smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(C)nn1C 732850888 NKIVHKLFZVOTDG-UHFFFAOYSA-N 433.420 2.308 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ncn(Cc2ccccc2)n1 737131601 QXWYWUUOUAVRJW-UHFFFAOYSA-N 436.541 2.135 10 20 IECD C[C@]1(C2CC2)NC(=O)N(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801442 ZJUYTGTYLMOTHQ-LHSJRXKWSA-N 436.459 2.094 10 20 IECD CCCOc1cccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743433128 XABWTMAXLHEKCQ-UHFFFAOYSA-N 440.544 2.361 10 20 IECD Cc1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(O)n1 744535761 JIFSTXTVLWGUPI-HUUCEWRRSA-N 431.464 2.322 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746010286 BLKOITCEZGUDHT-UHFFFAOYSA-N 435.521 2.478 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)c1 746036912 HFERBLIARPXDAV-UHFFFAOYSA-N 442.863 2.162 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccc(OC)cc1 746109150 KTGXVXWLDDISJB-UHFFFAOYSA-N 435.521 2.194 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccnn3Cc3ccccn3)CC2)cc1 746371954 LUOHKLLIGPRXCD-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cn2)C[C@H](C)O1 747017952 UVVQIKUYFOKKNO-IRXDYDNUSA-N 437.544 2.333 10 20 IECD CCC[C@H](C)NC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 747836021 YIMHIMPGWKWCKX-AZUAARDMSA-N 448.583 2.295 10 20 IECD COc1ccc(CCN2C[C@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc1OC 753640465 QTRMCXUSSXMFRU-CRAIPNDOSA-N 442.512 2.253 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4ccc(OC)cc4CC3)CC2)cc1 754074880 KROSBBQGFONWMU-QHCPKHFHSA-N 425.573 2.288 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)CC2)cc1 754127444 JCYZRJCCMFIRKS-VSKRKVRLSA-N 428.577 2.464 10 20 IECD COC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c(C(C)=O)c1 758230101 GKHLHQMFUCCNPO-FQEVSTJZSA-N 442.512 2.246 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccn(CCc4ccncc4)n3)CC2)cc1 759029527 BZICHBWOMVTCKU-UHFFFAOYSA-N 448.527 2.253 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](c4nccn4C)C3)cc2F)C[C@@H](C)O1 767114234 AEHJSPIDYDXZQF-ZIFCJYIRSA-N 429.540 2.279 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccccc3S(=O)(=O)CCN(C)C)c2)CC1 771635030 CTHQSVWQMNSIJS-UHFFFAOYSA-N 444.601 2.416 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN([C@@H]2CCOC2)CC1 773480413 CGGACDJLQDGETM-DLBZAZTESA-N 433.508 2.196 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Cc1ccccc1 774926878 XSAGIZXRUFYVIF-FCHUYYIVSA-N 439.556 2.189 10 20 IECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C[C@@H](O)C(F)(F)F 778202052 CMNLWYBGCXJOGS-QWQRMKEZSA-N 435.462 2.301 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H]3c3cn(C)nc3C)CC2)cc1 778326312 NGBRFNGIIWKPIE-NEQMZLFVSA-N 437.544 2.306 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]4CN(C)CC[C@H]43)CC2)cc1 779329963 HRZMYZISLWPFBP-NFBKMPQASA-N 429.609 2.333 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3ncsc3=O)c2C)c1 779367066 YMPPVAQZRHNLRF-UHFFFAOYSA-N 429.454 2.168 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-c4ncn(C)n4)c3)CC2)cc1 783613340 LXGJXQYJEBTZBT-KHPPLWFESA-N 446.511 2.334 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1 784024341 LKHHTORCPDGPOL-UHFFFAOYSA-N 438.528 2.157 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc(OC)c1OC 785479672 AFLMBYQERFTTGO-UHFFFAOYSA-N 427.501 2.245 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nc(N4CCCC4)ncc3Cl)cc2)CC1 786660458 XXARRIQJALDDSL-UHFFFAOYSA-N 442.951 2.329 10 20 IECD COc1ccc(C[C@H](C)CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788312260 FXYWYUJVBWQPNK-IBGZPJMESA-N 439.556 2.485 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(OCCN2CCCC2)CC1 788935765 FCFJVNWDYGHCPI-UHFFFAOYSA-N 428.577 2.006 10 20 IECD CC(C)(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789801438 SRVHNXBFKDOZQD-UHFFFAOYSA-N 434.537 2.349 10 20 IECD CCc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789825585 MYHCCJWDQXSCIQ-IYBDPMFKSA-N 428.508 2.329 10 20 IECD C[C@@H]1OCC[C@@]12CN(C(=O)c1ccc3c(c1[N+](=O)[O-])C(=O)c1ccccc1C3=O)CCO2 791887886 HWYOWRBQGLZUHQ-ZAMGYDSWSA-N 436.420 2.390 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 799254190 SXDWBJKBMLJOCS-FQEVSTJZSA-N 442.491 2.065 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1F 802550800 HHYNSBONVXOOAA-UHFFFAOYSA-N 447.438 2.437 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 803304958 GFUXJTOTIINDSO-WOJBJXKFSA-N 438.572 2.337 10 20 IECD C[C@H](O)C[C@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448578 CLQQVSTVDJXFTA-WMLDXEAASA-N 425.476 2.135 10 20 IECD C[C@H]1CN(CCCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CCCO1 807929923 FWKKGIASKXEQGN-FQEVSTJZSA-N 430.593 2.252 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc([C@@H]2CCOC2)cc1 815356060 BBNXQZWGAUPRMR-GOSISDBHSA-N 427.476 2.421 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)nnn1Cc1ccccc1F 815447640 WCKLLVIRFYHLGE-UHFFFAOYSA-N 436.491 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)CC2)cc1 817020988 PCGAXNIFCPSTTQ-CTDFXDFQSA-N 440.588 2.233 10 20 IECD CCCCN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)[C@H]1CCS(=O)(=O)C1 835861233 FKUNSVPMNPXQMO-NRFANRHFSA-N 438.590 2.216 10 20 IECD C[C@H](OC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(N)=O 913364035 VSEJISZLVYKZSM-OITNDJBGSA-N 429.317 2.067 10 20 IECD COc1ccc(-n2nnc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)c2C)cc1 915402617 GBWZGZJOVWZZLR-UHFFFAOYSA-N 437.500 2.466 10 20 IECD CCN(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCS(=O)(=O)C1 916633469 DKNVDAGKZDHRJQ-MRXNPFEDSA-N 449.495 2.261 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn(-c2ccc(Cl)cc2)nn1 918338183 WYOQFBMMXZIYPU-UHFFFAOYSA-N 445.932 2.086 10 20 IECD O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 919777289 HMSGXRQXDGUMAR-UHFFFAOYSA-N 437.949 2.450 10 20 IECD O=C(NCCCn1cccn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919783713 KBUCHFIHLXQDCY-UHFFFAOYSA-N 438.511 2.028 10 20 IECD COc1cccc([C@@H](CN/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)c1 920980390 LWHHFNASRQMJOC-XLXASQRYSA-N 430.574 2.205 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(C(F)F)n1 1798847331 SLVIXGLHDZBYDY-LJWNITHASA-N 448.426 2.360 10 20 IECD COC(OC)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803355322 NMCDAGLTUOVHDM-CXAGYDPISA-N 449.891 2.085 10 20 IECD C[C@H](Cc1ccncc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442149 ASNLPFWUZLSIBD-GOSISDBHSA-N 445.523 2.257 10 20 IECD Cc1cccn2ncc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)c12 1845708398 WIWDJKHUQZFISN-SOFGYWHQSA-N 448.479 2.290 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)n(C)c1 110358724 DXXCOXADOAUSCT-UHFFFAOYSA-N 448.589 2.463 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OCC(C)C 727178033 QULVIFHRVMODDT-YBEGLDIGSA-N 444.600 2.480 10 20 IECD COc1c(C)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1C 728015275 PAVLVNNRPXXFBX-UHFFFAOYSA-N 428.488 2.183 10 20 IECD Cc1ncccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 731093269 LSWKIZOPKZVULK-UHFFFAOYSA-N 427.482 2.485 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CNS(=O)(=O)c1ccc(Br)s1 734470650 FRJZCDMXSAURNK-UHFFFAOYSA-N 446.392 2.480 10 20 IECD CNC(=O)COc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC 735520382 ZLKDZXNOCBNOIB-GOSISDBHSA-N 428.485 2.347 10 20 IECD COc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)cc(NS(C)(=O)=O)c1OC 742597224 QXXCTHFFWKCJQL-UHFFFAOYSA-N 425.482 2.210 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)NC(C)(C)C 748042380 GSJDUXWSLJBFNB-NSHDSACASA-N 425.532 2.288 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN3C(=O)CC(C)(C)C)CC2)cc1 748230482 QSKMNEIUZLSRMV-NRFANRHFSA-N 430.593 2.361 10 20 IECD C[S@@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 752877482 CVADBJZOQIQCKL-YVGXBJCXSA-N 428.558 2.125 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(O[C@@H]4CCOC4)c3)CC2)cc1 754031700 WLQMRHZWZWKMCR-JOCHJYFZSA-N 440.544 2.200 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1 757831228 PYKSGAXASVDMRS-UHFFFAOYSA-N 432.546 2.184 10 20 IECD COC(=O)c1nccc2c(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cccc12 766319457 LHAUBYLRJYGDMH-UHFFFAOYSA-N 435.483 2.194 10 20 IECD CC(C)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1CCCCC1 767677356 YCCOZOXXWOBTPR-UHFFFAOYSA-N 448.583 2.343 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CCN3CCN(C)CC3)cc2F)C[C@H](C)O1 770345650 QVLQUEFUAMIFFO-QYZOEREBSA-N 435.588 2.265 10 20 IECD COCCc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n(C)n1 782423963 SAEWEITXSGIRTJ-UHFFFAOYSA-N 439.516 2.436 10 20 IECD CC(C)Cc1cc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)n(C)n1 783964748 CGWAIORVIZZGFO-UHFFFAOYSA-N 425.514 2.412 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H]1CCCCS1(=O)=O 784216376 RFGUMQACNYDEHF-INIZCTEOSA-N 449.495 2.309 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)n1 784768319 VYDPBVKTQJTVKX-HNNXBMFYSA-N 448.907 2.177 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)CC1 786122568 UBVXIDJQLWNUAA-UHFFFAOYSA-N 432.502 2.050 10 20 IECD CCN(Cc1ccccc1)S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786122575 UJZSHWUVPYYKJL-UHFFFAOYSA-N 430.574 2.212 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN(C(=O)NCC(C)C)C3)cc2)CC1 786656058 KCBVMNPGEJUVPF-NRFANRHFSA-N 443.592 2.049 10 20 IECD CC(C)Oc1ncccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 787985618 BQQHRYBLRYYIKR-QGZVFWFLSA-N 426.517 2.199 10 20 IECD CC(C)(C)c1nc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788311044 PPQQOQUYBCDVFR-UHFFFAOYSA-N 430.574 2.252 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(CCO)Cc3ccccc3)cc2F)C[C@H](C)O1 789812753 OMFHZNKLRPTHAY-ROUUACIJSA-N 443.519 2.077 10 20 IECD O=C(NCCCOc1ccc(F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789836702 VGSVUIBEVFXBRY-UHFFFAOYSA-N 447.482 2.127 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1 792350567 ZKRWZGDKYYWSTK-UHFFFAOYSA-N 432.480 2.361 10 20 IECD CC(C)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(=O)N1CCCCCC1 796603731 ZPWVBPJLOHBBCM-UHFFFAOYSA-N 448.583 2.392 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)ccc2Br)cc1 797431482 QDHDIQZKZGNUAP-UHFFFAOYSA-N 434.337 2.434 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccc(C)cc3)[C@@H](C)S(C)(=O)=O)nc12 797997749 QJROIKWCJZLHCY-AUUYWEPGSA-N 446.529 2.184 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2cccs2)C1)c1ccc(N2CCOCC2)cc1 803305117 JVESULYCIOXYSE-VQIMIIECSA-N 429.542 2.362 10 20 IECD Cc1nc2n(n1)C[C@@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CC2 804361962 NKSMBWLMQQGJFA-PBHICJAKSA-N 444.967 2.224 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3cnn(C(C)C)c3)cc2F)CC1 805009121 GXXZEPLYKKGAMW-QGZVFWFLSA-N 444.555 2.239 10 20 IECD Cn1cc(Br)cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1=O 807513586 QDBGSDPPZYJQIW-UHFFFAOYSA-N 449.088 2.415 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN3CCSCC3)cc2Cl)C1 807954974 JFIAQXRMTSFUIZ-INIZCTEOSA-N 439.025 2.358 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(NC(C)=O)ccc1NS(C)(=O)=O 808097160 SLVUVEROGQMFCJ-UHFFFAOYSA-N 426.491 2.138 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC[C@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc1 813562633 AEHKLBPUOVDGDE-SKPFHBQLSA-N 430.593 2.448 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccc(F)cc3)cc2)C1 919817311 VEQXHBREWISEPP-LJQANCHMSA-N 440.519 2.354 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)Cc3ccccc3)cc2)C1 920222471 UTVPOEOMTJMEHW-GMAHTHKFSA-N 448.567 2.238 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)c[nH]1 1318752306 NMGCSUOMBBFBIJ-UHFFFAOYSA-N 434.499 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nc4ccccc4n3C)CC2)cc1 1320144553 XFPKTISGERYEIH-QXMHVHEDSA-N 447.539 2.146 10 20 IECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c(=O)[nH]c1C 1794615084 WYYXSKLNJYJQGN-BTTYYORXSA-N 446.891 2.017 10 20 IECD Cc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)nn1C 1800712660 PBERIIJBNXUSBR-RBVVOMGSSA-N 432.908 2.288 10 20 IECD CC(C)/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823089351 PPNYEZXJYJWYMQ-UZYOAWRESA-N 435.575 2.474 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cc(C)nc(C(C)C)n4)CC3)nc12 107657443 FBCFKYBBJYMAAY-UHFFFAOYSA-N 439.520 2.156 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(CC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1 728932365 MWUXOJOXEMTBHJ-OAQYLSRUSA-N 440.588 2.436 10 20 IECD COC(=O)c1c(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[nH]c(C(C)=O)c1C 735828853 RWSIKKNWYBSQRS-UHFFFAOYSA-N 441.528 2.380 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1C 737168021 XIONKHGBMHAEBM-UHFFFAOYSA-N 444.557 2.394 10 20 IECD CC(C)CC(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 749197830 LZLYCMOUFQIPHZ-IBGZPJMESA-N 443.592 2.225 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C[C@H]2CCOC2)CC1 749852434 FSUPMOSWTUYMIO-ZWKOTPCHSA-N 447.535 2.443 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCS(=O)(=O)C1 764215775 LABILZSPLFLYCK-CQSZACIVSA-N 449.495 2.118 10 20 IECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cccc2nonc12 765036331 LXAFGGJYTHXXIX-UHFFFAOYSA-N 436.515 2.005 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3nc(O)c4sccc4n3)CC2)cc1 767961480 ZNSDBAMAFCUAPO-QGZVFWFLSA-N 443.573 2.020 10 20 IECD CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769860771 YUMRCFVMZBBODM-LJQANCHMSA-N 429.539 2.433 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CCc3ccco3)cc2F)CC1 775219789 MDSDSHASFNNHJI-QGZVFWFLSA-N 430.524 2.314 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3cccc(N4CCOC4=O)c3)nc12 775264348 YTIVUSJHLYCQKA-CYBMUJFWSA-N 425.445 2.419 10 20 IECD COC(=O)[C@@H]1C[C@@H](OC)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778236384 ZPRQBIBLXJCMJR-LIRRHRJNSA-N 436.464 2.053 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br 779460155 KWANVGORJNCSIL-UHFFFAOYSA-N 442.247 2.324 10 20 IECD CCn1c(O)nc2cc(C(=O)Nc3cccc(N4CCN(C(C)=O)CC4)c3)ccc2c1=O 781274716 BJXZEDMOBXCWHO-UHFFFAOYSA-N 435.484 2.043 10 20 IECD O=C(OCCC1OCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397557 ADOGKIQPQZOXKK-UHFFFAOYSA-N 438.414 2.021 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccsc4n3)cc2F)C[C@H](C)O1 785583248 KADWBIKDSVPPMN-KBPBESRZSA-N 445.520 2.081 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)cc2)CC1 787322789 SXUNJVSSMRLEMI-QFIPXVFZSA-N 438.503 2.164 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1 789798865 FCQBDXUWSZKACE-GOSISDBHSA-N 443.519 2.248 10 20 IECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccco1 789824830 KBXYJOJMEWMNOR-RVKKMQEKSA-N 433.480 2.152 10 20 IECD Cc1cccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789833700 IOKNLUVGVKTYLJ-KRWDZBQOSA-N 443.519 2.295 10 20 IECD CC(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789837346 YZJAMXNGDZPLLI-UHFFFAOYSA-N 434.537 2.299 10 20 IECD CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 791915428 ZRNZSNVLVUVLDL-AWEZNQCLSA-N 439.515 2.374 10 20 IECD COc1ccc(CNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N2CCOCC2)c(O)c1 792788351 BVUIVHVUOWCMTQ-IBGZPJMESA-N 445.516 2.291 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(=O)c2ccc(F)cc2o1 795367590 PUDSFOAJGPEEDN-UHFFFAOYSA-N 430.457 2.097 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCOC3CCCC3)cc2F)CC1 804019708 LVGBQLFCHXIZBU-UHFFFAOYSA-N 434.556 2.049 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccn(-c4ccccc4)n3)CC2)cc1 804106448 LAFARNNOLMQPRF-UHFFFAOYSA-N 447.539 2.325 10 20 IECD COc1ccc(N2CCCN(C(=O)NC[C@@H](N3CCOCC3)C(F)(F)F)CC2)cc1 805844302 HFSDYHKAWQINHC-GOSISDBHSA-N 430.471 2.180 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 806546432 RCOZPUXKYYCZSI-UHFFFAOYSA-N 436.509 2.234 10 20 IECD COc1ccc(CN2CC[C@H](NCc3ccc(N4CCOCC4)cc3)C2=O)c(OC)c1 808424124 RECSQZXZAJUSEZ-QFIPXVFZSA-N 425.529 2.431 10 20 IECD Cn1nc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C1CC1 810397147 UCQDZIONQYTCPA-MRXNPFEDSA-N 431.924 2.376 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 812491715 YJEGALZGBUEOKH-UHFFFAOYSA-N 426.583 2.418 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@]3(C)Cc4ccccc4C(=O)O3)CC2)cc1 843443863 YTUVKEVPHHTPFX-RUZDIDTESA-N 437.540 2.495 10 20 IECD CCCC(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 917055567 OWBCMTYSPANLAP-QZTJIDSGSA-N 448.583 2.436 10 20 IECD CS(=O)(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918202568 VIDABVILGXQZLM-UHFFFAOYSA-N 436.509 2.033 10 20 IECD O=C(CN1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1)NC1CC1 918306724 FXKHOYZHDPXSRZ-UHFFFAOYSA-N 434.500 2.463 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1 918434373 MVCIZQITRXWFGZ-UHFFFAOYSA-N 436.512 2.437 10 20 IECD C[C@@H](NC(=O)c1nc(S(C)(=O)=O)n2ccccc12)c1ccc(N2CCOCC2)cc1 921166210 LGCDZGRNIWLIET-OAHLLOKOSA-N 428.514 2.065 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777852179 WWVWXDCVILGELU-OMXJDXKCSA-N 443.500 2.092 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)cc1F 1777852259 LQZUJVVSSAJAEA-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2 1782003133 CSXLDZSZEGBSSO-MRXNPFEDSA-N 440.777 2.095 10 20 IECD Cc1cccc(Cl)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787294551 XODUFYBHCRLNCQ-QRTARXTBSA-N 445.903 2.362 10 20 IECD CC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787693052 NVSKZHOSGRIGDM-UHFFFAOYSA-N 433.555 2.350 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2nccc12 1800995906 NZXWUUGOTPNPAM-BJKLQHCMSA-N 448.479 2.416 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nn[nH]c2c1 1801203235 RBOOXNQDLGAFMB-AKNOBNDCSA-N 449.467 2.040 10 20 IECD CCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806028388 AEOMXHVMJXGNBJ-VBKZILBWSA-N 437.456 2.072 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1807993984 BLEULKJOBSXRBM-HNAYVOBHSA-N 437.456 2.126 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(F)cn1 1816587223 RZXIKVBXDJHGHJ-OAHLLOKOSA-N 426.408 2.370 10 20 IECD COc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1821918071 NDYJUXOHWAPJPR-LBPRGKRZSA-N 440.481 2.498 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3ccc(Cl)cc3nn2)C1 1843293223 JURKTTASYHIXJT-UHFFFAOYSA-N 439.859 2.220 10 20 IECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)C1 303346370 MRAVNHRGIBOUEU-RBBKRZOGSA-N 443.636 2.024 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(OCC(=O)NC)cc2)cc1 729785715 KKZFBYQOZSWBSQ-UHFFFAOYSA-N 426.517 2.255 10 20 IECD COc1cccc(CNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)c1O 729858682 BAOCXMFLDUDEBM-UHFFFAOYSA-N 428.304 2.395 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](O)COc3cccc(F)c3)cc2F)CC1 730133387 QCIMSOWIYQLBRN-LJQANCHMSA-N 448.514 2.346 10 20 IECD CCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 730235584 HEBJCWNCYPSWRL-UHFFFAOYSA-N 448.564 2.196 10 20 IECD CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)ccc1=O 732372809 YXFQBYZNTZKDPD-UHFFFAOYSA-N 437.452 2.497 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3CCN(CC(F)(F)F)CC3)CC2)cc1 742920756 SGKQRDZHXOMQQD-UHFFFAOYSA-N 428.499 2.208 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(OCC(F)(F)F)c3)nc12 745112820 WQOKWFKFLYLVOV-UHFFFAOYSA-N 440.334 2.305 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(OCc4ncnn4C)cc3)ccc21 746654949 OFUCWWMSDWWXFN-UHFFFAOYSA-N 427.530 2.255 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CNC(=O)OC(C)(C)C 749872925 XSRJRJLLEYCQOV-SJLPKXTDSA-N 447.580 2.348 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4ccsc4)CC3)CC2)cc1 753993030 CDKAAONVXOFHFR-JOCHJYFZSA-N 430.618 2.057 10 20 IECD NS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)cc1 756175515 VZUFTUCARDDKRN-UHFFFAOYSA-N 431.514 2.340 10 20 IECD C[C@H]1C[C@H](NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c2c(O)ccc(F)c21 756442448 QCIZWXCEHKYVSI-RDJZCZTQSA-N 434.537 2.216 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3[N+](=O)[O-])cc2F)CC1 759022493 GKJSVIFZNJNIIN-UHFFFAOYSA-N 436.509 2.495 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)N1CC[C@H](CO)C1 759700606 DDELZWRPGIGPNT-FUEWVNAISA-N 441.372 2.491 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cc(-n4cnnn4)ccc3Cl)CC2)cc1 760807452 OHDYDYFVZZHSNM-UHFFFAOYSA-N 427.896 2.085 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O 764894411 HSPNWFJTKGHCSR-FQEVSTJZSA-N 436.512 2.031 10 20 IECD COC(=O)c1sc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c(C(=O)OC)c1C 766048335 RMRMBXXGWNNBPH-UHFFFAOYSA-N 427.456 2.339 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)ccc1OC 766199754 HPBWSTVAHUZKSX-UHFFFAOYSA-N 430.276 2.428 10 20 IECD C[C@@H]1CN(c2ccc(CNc3cc(N4CCN(C)C(=O)C4)ncn3)cc2F)C[C@@H](C)O1 768495279 YFUVGZCORMYBHO-HZPDHXFCSA-N 428.512 2.120 10 20 IECD COC(=O)c1ccnc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 770681798 OCFFQHUFLZDNKQ-UHFFFAOYSA-N 427.505 2.211 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(F)(F)F)cn3)cc2)C1 772946509 OMURCCNKMZHBCA-AWEZNQCLSA-N 449.433 2.057 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H](NC(N)=O)c1cccs1 777828137 IKGFNYILSHTLEV-ZDUSSCGKSA-N 425.894 2.408 10 20 IECD CCC[C@H](C)NC(=O)[C@@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779222175 WDOAEJGJAVLUSU-XJUOHMSHSA-N 446.636 2.195 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)[C@H](C)O)cc1 779498051 HOOGWKDAHPEPPG-HTAPYJJXSA-N 445.585 2.280 10 20 IECD C[C@@H](OC(=O)c1cccc(C(N)=O)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781725819 CFVAFCGDDSZXGI-GFCCVEGCSA-N 443.415 2.140 10 20 IECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1 784105682 GTUQKTVDAKUZFR-UHFFFAOYSA-N 449.511 2.483 10 20 IECD COC(=O)COc1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cc1[N+](=O)[O-] 788691502 XWRSGGMIDYXXPC-JYRVWZFOSA-N 440.455 2.213 10 20 IECD CO[C@H](CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(F)(F)F 789823070 YMJRUOZXKILNNO-GDZNZVCISA-N 449.445 2.139 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](c4cc[nH]n4)C3)cc2F)C[C@@H](C)O1 789827223 RVCGRMJDDNFIMO-NUJGCVRESA-N 443.523 2.185 10 20 IECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951340 VUMYMFMLEQQCOI-KRWDZBQOSA-N 443.466 2.186 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803297829 HQWJRBVSTWKFSH-FPOVZHCZSA-N 436.556 2.486 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2CN2CCOCC2)cc1F 804852182 CCPPAOCRSAONKL-LJQANCHMSA-N 434.556 2.001 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(Cc4ccncc4)CC3)cc2)CC1 805023521 IPJBZPJRFFDRNM-UHFFFAOYSA-N 435.572 2.279 10 20 IECD CCN(C)C(=O)OC[C@@H]1CCCCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 805762101 NJNSWSXSOGQVNQ-VXKWHMMOSA-N 448.608 2.121 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(CCCN2CCOCC2)CC1 807103223 LYDMWDAZLXSBTA-UHFFFAOYSA-N 430.593 2.028 10 20 IECD CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 818789914 LOMDCLZGXADSSS-UHFFFAOYSA-N 447.498 2.395 10 20 IECD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915699455 FRNWYHUOVFZTKH-QFIPXVFZSA-N 438.507 2.400 10 20 IECD O=C(CN1C[C@H]2CN(c3ccccc3)C[C@@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917080423 KQPFEKHEUMFSBA-SFTDATJTSA-N 438.547 2.347 10 20 IECD Cc1ccccc1[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(N)=O 917834839 RHQBSSCAXLINOQ-GHTZIAJQSA-N 437.544 2.113 10 20 IECD CCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918118284 XXSGAVQVBHHSRG-HXUWFJFHSA-N 443.592 2.226 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 918283134 DRUUXYIJKQCUHW-UHFFFAOYSA-N 432.427 2.015 10 20 IECD CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 918285684 BBCRHWYVHXCYPQ-UHFFFAOYSA-N 442.491 2.492 10 20 IECD CN1CCN(Cc2cccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)c2)CC1 920189700 ORBFBYCZGWLFOU-UHFFFAOYSA-N 435.572 2.289 10 20 IECD CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)no1 1782007576 UPUOJGMUSIHXMQ-HXUWFJFHSA-N 435.864 2.059 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1[C@H]2C=CS[C@@H]21 1796934720 HCVWMHROGRVWRZ-VDRHBUIISA-N 436.537 2.293 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997872 GCXYMVHNOJNQGC-AJRGADBESA-N 434.855 2.132 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2nccc3occc23)C1 1843159557 VKUHAGRWGDZXCX-HWKANZROSA-N 435.436 2.475 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN([C@H](C)C(=O)NC4CC4)CC3)ccc21 484907448 SBXYPFDMQWVGTJ-GOSISDBHSA-N 426.561 2.329 10 20 IECD CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727993301 WQONYDDGXZSPBG-HKUYNNGSSA-N 432.590 2.096 10 20 IECD NC(=O)[C@@H]1c2ccccc2CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 730809444 XLUUKRXUFYBMNX-QHCPKHFHSA-N 439.471 2.485 10 20 IECD CCCc1nnnn1CC(=O)c1cc(C)n(-c2cc(C(=O)OC)cc(C(=O)OC)c2)c1C 731565814 DOLIQRPXTNBEAW-UHFFFAOYSA-N 439.472 2.489 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CCNS(=O)(=O)c1cccnc1 743808080 PCBFNJGLMNNYTA-UHFFFAOYSA-N 442.335 2.267 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N(C1CCCCC1)[C@H]1CCS(=O)(=O)C1 746497550 PEQKHULAGPLQAZ-IBGZPJMESA-N 435.590 2.300 10 20 IECD CCCCN(C)C(=O)C1CCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754008855 WMBYDLUUJFDOCI-QHCPKHFHSA-N 446.636 2.149 10 20 IECD CCOC(=O)C(C)(C)n1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 766154109 IVIAHAHBDXFMAB-UHFFFAOYSA-N 433.484 2.479 10 20 IECD O=C(O)[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 769523567 ZUDGSIBRGJAMCW-OQZOHAQUSA-N 426.541 2.042 10 20 IECD C[C@H](NC(=O)N1CCC[C@H]([C@@H](O)c2nccn2C)C1)c1ccc(N2CCOCC2)cc1 769976842 ABVZKHLEMOCHJM-HFSMHLIXSA-N 427.549 2.473 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 776819446 APUCAQILXOHMPM-JAXLGGSGSA-N 448.608 2.025 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 781443299 MIEDDURXGWWCKZ-UHFFFAOYSA-N 429.473 2.154 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1 781823397 JOMQQYWWBRDZJS-XMMPIXPASA-N 438.572 2.431 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1F 787102973 HSDIUTAXHVWDOV-IBGZPJMESA-N 434.556 2.048 10 20 IECD O=C(NCCc1csc(N2CCCC2)n1)C(=O)NCc1ccc(N2CCCC2)cc1 788937892 OAJLFGNSUNPQGZ-UHFFFAOYSA-N 427.574 2.319 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789820421 QPAAWAYRAHPPAN-IRXDYDNUSA-N 445.539 2.109 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]1c1cccnc1 789844430 SCFGMNPXFHUJFV-FQEVSTJZSA-N 426.492 2.162 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc3nc(Cl)sc3c2)ccc1O 790408390 XSZIJLJXFBUOOO-UHFFFAOYSA-N 433.920 2.364 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)N3CCC[C@H](C)C3)CC2)cc1 793913179 QHBFFOMRNPUJQE-IBGZPJMESA-N 430.593 2.361 10 20 IECD COc1cc(N2CCN(CCc3c(C)nc4sccn4c3=O)CC2)cc(OC)c1OC 796006979 YHDQDRKMABDZEZ-UHFFFAOYSA-N 444.557 2.455 10 20 IECD Nc1ccccc1CCCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 798682118 AWTBAYBHNIVLMP-UHFFFAOYSA-N 429.492 2.427 10 20 IECD CS(=O)(=O)N1CCC(N(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC(F)F)CC1 802658366 WWSIKFDHTWFTSZ-UHFFFAOYSA-N 427.857 2.445 10 20 IECD CCN(C[C@@H]1CCOC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449290 UYCGKJRQAUVERI-HNNXBMFYSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc([S@](C)=O)cc3)CC2)cc1 804318140 APKZFYGFOUZAHA-HKBQPEDESA-N 443.569 2.176 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@H](C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 810015135 IURMDNMAJDAVJL-KSMMKXTCSA-N 434.512 2.022 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CC(=O)N(c2ccccc2F)C1 812877294 WAESRHCIYFXRSI-MRXNPFEDSA-N 430.455 2.406 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 815152932 AYHZFSYOKBJBCR-NJYVYQBISA-N 425.529 2.211 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1nc(S(C)(=O)=O)ncc1C 816940867 OJNVRYPSZRQVLH-UHFFFAOYSA-N 428.308 2.319 10 20 IECD COCC1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCOCC1 817227169 UEDRIHQZCRMGGW-UHFFFAOYSA-N 426.516 2.180 10 20 IECD Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 914688802 XMLLGQJOSYTKMS-UHFFFAOYSA-N 434.879 2.225 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](c3ccco3)N(C)C)CC2)cc1 915896810 LNEMKPYLCWAVAI-OAQYLSRUSA-N 429.565 2.402 10 20 IECD O=C(COC(=O)CCn1ccccc1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919254409 IZHLMUIGBRYTBA-UHFFFAOYSA-N 430.416 2.196 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)cc1 1253403368 FTERIUPQWOFFOX-UHFFFAOYSA-N 434.540 2.377 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 1317793396 OAFFVAMGOCOYQY-UHFFFAOYSA-N 444.399 2.439 10 20 IECD CCOc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3S(C)(=O)=O)CC2)cc1 1336412305 ASRUSKSMGSCNEN-UHFFFAOYSA-N 438.571 2.219 10 20 IECD C[C@@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)CC1(F)F 1792156856 DWAWKLFBPILXLB-JCTLKHEBSA-N 444.862 2.390 10 20 IECD COC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314712 QBHUORQLBDJYHI-CYBMUJFWSA-N 435.571 2.263 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1CCCSC1 1802056421 IOHPBBILZGSTDF-DPYKFYPSSA-N 440.949 2.098 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cc(Cl)cnc3O)C2)CC1 1804702694 FYWSKEKXMXYIPK-UHFFFAOYSA-N 446.891 2.405 10 20 IECD CC(C)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1810433133 LOWHAGSJODTOFF-KKVAFCGZSA-N 428.489 2.021 10 20 IECD CCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816560103 ATNAYMJPQWCXTC-CQSZACIVSA-N 425.449 2.052 10 20 IECD CCn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cc1C 1816724867 BLBGEALIJYCTFX-LBPRGKRZSA-N 442.501 2.014 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C1=COCC1 1822984919 MNKXTYGMQVUUBS-LJQANCHMSA-N 448.483 2.499 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427116 PNWDJJNPQWSYJO-VQIMIIECSA-N 441.532 2.259 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)COc2ccc(O)cc2)C1 1841222478 RMBHPOSFFIPROR-UHFFFAOYSA-N 432.860 2.353 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C1 1841396939 GHRCNEHDWMZCFB-HUUCEWRRSA-N 429.423 2.392 10 20 IECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccccn1 1843442239 IHENTOFNNNXEIS-QGZVFWFLSA-N 431.496 2.181 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)n(C)c2ccccc12 555682036 HUMNOTGMZAUPRF-FQEVSTJZSA-N 434.540 2.120 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726727064 SVEDCACMHGJNSU-UHFFFAOYSA-N 446.454 2.371 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CC(=O)N(C3CC3)C2)NC(=O)OC(C)(C)C)cc1 742755024 UNNHCAGOSTUMHL-LPHOPBHVSA-N 430.549 2.446 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)CC2)cc1 742917549 ZQGHBPXFAXPFIX-JOCHJYFZSA-N 440.519 2.126 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(Cc4ccccn4)c3)cc2)C1 746728484 PFYLAOBKTUBXJQ-GOSISDBHSA-N 433.516 2.350 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 747686959 WITKXHZVKDPHPN-UHFFFAOYSA-N 438.444 2.057 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)CC(C)(C)O)CC2)cc1 754226124 OMNHXIQTSVYBIC-HSZRJFAPSA-N 427.589 2.451 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCC[C@@H]3CO)c2C)c1 754638430 BCWHGSPOZPFCPI-GOSISDBHSA-N 428.485 2.307 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C(C)(C)CNC(=O)OC(C)(C)C)CC2)cc1 757169882 BIKDSIUJZIPCDK-UHFFFAOYSA-N 449.548 2.438 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCCc4c3cnn4C)CC2)cc(OC)c1OC 759222587 UXCMRMUMJIKEQE-QGZVFWFLSA-N 429.521 2.355 10 20 IECD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771067753 VPQFZRHYLDJWCR-QGZVFWFLSA-N 446.891 2.464 10 20 IECD COC(=O)COc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1Cl 771657486 AIACQLHPFQHMIR-UHFFFAOYSA-N 428.850 2.221 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 773744231 QDTAVJLNGNPKNK-HOCLYGCPSA-N 436.505 2.385 10 20 IECD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 773829077 ZBJIAVPLCVVZJK-OLZOCXBDSA-N 427.523 2.282 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc4c(=O)n(C)c(S)nc4c3)c2)CC1 781268405 IJJPERUGZCDCIQ-UHFFFAOYSA-N 437.525 2.143 10 20 IECD COc1ccccc1[C@@H](CO)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782064306 RTXIVICGYPTDPX-LLGFUMIMSA-N 445.535 2.387 10 20 IECD Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 782166012 DREZIFUPWIAZAD-UHFFFAOYSA-N 425.367 2.357 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CCCCS3(=O)=O)cc2F)C[C@@H](C)O1 784222701 NJSXAWNLDYUONY-UXLLHSPISA-N 427.542 2.206 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)N(C)C)cc1 789810547 BCVWBQVXJCEMFM-JOCHJYFZSA-N 442.535 2.006 10 20 IECD CC(C)(C)OC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789853871 AGXYSWNRCULRKZ-KRWDZBQOSA-N 433.574 2.046 10 20 IECD O=C(OCc1ncnn1CCF)c1cc(NS(=O)(=O)c2cccs2)ccc1O 801321467 BGAGWAWSFRYZGK-UHFFFAOYSA-N 426.451 2.173 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 803242631 YLDIOWSVKCZZDT-OAHLLOKOSA-N 443.013 2.369 10 20 IECD CC(C)[C@H](CO)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 805310812 PLOXDOJJIZFMHM-ZDUSSCGKSA-N 437.474 2.096 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H](C)C[C@H]3C)CC2)cc(OC)c1OC 806192035 PSHMDMVSQSHFQB-LZLYRXPVSA-N 433.549 2.302 10 20 IECD COCc1cnc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 807010078 VMNRBEKXRKXSBY-CQSZACIVSA-N 438.937 2.368 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 810165456 SULANBFPZVCHJG-QFIPXVFZSA-N 441.576 2.008 10 20 IECD CS(=O)(=O)C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 816891264 NGVXYVUIQRHQGV-LJQANCHMSA-N 434.533 2.231 10 20 IECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)c1 817994605 YXMSYBZAHRMXQS-UHFFFAOYSA-N 437.524 2.193 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@]1(N2CCOCC2)CCSC1 916624728 NTQHBDXOUSGGMJ-OAQYLSRUSA-N 436.647 2.247 10 20 IECD CN(C)C(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918201290 IKAXQUWDVPUTEN-UHFFFAOYSA-N 428.508 2.488 10 20 IECD CCCNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918310683 NTQBHWFVJMAEIN-UHFFFAOYSA-N 438.528 2.260 10 20 IECD COC(OC)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781752361 MIKAKLWUSTYLOR-XMMPIXPASA-N 441.528 2.157 10 20 IECD CN(C)c1c(F)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1F 1796604177 LPSOTMASPZUPSV-QDMKHBRRSA-N 446.454 2.403 10 20 IECD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccc1 1801257638 YFCAIVWOCUUAIP-FRQROOTJSA-N 433.892 2.017 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/C2CC2)[nH]n1 1823496923 RGFWRFBELMPLGV-UZYOAWRESA-N 433.559 2.228 10 20 IECD CCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1826091909 WWIKRKCKUBREHG-SFHVURJKSA-N 427.505 2.256 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1845789852 DGAKJFBEDRCBNX-NSHDSACASA-N 426.853 2.130 10 20 IECD COCCCNC(=O)CN(C)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 105149935 USNGYJQVUOKSAK-UHFFFAOYSA-N 429.517 2.133 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@H]3Oc4ccccc4NC3=O)cc2F)CC1 730193088 DJSSSDPIFQUANF-OAQYLSRUSA-N 426.492 2.374 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 742805606 MXAKTDXHGDLZGX-LLVKDONJSA-N 431.486 2.396 10 20 IECD CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 743887321 JBBYWUQIMYPVJB-UHFFFAOYSA-N 449.504 2.464 10 20 IECD CC(=O)N1CCN(C(=O)CCNC(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 745830226 MMHNAIOBETYVCW-UHFFFAOYSA-N 430.549 2.317 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 747251715 AQLPXQPBPKOUJU-OAHLLOKOSA-N 434.514 2.358 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 751138149 ZXMUSEKHECNPPZ-QGZVFWFLSA-N 426.535 2.324 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c([N+](=O)[O-])c1 754040268 LNGFCVYTQZAXRD-UHFFFAOYSA-N 425.438 2.262 10 20 IECD CCOC(=O)c1cc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1C 759505451 VDHGIIAJOXTJMS-INIZCTEOSA-N 427.505 2.225 10 20 IECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1 763692211 SPCWBKHJLMNDKV-UHFFFAOYSA-N 427.530 2.272 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 766845662 HGZHNJOUTOLGHP-LJQANCHMSA-N 432.565 2.192 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 772996175 CETHYTINJQKBRN-KBXCAEBGSA-N 433.578 2.371 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CNS(=O)(=O)c1ccccc1N 774427745 CFSXKBBTDZZAMT-UHFFFAOYSA-N 442.335 2.064 10 20 IECD CC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)nc1C 777107185 DTCOPJVRWBCSKT-UHFFFAOYSA-N 443.475 2.350 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 778298706 RGZYUNYHSODDHQ-BLIJAFNYSA-N 441.532 2.458 10 20 IECD CCc1ccc([C@H]2COCCN2C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)o1 779222460 OESPBDJZNCNELL-NZQKXSOJSA-N 429.561 2.407 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 784028655 UIKWEKXOLQEOGC-UHFFFAOYSA-N 438.528 2.438 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1 785296256 MXNOMAXMAIXTHL-XGCHSQQGSA-N 430.404 2.411 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c([N+](=O)[O-])cc1OC 786657435 XYFQMGKVGCCVCR-UHFFFAOYSA-N 442.472 2.211 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(O)cc3)cc2F)C[C@@H](C)O1 789821334 RZUKHZATIIUOLP-IYBDPMFKSA-N 429.492 2.420 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H]1C 789826383 PUVKZRWOBIYVJD-XSYGEPLQSA-N 448.583 2.387 10 20 IECD C[C@@H]1COc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789846011 YOVWFROEWPSTBV-MRXNPFEDSA-N 441.503 2.213 10 20 IECD CC(C)[C@H](NCc1cc(Br)ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 793247585 RDDMTRMGEDAQJQ-SFHVURJKSA-N 436.354 2.465 10 20 IECD Cc1cccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 793727898 WDVQYYVIZKDCBK-FCHUYYIVSA-N 448.567 2.329 10 20 IECD Cc1ccc(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 793732607 JMCJMOYCKNOVMR-CRAIPNDOSA-N 442.585 2.122 10 20 IECD O=C(O)c1cc(I)cc(NS(=O)(=O)c2cccc3nonc23)c1 795365390 KKHGZTXMHBSSLP-UHFFFAOYSA-N 445.194 2.326 10 20 IECD COCCN(Cc1ccccc1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803307160 XROIMDYKMWWSRS-LJQANCHMSA-N 425.529 2.376 10 20 IECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803308092 SWBPUXAPBNCROI-JXFKEZNVSA-N 439.512 2.349 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 803400322 DAFBDLGFCSRXND-JOCHJYFZSA-N 442.535 2.040 10 20 IECD CCOc1ccc(S(=O)(=O)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 806585971 CWPUVYYNORCOEI-UHFFFAOYSA-N 436.505 2.151 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807671180 LVUSYGCJZYGFPC-MRXNPFEDSA-N 427.501 2.334 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1C 815404795 XFPMYWAQCJYMCK-UHFFFAOYSA-N 446.415 2.383 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2)c(C)n1-c1ccccc1 915749381 UNSYSNHLUXSZBG-UHFFFAOYSA-N 434.496 2.256 10 20 IECD O=C(CN1C(=O)COc2ccc(Cl)cc21)NCc1ccc(N2CCOCC2)c(F)c1 917708137 HHHSTHGOENHUHY-UHFFFAOYSA-N 433.867 2.358 10 20 IECD O=C(NCCc1ccccn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919785292 WWJVLDIBFRRYPI-UHFFFAOYSA-N 435.507 2.379 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n(C)c1 920880456 ALCRDWBCNVMUGG-QGZVFWFLSA-N 448.589 2.383 10 20 IECD NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 920938335 LRZHBWNMLYMLBL-QFIPXVFZSA-N 437.544 2.295 10 20 IECD CC(C)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007290 OUOSUGDWHQKCMG-XCLFUZPHSA-N 426.897 2.008 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ncc[nH]2)cc1 1794504108 YHERMUNJIILPKN-CEQLMSFQSA-N 433.512 2.334 10 20 IECD O=C(COc1ccccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806467185 AABGEGSMHPFTHZ-HXOBKFHXSA-N 448.479 2.286 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)[C@H]3CCCO3)C2)CC1 1810219295 AELRXMJSMWRKLI-SUQGKYDKSA-N 430.501 2.227 10 20 IECD C[C@H]1CCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987038 BJYKTVYEQCVTPA-KXBFYZLASA-N 430.549 2.114 10 20 IECD O=C(COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)NCC(F)(F)F 20816779 WIGWFBOZDVTLRK-UHFFFAOYSA-N 436.298 2.206 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)cc1 195680886 BPNIMDIRYJVYGY-UHFFFAOYSA-N 436.556 2.416 10 20 IECD Cc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 732247643 JSETZSRGQDTMBE-UHFFFAOYSA-N 428.508 2.324 10 20 IECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 734501592 HSSABXFEPBPAPF-UHFFFAOYSA-N 437.587 2.324 10 20 IECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 736837508 WWICWBIMHHIMFX-UTKZUKDTSA-N 432.565 2.474 10 20 IECD O=C(Nc1ccc(-n2cncn2)c(F)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 737110547 FFUBOGQKNLLENB-KRWDZBQOSA-N 439.447 2.258 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 737116714 IYQUPGGMBTXRCR-UHFFFAOYSA-N 428.445 2.419 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)NC(=O)OC(C)(C)C)cc1 742748981 BXWWXBUFUGACLM-KRWDZBQOSA-N 432.481 2.240 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(CCN2CCOCC2)cc1 743955420 JGVKGHMDXWQLAL-UHFFFAOYSA-N 437.540 2.401 10 20 IECD CCN(CC)c1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1 747644707 BHHJFPXQQLGXRK-UHFFFAOYSA-N 447.605 2.292 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cccc(CS(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 749404314 JJIXDYLGRPZZSB-GASCZTMLSA-N 435.521 2.158 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 750255431 KTVQIJZBAOVWGS-CYBMUJFWSA-N 429.473 2.317 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 761750289 LTALVCXSWIUWHO-UHFFFAOYSA-N 436.490 2.189 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1 762091232 GDBOKMFWWSXCOP-SFHVURJKSA-N 432.540 2.377 10 20 IECD C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 771418933 TZRQDUQQDFFMKX-HXUWFJFHSA-N 435.839 2.016 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccccc3S(=O)(=O)N3CCCC3)ccc21 772561590 QKJMFRCKPHDJGJ-UHFFFAOYSA-N 449.598 2.332 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773617363 DDUBDELLGCPCSC-LSDHHAIUSA-N 447.561 2.048 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cnn(CC(F)F)c3)cc2F)C[C@@H](C)O1 777899445 YLDHFCFHBLBENJ-CHWSQXEVSA-N 432.468 2.379 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CC23CCOCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 786445956 VWDHCTAIZWNIOV-LJQANCHMSA-N 446.525 2.284 10 20 IECD C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 787330216 VAMRYFXMUGYNAQ-OXFYSEKESA-N 438.528 2.037 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(CN4CCCC4=O)cc3)ccc21 787435436 XTNDTWFUPZWSRV-UHFFFAOYSA-N 434.540 2.124 10 20 IECD CCCc1csc(NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)n1 789356144 GNSCIFPMONUGIE-UHFFFAOYSA-N 445.589 2.371 10 20 IECD CCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789826215 OZUBZIYBWDBCGK-IAGOWNOFSA-N 428.508 2.499 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1 789841104 RPYKBONENQOHEZ-UHFFFAOYSA-N 429.492 2.036 10 20 IECD C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccc(N2CCOCC2)cc1 803298122 PGELJNRGZOKLJK-FQEVSTJZSA-N 430.593 2.473 10 20 IECD CCCn1ccnc1CCCN(C)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315411 KJHSPMFYKWYNJZ-UHFFFAOYSA-N 441.576 2.478 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(CN4CCCC4)CC3)CC2)cc1 804318453 KMLFQXCFDCCSHK-UHFFFAOYSA-N 428.577 2.115 10 20 IECD Cc1cc(N2CCC(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)CC2)n[nH]1 809678750 NSHHMOQFLJYQGH-UHFFFAOYSA-N 426.565 2.306 10 20 IECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 813656390 XGENWAULEREGNE-INIZCTEOSA-N 448.541 2.496 10 20 IECD Cc1cc(C(=O)O[C@H](C(=O)N2CCC[C@H](C(N)=O)C2)C(C)C)c(C)n1-c1ccccn1 914903371 LTARHHUQPPJHJY-PXNSSMCTSA-N 426.517 2.394 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccccc4C3=O)cc2F)C[C@@H](C)O1 917714991 XWLDQNCROQBVEI-GASCZTMLSA-N 425.460 2.352 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918308054 DBQJTRFGXUBNBI-UHFFFAOYSA-N 428.445 2.037 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCN(C(=O)NCC(C)C)C1 1320150713 YZBOKEVIJPSHQT-ROUUACIJSA-N 449.548 2.156 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1 1320385354 HWGKNMHXLBIZNL-AWEZNQCLSA-N 441.889 2.059 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(c2ccc(C)cn2)CC1 1324121028 MWBDIZNWLQWWND-SFHVURJKSA-N 427.501 2.308 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4nnc(C(F)F)n4c3)cc2)C1 1332760884 OWRMWJKVEQDQOB-CQSZACIVSA-N 428.443 2.299 10 20 IECD CC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753011 YZZJONLPTBLDNP-XUZZJYLKSA-N 425.529 2.309 10 20 IECD Cc1noc(C)c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992229 WTQJVSKWLIZWBI-FOIQADDNSA-N 437.456 2.126 10 20 IECD CC1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817843180 GTOCDIJNXHVYMP-KRWDZBQOSA-N 442.520 2.254 10 20 IECD Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496660 OGPNSSHJTUDFHG-CYBMUJFWSA-N 446.558 2.212 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c[nH]1 1827896584 OVKOQHJVKIARMJ-KRWDZBQOSA-N 448.614 2.417 10 20 IECD Cc1nc2ncccn2c1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1843750121 MFULYLYVOKECFD-UHFFFAOYSA-N 441.875 2.233 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2[nH]nc3c(Cl)cccc23)C1 1845023922 PSZVZWFRXIVCBZ-UHFFFAOYSA-N 441.875 2.082 10 20 IECD CCOC(=O)C1CCN(C(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 10878524 HLDKUEALFFLPBW-UHFFFAOYSA-N 449.459 2.421 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCCC4)CC2)cc1 39561410 NRBPQVMYKKYHMY-UHFFFAOYSA-N 428.558 2.495 10 20 IECD C[C@@H](NC(=O)N1CCN(c2ccc(C(N)=O)cc2)CC1)c1ccc(N2CCOCC2)cc1 735512785 NDFKYXMVXBCUOU-GOSISDBHSA-N 437.544 2.215 10 20 IECD CCNC(=O)N1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 741804100 OBHIBBKFRKKBSH-OAHLLOKOSA-N 434.496 2.136 10 20 IECD C[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 746048835 JJPYAJRAAMVOMG-XLIONFOSSA-N 444.601 2.489 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCNS(=O)(=O)c3cccs3)CC2)cc1 747402200 HGORVQGNPZJFPM-UHFFFAOYSA-N 438.575 2.003 10 20 IECD COc1ccc(N2CCCN(C(=O)NC3CCN(C4CCN(C)CC4)CC3)CC2)cc1 747990478 NPBRDLFPYYORHG-UHFFFAOYSA-N 429.609 2.476 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)[C@@H](O)c3cccc(F)c3)CC2)cc1 752905627 NYLNWKZZMPHSKZ-VGOFRKELSA-N 430.524 2.378 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CC(N)=O)C3CCCCC3)cc2F)C[C@@H](C)O1 754504570 ISVICTAGGIQUAL-LLGFUMIMSA-N 448.583 2.469 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1O 756182695 XGCQMXITBUDLTE-UHFFFAOYSA-N 425.416 2.005 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccnn1Cc1ccccc1 756769569 GBSNJYVAEYWUTI-UHFFFAOYSA-N 447.539 2.395 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CC[C@@H](CO)CC1 757645208 OQCUNCAKQHWCQF-IZAXUBKRSA-N 442.539 2.293 10 20 IECD CNS(=O)(=O)c1ccc(NCCCN2CCN(c3ccc(OC)cc3)CC2)c(F)c1 759302127 SHTYVDJGJNATHJ-UHFFFAOYSA-N 436.553 2.367 10 20 IECD CC[C@@H](CCO)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762835517 HGWWXNSLJLIZGD-ZDUSSCGKSA-N 437.474 2.240 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H]4[C@@H](CCCN4C)C3)cc2F)C[C@@H](C)O1 766121014 FNIJAFBJBZOCEP-HROGELHOSA-N 432.584 2.472 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(OC)c(OC)cc3OC)CC2)cc1F 766515274 CFDULTNXPKSZGU-UHFFFAOYSA-N 447.463 2.147 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cs1 768916409 QERXJYAQGSQAAY-AWEZNQCLSA-N 429.951 2.149 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc1F 769637268 RHNOQNNYIPLHFH-UHFFFAOYSA-N 441.550 2.448 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1COCCN1CC(F)F 771623060 LHUUSILZJNTVMG-INIZCTEOSA-N 437.409 2.124 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1)c1ccc(N2CCOCC2)cc1 774163917 IVFQAGJQPMLVRO-NGFNCXNUSA-N 433.505 2.216 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H](c1cccs1)N1CCOCC1 774807395 IYEQVMWVAIMUFK-FQEVSTJZSA-N 442.585 2.154 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)N3CCCC[C@@H]3C)CC2)cc1 778234206 NPCJILPUEUGXGN-LWKIYRRVSA-N 428.577 2.279 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@@H](C(=O)NCC(F)(F)F)C3)CC2)cc1 779555238 DWMNIHONNUXNKU-CQSZACIVSA-N 428.455 2.374 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cnn(-c2ccccc2)c1)c1ccc(N2CCOCC2)cc1 785973210 VSBAGHIUDAYFRL-GOSISDBHSA-N 433.512 2.203 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc4c(c3)OCO4)cc2)CC1 787321730 ISHZALIXKCFSFQ-UHFFFAOYSA-N 447.495 2.404 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(=O)n(-c4ccc(C)cc4)[nH]3)cc2)CC1 787326187 VWPBQDUTFHWJGD-UHFFFAOYSA-N 433.512 2.073 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1noc(-c2ccccc2)n1 788321936 DJPGSRVHJZLFAC-MRXNPFEDSA-N 435.484 2.067 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccn4ccnc4c3)cc2F)C[C@H](C)O1 789819495 NSAGILQVONGZDX-HOTGVXAUSA-N 439.491 2.020 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCc2ccccc2OC1 789856228 QSZIRAWQDQEJIM-LJQANCHMSA-N 425.554 2.366 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@H]1COC2(CCCCCC2)O1 789859697 FBJPGXWVCRDYQF-FQEVSTJZSA-N 447.601 2.438 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(O)c1 797389728 WAVYNBMWTPWSOP-ZIAGYGMSSA-N 431.464 2.408 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1F 799253363 REVJJYQMZIVWAQ-UHFFFAOYSA-N 428.464 2.282 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803299835 OEKLNXQEKCIDPA-CDNPAEQRSA-N 436.556 2.262 10 20 IECD Cc1ccc(C(=O)NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)s1 803661978 PYXGTSQQWYRUFF-UHFFFAOYSA-N 446.548 2.299 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)c3cccc(C)c3C)CC2)cc1 803747649 SUNDNRQMADVRGN-HXUWFJFHSA-N 438.572 2.428 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(C[C@H]4CCOC4)CC3)cc2)CC1 805019042 BAVBYIQODDBABE-OAQYLSRUSA-N 442.604 2.156 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CN4CCOCC4)C3)cc2)CC1 805023883 MUFGLIURLFTTFG-JOCHJYFZSA-N 442.604 2.110 10 20 IECD O=C(COCc1ccccn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 805169123 WPBNGHQGZSXXPL-UHFFFAOYSA-N 436.491 2.170 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)N(C)Cc3ccccc3)CC2)cc1 805940561 TZIXOABESUDFPQ-HXUWFJFHSA-N 438.572 2.371 10 20 IECD CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 806277268 VZRHJFXUNABRMG-AWEZNQCLSA-N 426.608 2.142 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O 807103953 YUIHHQUQFHPRMF-QFIPXVFZSA-N 436.556 2.027 10 20 IECD O=C(Nc1cccc2c1COC2=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808939605 MQMCDABSCNGVBX-HNNXBMFYSA-N 443.887 2.435 10 20 IECD CN(C)c1ccc(CN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C2CC2)cc1 918064908 MFVDOQPVCZYGTC-UHFFFAOYSA-N 437.592 2.429 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3CCN(CC(F)(F)F)CC3)cc2)C1 918373317 VWRPKKSMERLQBT-KRWDZBQOSA-N 426.483 2.279 10 20 IECD C[C@H](NC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920868761 LHYUXMVWIIYPJT-HOTGVXAUSA-N 432.546 2.292 10 20 IECD COc1ccc(/C=C2\SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1OCC(N)=O 1115954388 IQMKAFOQWRJJFT-SXGWCWSVSA-N 443.506 2.064 10 20 IECD CSCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777849469 WJIPYFNXWTWSCS-QVKFZJNVSA-N 437.562 2.010 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(F)ccc1F)C2)c1cc(O)nc(O)c1 1777851050 MDUAMDACPJSOQI-VGOFRKELSA-N 447.438 2.212 10 20 IECD C[C@]1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC=CCC1 1785510705 YVGVSVARDMKJJN-SGRYIFHISA-N 442.512 2.393 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccccc1O 1805197396 RFWPLNDVGVMUFF-VFNWGFHPSA-N 434.452 2.227 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H](O)c1ccccc1 1817076054 TXCXTMYTPYMTBS-JXFKEZNVSA-N 437.456 2.255 10 20 IECD COCc1c[nH]c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1820157371 JKYFHTXROJDAQN-MRXNPFEDSA-N 440.460 2.310 10 20 IECD C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825113652 OODJJSGCFJZHBH-SWVIMVIYSA-N 436.584 2.048 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)CCC(F)(F)F)CC2)CC1)c1cc(O)nc(O)c1 1834987306 YVQMMDKGMSQYMP-UHFFFAOYSA-N 444.454 2.021 10 20 IECD O=C(CCCc1cccnc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442413 MWKDIUAGOQCEIZ-UHFFFAOYSA-N 445.523 2.401 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cccc3c2CCCC3)C1 1846837222 RJVQGDQCAWVAKR-UHFFFAOYSA-N 443.594 2.243 10 20 IECD CCOC(=O)c1cc(NS(=O)(=O)c2cccc3nsnc23)cc(S(C)(=O)=O)c1 571485565 YREWAAAYDVIKFO-UHFFFAOYSA-N 441.512 2.072 10 20 IECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 726244243 BRDDMYFXPXLPLP-WSTZPKSXSA-N 432.565 2.157 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(OC)c(OC)c(OC)c3)CC2)cc1 726726469 RPGAMPZNRHXBAB-UHFFFAOYSA-N 443.500 2.445 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1F 731408731 DBOFMJACLHAZID-UHFFFAOYSA-N 444.507 2.394 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 732202504 TXJJWQYSNPVIBZ-IBGZPJMESA-N 432.542 2.093 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(CS(C)(=O)=O)cc3)CC2)cc1 734841460 OYCRUBYSOPCJIB-UHFFFAOYSA-N 438.571 2.187 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cn1 743045941 GURJTVMEBGREKA-UHFFFAOYSA-N 437.459 2.197 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3Cc3ccc(C)o3)CC2)cc1F 746436246 LDVFDAABPFNXPE-UHFFFAOYSA-N 441.463 2.268 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 751227099 DQQUCCRBNJNHMI-UHFFFAOYSA-N 428.507 2.113 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 751385273 JMAMBLRSENMXQP-MZKRTTBSSA-N 432.609 2.067 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C(C)=O)C4(CCCCC4)C3)CC2)cc1 754081023 JNWWRORRCLFIJT-QHCPKHFHSA-N 444.620 2.045 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(F)c3C(N)=O)cc2F)C[C@@H](C)O1 758911441 INKUTXKMOVTSJF-OKILXGFUSA-N 433.455 2.373 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1 759016900 SLCYJEOSGVIHQY-UHFFFAOYSA-N 439.479 2.447 10 20 IECD CCCS(=O)(=O)N1CCC(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 761003950 LCSZHCPNCBVIAZ-UHFFFAOYSA-N 429.926 2.014 10 20 IECD COc1ccc([C@@H](CO)N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764351434 MNUSYVOQSBIZDU-DENIHFKCSA-N 440.544 2.272 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC3CCN(C4CC4)CC3)CC2)cc1 770104294 WAOQHOZRHKFNBB-UHFFFAOYSA-N 429.609 2.381 10 20 IECD O=C(COc1ccccc1)NCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771055311 BNDAPVHTGZTUCR-GOSISDBHSA-N 431.920 2.321 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N(C)C)c1ccc(N2CCOCC2)cc1 774853068 GMDIZGVBDOXAHV-APWZRJJASA-N 430.574 2.181 10 20 IECD CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775661184 MVADWIDJVXVBBP-UHFFFAOYSA-N 429.653 2.354 10 20 IECD C[C@@H](NC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccc(N(C)C)cc1 776061519 JYDXJTVVCUKRLL-OAHLLOKOSA-N 433.534 2.051 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ncn(Cc4ccccc4)n3)CC2)cc1 778244830 DHLHOJFLABAKIG-VAWYXSNFSA-N 446.511 2.179 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2)CC1 782125819 RQCRPIHEGZNAQT-QGZVFWFLSA-N 437.544 2.237 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)OCC(=O)c2ccc(O)c(O)c2)(c2ccccc2)CC1 782547117 RGYPMASVHWRCOL-UHFFFAOYSA-N 447.509 2.207 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(F)c1 784765582 AYBQWWHMLOGVJT-OAHLLOKOSA-N 448.882 2.003 10 20 IECD CC1CCN(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 787665282 ZNRJCJIXDXLMDB-KRWDZBQOSA-N 438.519 2.221 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccccc1OCC(=O)NC 788067429 OEKQPCDKZCJEKY-FQEVSTJZSA-N 440.544 2.070 10 20 IECD C[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCc2ccccc21 788137243 BUPUHJCTTPOFKD-QGZVFWFLSA-N 441.503 2.273 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ncc(C(C)(C)C)s3)CC2)cc1 789406373 YWBSSNMNHYUEBO-UHFFFAOYSA-N 445.589 2.326 10 20 IECD Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811269 DOHKNGUPXNRVEI-KRWDZBQOSA-N 429.492 2.171 10 20 IECD CCc1ccnc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 789823308 ZZUCJMPGDAPEQT-HZPDHXFCSA-N 428.508 2.329 10 20 IECD CN(CCC1CCCCC1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793726213 SLDVDMXNMSALCX-FQEVSTJZSA-N 428.577 2.433 10 20 IECD Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 793794739 STFUMITXVIDNGG-LJQANCHMSA-N 425.529 2.374 10 20 IECD C[C@H](NC(=O)C(=O)NCCN(C)Cc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803299436 LFLQRXXBCWCLAK-SFHVURJKSA-N 442.535 2.088 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803305706 OGOSSJALSUEQLD-IEBWSBKVSA-N 445.560 2.138 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C(C)C)N(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 803498241 RBKCLTVAHIOUPA-HXUWFJFHSA-N 435.546 2.054 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 804958237 PJCXXFRLYIXZFE-RYUDHWBXSA-N 442.538 2.333 10 20 IECD O=C(NC[C@H]1CCCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806042474 USELCRWPGTUKAX-CABCVRRESA-N 431.505 2.381 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)cc1 806845335 KXKOWOALIQBQOK-IBGZPJMESA-N 426.565 2.010 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 807770946 QCQBSTCSLZFOAV-BFYDXBDKSA-N 425.476 2.399 10 20 IECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 917928088 SUCNDHHMRGXWBB-UHFFFAOYSA-N 437.587 2.356 10 20 IECD Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917929320 CVFBGQGNPDLYBY-MRXNPFEDSA-N 432.502 2.083 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCN(CC(F)(F)F)CC3)cc2)C1 918117210 IUEHKYMJQJKAIJ-KRWDZBQOSA-N 441.498 2.168 10 20 IECD CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920195635 XFWRIXWNWMHYAI-UHFFFAOYSA-N 438.528 2.260 10 20 IECD O=C(Cc1cccs1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002607 UKTMZEZUKUZBLM-HXUWFJFHSA-N 436.917 2.499 10 20 IECD O=C(Nc1cccnc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718206 ONYBKLCXKGQJRT-QDMKHBRRSA-N 444.875 2.037 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ccno3)C2)CC1 1808324424 QRBIMNLDXUICCU-UHFFFAOYSA-N 435.484 2.312 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nc1C 1842293562 YNVUOIMCFKMHSN-UHFFFAOYSA-N 431.496 2.308 10 20 IECD COc1cccc(CNC2CCN(S(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)c1O 725844295 SSGFBCYLRJYVOF-UHFFFAOYSA-N 433.530 2.302 10 20 IECD CO[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 728130288 XLCKMCFGRFICEJ-GOSISDBHSA-N 428.512 2.263 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)cc1 728294740 RFKPYGDLPOGTOQ-UHFFFAOYSA-N 449.485 2.276 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)c3ccc(NC(N)=O)cc3)CC2)cc1 729607607 RWSLRAMMFKAVRX-QGZVFWFLSA-N 440.548 2.368 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CN(C(C)=O)c4ccccc4O3)cc2F)CC1 730192890 OTXVPUPKZLRVKB-QHCPKHFHSA-N 440.519 2.398 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)cc2F)C[C@@H](C)O1 734270542 UCVLMRUUSGRZRH-GGPKGHCWSA-N 447.599 2.407 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 741019347 FWAGTJODMZUSQR-SELNLUPBSA-N 447.576 2.021 10 20 IECD CN1CCCc2cc(CNC(=O)c3ccc(S(N)(=O)=O)c(Br)c3)ccc21 748073874 FWYBOCVUFPOMHK-UHFFFAOYSA-N 438.347 2.409 10 20 IECD O=C1CCCN1c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227414 IFVCJCLFSYCOTF-UHFFFAOYSA-N 447.532 2.392 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)CC2)cc1F 753739260 BQDLQQJRTGKNQX-UHFFFAOYSA-N 439.484 2.186 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N(C1CCCCC1)[C@H]1CCS(=O)(=O)C1 759588099 IEMHHINJDKZWTC-KMDWOBIYSA-N 437.514 2.003 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cnn(Cc2ccccc2)c1 762415914 MTCUKUKIDGTDEO-UHFFFAOYSA-N 447.539 2.395 10 20 IECD C[C@H]1OCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@@H]1C 770022146 AHAWOKTXBQYKJT-CHWSQXEVSA-N 435.458 2.351 10 20 IECD O=C(COC(=O)c1cc(O)nc(C2CC2)c1)NCc1ccc(N2CCOCC2)c(F)c1 770583857 WMZWFFGDDCIYHT-UHFFFAOYSA-N 429.448 2.114 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3COC4(CCCCC4)O3)CC2)cc1 775734674 VWURLLUBGSMIGN-NRFANRHFSA-N 432.565 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 778287927 BQPKRYLDOSAAJP-QTSKCGQKSA-N 427.545 2.220 10 20 IECD Cc1cc(Br)cc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)c1O 779608404 SKCBNJSAUCIOJB-INIZCTEOSA-N 433.368 2.090 10 20 IECD CC(C)CN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 786331495 QBBVFNQDVNNMNF-QZTJIDSGSA-N 448.583 2.292 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789818810 LCCTYOFVULLJTL-UPJWGTAASA-N 435.525 2.093 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2c(F)cccc2C1 789843116 IUWWTORGSPUDMP-UHFFFAOYSA-N 429.467 2.127 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(Cc2ccsc2)CC1 789847485 RRKIYIDALFOIAB-UHFFFAOYSA-N 444.626 2.262 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1 792955645 HWWDIIMKYRTUJE-HUUCEWRRSA-N 445.495 2.271 10 20 IECD CC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)[S@]1=O 796365867 IXCFOZRYVAGKNB-NZXKKUMQSA-N 439.597 2.287 10 20 IECD COc1ccc(-n2cc(O)c(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)n2)cc1 801363202 NUPVHMLHMKMOSG-UHFFFAOYSA-N 438.484 2.468 10 20 IECD Cc1ncc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 803447926 BSZBXSXKQXICKN-UHFFFAOYSA-N 438.500 2.497 10 20 IECD COc1cccc([C@@H](C)N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c1 803662499 WTZXXBKTVXXJNS-QGZVFWFLSA-N 442.535 2.422 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)Oc3ccccc3OC)CC2)cc1 804315160 GDURDUWBAUGGFB-QGZVFWFLSA-N 441.528 2.373 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)CC2)cc1 804315283 JQDCCDWQZIERGW-DHIUTWEWSA-N 436.556 2.342 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 804389305 BRCRNGHVVHYRSF-HZPDHXFCSA-N 446.573 2.058 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cn1 804857248 CAZJWMHSHURAHY-UHFFFAOYSA-N 426.517 2.234 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cnn(Cc2ccccn2)c1 807387580 OPBZMISOFNFNRQ-UHFFFAOYSA-N 430.262 2.049 10 20 IECD Cc1ccncc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807579506 QALOYXDZBMXLQC-IBGZPJMESA-N 435.572 2.416 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1 807692133 CRAHDUOMBAJEKE-FQEVSTJZSA-N 428.577 2.399 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccc2c(c1)CCN2Cc1ccccc1 809538998 WXRVGULSCSEKGQ-QFIPXVFZSA-N 441.597 2.375 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCC2([S@](C)=O)CCC2)cc1 809895419 RQRVDVNJRHDHDU-PMERELPUSA-N 431.558 2.292 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN(C2CCC2)C1 813594634 LJDLKGDOAOGMSU-UYAOXDASSA-N 427.593 2.404 10 20 IECD CCOC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 916676842 WAJZMFKTWRZAOH-UHFFFAOYSA-N 431.514 2.420 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)c4ccccc4F)CC3)nc12 917096836 DETSXPWNPGYUST-UHFFFAOYSA-N 441.463 2.099 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CSc3nnc(N)n3C3CC3)cc2F)C[C@@H](C)O1 917212603 MNJIFVQFOFNBDT-CHWSQXEVSA-N 434.541 2.356 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(CC(=O)N(C)C)cc3)CC2)cc1 918461577 GOLQLNIPIXDNHD-UHFFFAOYSA-N 438.528 2.003 10 20 IECD C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918672751 KSMCRRJPNYJSMY-QAPCUYQASA-N 442.947 2.476 10 20 IECD CC(C)n1nccc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779604271 CMHCFNYVDWFXMB-NRFANRHFSA-N 448.907 2.286 10 20 IECD C/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221731 MKBINDPJLPSFLX-RVVWZKGKSA-N 430.501 2.297 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3csnn3)CCC2)cc1 1792314743 SJIYAMOTGXXLHJ-UHFFFAOYSA-N 447.567 2.146 10 20 IECD COc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1798785838 BFVWMDVSXIBDOI-NCSLWMNCSA-N 439.468 2.172 10 20 IECD O=C(CN1CCSCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800713510 MTNYTPLGJDNULC-QDMKHBRRSA-N 439.965 2.052 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1[C@@H]2C=CS[C@@H]12 1812384972 VPLZXSAIAIILNE-XXEDRWDRSA-N 438.509 2.083 10 20 IECD Cc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844388 ZTQDXLSABVUJOK-CQSZACIVSA-N 426.433 2.440 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)ccn1 1820483293 NCOBNJCLODRHGR-CYBMUJFWSA-N 425.470 2.192 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824754794 BOEOMHKPOSMUPR-QGZVFWFLSA-N 447.532 2.458 10 20 IECD Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827886018 UYZOKHSTHJZAJR-QGZVFWFLSA-N 448.614 2.417 10 20 IECD COCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827916937 WSFUPQJRKSWUQG-QGZVFWFLSA-N 444.488 2.174 10 20 IECD Cc1noc(C)c1CCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441204 DHCMMOCNUZIHBX-UHFFFAOYSA-N 449.511 2.220 10 20 IECD O=C(CCc1cccnc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442020 NEEJKTICFUOHFH-UHFFFAOYSA-N 431.496 2.011 10 20 IECD CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1O[C@H](C)C(=O)N(C)C 13351935 LBXYSGMJWQKYDN-PDICVPPASA-N 438.527 2.227 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 728839927 XXSPXZDCILEBEI-LNMJFAINSA-N 435.446 2.451 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1 729064175 QRBCDAQNWHELFN-MRXNPFEDSA-N 426.517 2.359 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3c(C)nc4cc(O)nn4c3C)cc2F)CC1 730288014 QTRAHOYZVFDNQO-UHFFFAOYSA-N 440.523 2.192 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CNC(=O)c3ccccn3)c2C)cc1 740337849 XTAYJMHAVJZSPZ-UHFFFAOYSA-N 449.463 2.432 10 20 IECD O=S1(=O)CCN(c2ccc(CNc3ncnc4c3cnn4-c3ccncc3)cc2)CC1 752634337 FRYWTEKGZJRKDZ-UHFFFAOYSA-N 435.513 2.057 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2C(=O)OC)OCO3)cc1 753815938 QPIPTGROUBAYPT-UHFFFAOYSA-N 427.457 2.303 10 20 IECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 756937179 UYSQSEKEAMQTJV-HZPDHXFCSA-N 446.523 2.025 10 20 IECD O=C(NCCCSc1nccs1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 758578044 KCHXUPCXCKZIAK-UHFFFAOYSA-N 430.533 2.307 10 20 IECD O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCc1c(O)ccc2c1CCCC2 758692523 PWAQJGKMOCSVLR-UHFFFAOYSA-N 433.486 2.452 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cc4c(nc3O)CCC4)CC2)cc(OC)c1OC 760117947 MLRBKTGDWSNZEA-UHFFFAOYSA-N 442.516 2.334 10 20 IECD NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NCc1c(O)ccc2c1CCCC2 760169492 FEEBHCTVHJKTRK-HXUWFJFHSA-N 439.512 2.448 10 20 IECD COC(=O)c1cn([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)nn1 760668021 FLUYDMVLGLMTIQ-LJQANCHMSA-N 426.521 2.458 10 20 IECD C[C@H]1CO[C@H](C)CN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769674867 SDQUCXDNRDJDGP-QWHCGFSZSA-N 435.458 2.351 10 20 IECD CCn1nnnc1-c1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772908399 DMBYQJNRTKBLMC-UHFFFAOYSA-N 439.495 2.064 10 20 IECD O=C1N[C@@H](c2ccccn2)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 773834849 BPUVTBSEJOHQMN-FQEVSTJZSA-N 447.474 2.130 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773857291 LTVJWBAOMRYPMR-OAHLLOKOSA-N 432.546 2.255 10 20 IECD COc1ccccc1N(CCC(N)=O)C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775254435 IZLQNHQRNALOFX-GOSISDBHSA-N 440.544 2.091 10 20 IECD O=C(COC(=O)c1ccc2nsnc2c1)NCc1ccc(N2CCOCC2)c(F)c1 781673668 ATLRSYUJNXBUDI-UHFFFAOYSA-N 430.461 2.140 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 787705014 IPGANHSQYHTDHA-VAMGGRTRSA-N 430.593 2.185 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O 788908785 ALLRVEVDGZDYQN-QHCPKHFHSA-N 448.567 2.253 10 20 IECD CN(CCCOc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797217 ANBPRSBULUAMMI-UHFFFAOYSA-N 429.492 2.206 10 20 IECD CSc1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccn1 789828946 ZMEPMMHBLRQCFW-GJZGRUSLSA-N 446.548 2.489 10 20 IECD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 792198007 IQSWNQDOHRXXPW-KSFYIVLOSA-N 435.471 2.294 10 20 IECD CN(C)c1ccc(CNCCC(=O)N2CCN(c3ncccn3)CC2)c(C(F)(F)F)c1 792949496 AWTWYNSWCVRRFG-UHFFFAOYSA-N 436.482 2.390 10 20 IECD CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734557 UPBZEMGZRZDWDS-YSIASYRMSA-N 446.617 2.137 10 20 IECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)c1 803661337 XOTANVGHOZSJJK-KRWDZBQOSA-N 428.508 2.159 10 20 IECD CCS[C@@H]1CCC[C@H](NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 803747650 SKQDIVBGTUKDKX-GHTZIAJQSA-N 448.633 2.114 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)cc1F 804852952 JJFGIELDROEVKO-FXAWDEMLSA-N 447.507 2.232 10 20 IECD CO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)n1 805024133 BEDFGLJQQYAPBQ-MRXNPFEDSA-N 429.521 2.288 10 20 IECD CC(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)on1 806431063 KKRABWKIZIUDLZ-UHFFFAOYSA-N 439.560 2.263 10 20 IECD Cn1cc(N2CCC[C@@H](NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)C2)cn1 806843708 AHYAYHJQSBHWRG-GOSISDBHSA-N 437.500 2.033 10 20 IECD COC(=O)[C@@H]1CN(C(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c2ccccc2O1 807511534 OIQZPOPVZATPAE-HNNXBMFYSA-N 439.251 2.282 10 20 IECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807953894 ARERSJIECUXUBE-YXJHDRRASA-N 434.968 2.223 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1=O 808545500 CTEWOJLIXHMNPX-QFIPXVFZSA-N 436.556 2.327 10 20 IECD CC(C)OCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)no1 811973504 XWOIKHFQWIXFNZ-DOTOQJQBSA-N 444.536 2.257 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)n(C)c4ccccc43)cc2F)C[C@@H](C)O1 917712140 HNJDLUMIUVHGGW-IYBDPMFKSA-N 426.492 2.409 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)cc2)C1 917832133 KLRMJOVGDUQMNC-SFHVURJKSA-N 448.483 2.412 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 917833927 DMHQAPMTNFMION-MOPGFXCFSA-N 426.561 2.186 10 20 IECD CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969458 YSMIEEYPOJCUNJ-UHFFFAOYSA-N 425.529 2.340 10 20 IECD Cc1cc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 920873024 WIZMLCURXWEVRA-QFBILLFUSA-N 447.561 2.270 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc2ccoc2s1 1787276427 ZIXNNIHVUOWQLD-QEJZJMRPSA-N 443.481 2.208 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3Cl)C[C@@H]21)c1cc(O)nc(O)c1 1787294131 BUYZVIKPOKTJRY-PJODQICGSA-N 449.866 2.192 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992414 YCKPSKKQQCTVCL-SJKOYZFVSA-N 443.847 2.163 10 20 IECD CC(C)(F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817203118 OMNZFISYTKNKEV-LLVKDONJSA-N 427.527 2.010 10 20 IECD Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817768771 YAXNXROVQWOHIQ-LBPRGKRZSA-N 425.470 2.192 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(Cl)cn2)C1 1844443239 YGGJALUCSLSYGB-UHFFFAOYSA-N 437.887 2.345 10 20 IECD O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)N[C@H]1CCS(=O)(=O)C1 11643499 JFSLAOAIZXSVCC-IRXDYDNUSA-N 435.571 2.125 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CSc3nnnn3C)c2C)c1 15180982 WBCYSTSLFYKTBZ-UHFFFAOYSA-N 443.485 2.166 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc(Br)cc(C(N)=O)c1 442323622 MMDSRWRYZMHUDQ-UHFFFAOYSA-N 440.319 2.202 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(N4CCCC4)c3)cc2)C1 726291767 OINZEUHVOCCWGE-IBGZPJMESA-N 449.555 2.243 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(N4CCOC4=O)cc3)CC2)cc1 726727455 GSFBPINHEMJDCF-UHFFFAOYSA-N 438.484 2.376 10 20 IECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167390 VISCXJGRQKSUPW-UHFFFAOYSA-N 436.877 2.489 10 20 IECD CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)CCO)cc3)cc2)CC1 731059337 OUINBPRXQOAQEB-UHFFFAOYSA-N 445.585 2.466 10 20 IECD CS(=O)(=O)c1ccc(OCCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 736196740 XSVYWYAWUVOLJJ-UHFFFAOYSA-N 446.569 2.384 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1 737080084 XKQDXHQDLULYTD-UHFFFAOYSA-N 426.498 2.203 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CNC(=O)Nc3cccc(C)c3)CC2)cc1 742919733 JSHCMYLCFPQVEP-UHFFFAOYSA-N 425.533 2.064 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 746979896 YBOHLLSQXSDTPO-QZTJIDSGSA-N 433.572 2.223 10 20 IECD NC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 753928488 IEUZJMGXTHFIMU-UHFFFAOYSA-N 437.422 2.035 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1OC 754039646 BIXHVUSXBPBAOQ-UHFFFAOYSA-N 438.477 2.140 10 20 IECD CN1CCN(c2ccc(CN[C@H](Cc3ccc4c(c3)OCCCO4)C(=O)O)cc2)CC1 756390553 VMYMBUNXYVSUGR-OAQYLSRUSA-N 425.529 2.385 10 20 IECD COc1cc(N2CCN(C(=O)c3ccccc3Cn3cncn3)CC2)cc(OC)c1OC 759240168 WWFYNWQQFIOWKB-UHFFFAOYSA-N 437.500 2.315 10 20 IECD COc1cc(N2CCN(CC(=O)NCCOc3cccc(F)c3)CC2)cc(OC)c1OC 759872511 LPRNWVXLDZMBCB-UHFFFAOYSA-N 447.507 2.169 10 20 IECD Cc1cccc(S(=O)(=O)CCCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 766199650 HWOGDTYDPRSKHF-UHFFFAOYSA-N 427.500 2.093 10 20 IECD O=C(COC(=O)c1cnc(NC2CC2)s1)NCc1ccc(N2CCOCC2)c(F)c1 770086217 PTQRISAYPCMGIZ-UHFFFAOYSA-N 434.493 2.166 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)CC2)cc(OC)c1OC 774754372 JBFRGHRFUDHGQS-LZLYRXPVSA-N 433.549 2.302 10 20 IECD COc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 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448.608 2.167 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1ccc(F)cc1 803304185 FBVRNJQZNLUPPK-DLBZAZTESA-N 429.492 2.423 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1F 803663992 DBLIHZVUXZUWGE-HXUWFJFHSA-N 426.492 2.162 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CCN1CC(C)(C)O 803677104 FWZGJHQFAHMROG-LJQANCHMSA-N 444.620 2.375 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687535 FPUSSKJPUUSYDM-HXUWFJFHSA-N 449.599 2.012 10 20 IECD Cc1cnc(COCC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 803899462 HQGBFBGFYDBFAI-HZPDHXFCSA-N 449.479 2.112 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC3(CCOC)CCCC3)cc2F)CC1 805010167 WFVSZROQRQPKKJ-UHFFFAOYSA-N 448.583 2.297 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCN3C[C@H](C)O[C@H](C)C3)cc2)CC1 805022683 ARQQKJOQABSSQN-BGYRXZFFSA-N 430.593 2.107 10 20 IECD Cc1nn(C)cc1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 805085046 FFEIOURQNAJQOF-KRWDZBQOSA-N 437.566 2.339 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 917707430 FZCDMRHKDGNSEZ-UHFFFAOYSA-N 447.532 2.377 10 20 IECD COc1cc(N2CCN(C(=O)c3cnn4c(C)cc(C)nc34)CC2)cc(OC)c1OC 1254794163 PJTNQOCGHASCGQ-UHFFFAOYSA-N 425.489 2.334 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3ccc(F)cc3)C2)C1 1780714030 SKWLQQNAEGNTKS-WAWJGKILSA-N 442.443 2.099 10 20 IECD Cc1ccn(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007171 LHKUWVCIDMNFLN-NRFANRHFSA-N 433.892 2.155 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ncccc12)c1cc(O)c(O)c(Cl)c1 1796712969 WDVNVBRNPSLBQZ-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccn2ccnc12 1819107037 SEKYBKATAXIVNS-MRXNPFEDSA-N 447.455 2.483 10 20 IECD O=C1CC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc(O)c(O)c3O)n[nH]2)C1 1823479312 HHHPPVAXCPDHSG-YERXGYGTSA-N 440.456 2.211 10 20 IECD O=C(COc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249072 UAADFEOGJUAPSD-UHFFFAOYSA-N 435.839 2.181 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3ncsc3[nH]2)C1 1844395715 BUUWKQLANQMZJA-HWKANZROSA-N 440.481 2.272 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n[nH]1 1844781311 GNXGNXJZGIOYNI-FNORWQNLSA-N 426.473 2.180 10 20 IECD COC(=O)CCCCCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847036789 FAFGRPODGQNCLL-PKNBQFBNSA-N 446.500 2.144 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc(-n2cnnn2)c1 71933431 BBBIUOLFANFVIF-UHFFFAOYSA-N 432.406 2.448 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 110359451 IKWNMBFZOWXNAO-QMHKHESXSA-N 428.533 2.281 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 728889114 PFTJSPDIGYPMQB-HXUWFJFHSA-N 426.561 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3ccc(F)cc3F)cc2F)CC1 730287186 HHGWNMBDJXQWIZ-UHFFFAOYSA-N 434.462 2.292 10 20 IECD COC[C@H](C)NC(=O)NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036430 KPJBYOIKCLIZKH-HNNXBMFYSA-N 434.537 2.325 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)NC)cc2)cc1F 731408566 QIZFOVHYJLERGE-UHFFFAOYSA-N 430.480 2.052 10 20 IECD COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740610042 RYPQBNPJQPHEDV-UHFFFAOYSA-N 434.474 2.106 10 20 IECD CCO[C@H](C)c1noc(CN(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n1 743566966 LWPXDWWLEFBFOX-QGZVFWFLSA-N 446.552 2.139 10 20 IECD Cc1ccc(CNC(=O)C2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 746893949 JWWRNGBMMHXMNG-UHFFFAOYSA-N 445.541 2.241 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(=O)n(Cc2ccccc2)n1 748654643 PCJQEHCOIXMBMQ-UHFFFAOYSA-N 434.496 2.173 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)N[C@](C)(CCC=C(C)C)C3=O)CC2)cc1 758224475 VBDSHSAYSYBUOR-HYBUGGRVSA-N 444.576 2.235 10 20 IECD C[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)c(F)c1 773090896 HLGKNAZXDWBAOJ-ZBFHGGJFSA-N 428.551 2.209 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN([C@@H]2CCOC2)CC1 773480350 CFTHDNGPSWMSTR-SJLPKXTDSA-N 433.508 2.196 10 20 IECD CN(C)C1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCC1 774852138 BSJHZFIEVQHRSB-UHFFFAOYSA-N 438.519 2.364 10 20 IECD COC(=O)c1sc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(C(=O)OC)c1C 775286360 QKKLAFBQRWXSLX-UHFFFAOYSA-N 430.416 2.044 10 20 IECD C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 775838385 YAAZURYKSSJKDU-KRWDZBQOSA-N 448.564 2.075 10 20 IECD O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)NCc1ccc(N2CCOCC2)c(F)c1 776285091 KMLBADYQNGOCBM-UHFFFAOYSA-N 440.435 2.145 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2scnc2C)c(O)nc1=O 776731562 OICKWZXRWJISTF-CMDGGOBGSA-N 441.513 2.189 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3cccc([N+](=O)[O-])c3)CC2)cc1 778402196 MCMLWLHGSSTAGW-MDZDMXLPSA-N 438.484 2.167 10 20 IECD CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)NCc1ccc(N2CCOCC2)cc1 779540019 LVMSXBRFOZJPEB-VWLOTQADSA-N 438.572 2.302 10 20 IECD C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnnn1C1CC1 785410857 BMTYMYUKPPOZPT-JTQLQIEISA-N 435.487 2.494 10 20 IECD CCN(CC)C(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 787182652 FZAYEHOAMSOMEK-UHFFFAOYSA-N 434.540 2.477 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788070168 IYNAZEWGENXWFX-UZLBHIALSA-N 440.544 2.322 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CCCOc2ccccc21 789799707 KPGIGVGEFPKGHP-IBGZPJMESA-N 427.476 2.309 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccc(F)cc1 789814105 XYBQYAKXPPATEM-OAHLLOKOSA-N 433.455 2.001 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C1Cc2ccccc2C1 789834250 LGUOSLTVOKHPGT-UHFFFAOYSA-N 425.504 2.029 10 20 IECD C[C@H](OC(=O)[C@@H]1CCCN(C(N)=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792270566 AXPCVBMUTUQPQD-UONOGXRCSA-N 449.463 2.123 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cccs3)cc2)C1 793732556 IMZTXNBQBHSCNC-IEBWSBKVSA-N 440.569 2.430 10 20 IECD O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803344816 HBFWIYUZGRSAPO-NRFANRHFSA-N 434.496 2.402 10 20 IECD CC[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 805771841 BIDIGIIIXANYSH-GDBMZVCRSA-N 440.521 2.298 10 20 IECD COc1ccc(C(=O)OCC(=O)C(C)=O)cc1S(=O)(=O)NCc1ccc(Cl)cc1 808484156 LBIPBCVJKPMBNQ-UHFFFAOYSA-N 439.873 2.142 10 20 IECD O=C(Nc1cn(Cc2ccccc2)nn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 815360995 FGGDQUYUMUWTPY-IBGZPJMESA-N 435.484 2.178 10 20 IECD CN(C)C(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 918438961 KDDXIOYKLPVEND-UHFFFAOYSA-N 426.542 2.197 10 20 IECD CSC[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 919767392 XIMUULQUECIGSF-ZCNNSNEGSA-N 445.585 2.046 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](CO)CC3CCOCC3)cc2F)CC1 1321226957 GFXVRHVJSWAJGF-HXUWFJFHSA-N 436.572 2.192 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cc[nH]n3)CCC2)cc1 1792314470 DBIFQUCITNGBAM-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccncc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995598 GYKDENBOIWPWNC-XOBRGWDASA-N 437.431 2.055 10 20 IECD COC(OC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815035580 RLHWPNQGYYWZAF-CYBMUJFWSA-N 438.868 2.399 10 20 IECD O=C(CCN1CCCCC1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722604 QQSSKWHOJCCCPE-AWEZNQCLSA-N 445.545 2.051 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146147 UMTNSUHCJLDWDS-SFHVURJKSA-N 446.471 2.232 10 20 IECD CCn1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)cc1C 1820770379 JMNJVRNEICVZEV-GFCCVEGCSA-N 442.501 2.014 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2ccnn2)CC1 1827240498 FFZMYAGWEJEHTF-QGZVFWFLSA-N 447.923 2.276 10 20 IECD O=C1NCc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)ccc21 1844133831 OWZBNGVNBHUHSP-UHFFFAOYSA-N 441.871 2.125 10 20 IECD O=C(CN1CCN(c2cnccn2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 27628762 UXWDXHBGQFBTHU-UHFFFAOYSA-N 427.464 2.013 10 20 IECD CCC(CC)N1C[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 195591328 YSDOYFAUGMPXOQ-LJQANCHMSA-N 430.593 2.361 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)NC3CCN(C(C)=O)CC3)ccc21 728637100 HYISSRVOLLXPRU-UHFFFAOYSA-N 429.517 2.188 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H]4CNC[C@H]4C3)c2C)c1 728914014 LHTWHQMABSUQBO-OALUTQOASA-N 439.512 2.001 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3nnnn3-c3ccccc3)cc2F)C[C@@H](C)O1 730579711 FJLLDMGGAKJODU-HZPDHXFCSA-N 439.495 2.414 10 20 IECD COC(=O)[C@@H]1CC12CCN(C(=O)NCCCN1CCN(c3ccc(OC)cc3)CC1)CC2 733846693 RGAJLOZTAHJROT-NRFANRHFSA-N 444.576 2.192 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)c1 740494612 GETLSGRBBHRUEI-UHFFFAOYSA-N 449.529 2.041 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1C(=O)N(C)C 741095328 KQIDUDORRNJCCV-KRWDZBQOSA-N 438.528 2.349 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O)c1ccc(OC)cc1 746109514 RSVHWZJOIMUXIG-JOCHJYFZSA-N 426.473 2.029 10 20 IECD O=C(Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)cn1)NC1CCCCC1 746594857 UEQZTRRYWYHWLF-UHFFFAOYSA-N 425.533 2.099 10 20 IECD CNC(=O)CCOC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 749045691 CIFFMKDNJSNDAM-WQLSENKSSA-N 443.344 2.330 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)nc12 749314210 BHDPWIANOSKQDA-UHFFFAOYSA-N 425.357 2.358 10 20 IECD CN(C[C@@H]1CCOC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 749541382 BOAIXMCJDCIDGW-ZDUSSCGKSA-N 435.458 2.210 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)NC(=O)CC3CCCCC3)nc12 750237011 UCPGMKXHJHKVDF-CYBMUJFWSA-N 432.477 2.130 10 20 IECD COc1ccc(N2CCN(C(=O)NCCNC(=O)c3c(F)cccc3F)CC2)cc1F 753911984 POKXAOKNGYLXPM-UHFFFAOYSA-N 436.434 2.374 10 20 IECD COC(=O)C[C@@H]1CN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 754067255 NZCVOYVPKQBICT-CTNGQTDRSA-N 439.556 2.345 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)c3O)cc2F)C[C@H](C)O1 758559379 HUKJEVNWDKFXNI-KBPBESRZSA-N 432.448 2.324 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnc1Cl 767789442 WJTRIVQEKREHNJ-UHFFFAOYSA-N 429.901 2.322 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(I)cn1 772938861 QDTQRYXAATZFHQ-UHFFFAOYSA-N 438.269 2.349 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773617345 DDUBDELLGCPCSC-GJZGRUSLSA-N 447.561 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cn4cc(C)ccc4n3)CC2)cc1 778246908 SFOUYHIJQJIWRP-KTKRTIGZSA-N 433.512 2.173 10 20 IECD Cc1n[nH]cc1-c1nnc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 782093351 OGOCJMVEKVQJQC-AWEZNQCLSA-N 440.533 2.260 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cnn(-c2ncccn2)c1 785198689 YQWGUHMBUXAYMZ-UHFFFAOYSA-N 445.277 2.118 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1cccs1)C[C@H]1CCCO1 788309752 GXQICIZRLZLFJV-HXUWFJFHSA-N 443.569 2.409 10 20 IECD CC(C)NC(=O)Nc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 789484993 XNPAKNQRJLLFOO-UHFFFAOYSA-N 429.496 2.354 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc4c3OCO4)cc2F)C[C@@H](C)O1 789825623 NFSQLQZCWQCHCU-GASCZTMLSA-N 443.475 2.101 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(OC)cc3F)CC2)cc1 790824927 XOGNXNYMUCMDNT-UHFFFAOYSA-N 437.537 2.334 10 20 IECD O=C(CNC(=O)NCc1ccccc1O)Nc1ccc(I)cc1 790887315 CROONBSUUDZKLX-UHFFFAOYSA-N 425.226 2.435 10 20 IECD CCOC1CC(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)(N2CCOCC2)C1 794802577 NXROZSGEDCBQOM-UHFFFAOYSA-N 437.924 2.080 10 20 IECD CC[C@@H]1CO[C@@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448927 IJDABAUAIJXYSJ-GOEBONIOSA-N 425.476 2.399 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCN(c2ccccc2)C1=O 803665282 WQGMBCJBRWDXEX-HXUWFJFHSA-N 426.492 2.162 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(C(=O)NCc2ccccc2)CC1 807289420 ULCYQTZYYYXUHX-UHFFFAOYSA-N 446.551 2.234 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1 808568545 MHRWUTCQPYJPMC-LJQANCHMSA-N 444.482 2.349 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)cc1 813533523 CBLVJCVHKRVVBZ-UHFFFAOYSA-N 438.500 2.247 10 20 IECD CCN(CC)C(=O)N1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 915206689 LBDARCVIOLGFCE-UHFFFAOYSA-N 432.565 2.006 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4nc(O)[nH]c4c3)cc2F)C[C@@H](C)O1 917917812 HVTCJAFUAUMGGM-BETUJISGSA-N 434.493 2.500 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cccc(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 917998583 LPXIZBPLVIEMAI-OKILXGFUSA-N 436.509 2.408 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C(N)=O)c(Cl)c3)CC2)cc1 918462147 SGXGHCCMDKFLHJ-UHFFFAOYSA-N 430.892 2.125 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 1324589780 YOAXMPFVIBKIOW-UHFFFAOYSA-N 449.598 2.233 10 20 IECD Cc1nc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782006989 DYGDYJZMJCQWQQ-HXUWFJFHSA-N 435.864 2.113 10 20 IECD C[C@@]1(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC=CCC1 1785510702 YVGVSVARDMKJJN-CYEIDUMTSA-N 442.512 2.393 10 20 IECD CC1CCN(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1 1810549674 WZFMGXUKVSZDBD-UHFFFAOYSA-N 430.549 2.070 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817848499 NHSQYCYLKUXFQI-HNNXBMFYSA-N 426.433 2.061 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1)CC2 1828246892 HRRMTGPFAZZYQW-GFCCVEGCSA-N 446.579 2.229 10 20 IECD Cn1ncnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830735009 IYJDNEMRFLDRTR-INIZCTEOSA-N 447.923 2.427 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2nc(-c3ccccc3)ns2)C1 1843119373 LPEPLSATQWZIHV-UHFFFAOYSA-N 437.481 2.142 10 20 IECD O=C(c1ccccc1)c1ccc(O)c(CN2CCN(CC(=O)N3CCCCC3)CC2)c1O 728193809 CGPBNVIUHWYHOU-UHFFFAOYSA-N 437.540 2.459 10 20 IECD COc1ccc(N2CCCN(C(=O)Cc3c(C)nc(-c4ncccn4)nc3O)CC2)cc1 729525417 NEOCUSVSFFHHAG-UHFFFAOYSA-N 434.500 2.238 10 20 IECD Cc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n[nH]1 733367198 UAESXBBBBDDBPP-UHFFFAOYSA-N 431.430 2.063 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1 743560885 WHSIVFFSMFLCBD-YMPZKCBVSA-N 434.540 2.479 10 20 IECD Cc1cccn2cc(CCNC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)nc12 746758389 VSPGGGPXUJDPCP-LJQANCHMSA-N 434.544 2.386 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747077695 DSNJPKBFYCBDTF-CHWSQXEVSA-N 443.477 2.013 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 749635606 GSYCLXQVLPLUCQ-INIZCTEOSA-N 449.515 2.013 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cnn([C@@H]4CCOC4)c3)cc2F)C[C@@H](C)O1 751974292 MAWNOYBYZHMJNS-BFYDXBDKSA-N 438.525 2.076 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](C)Oc4ccc(OC)cc43)CC2)cc1 754047135 BGPZINQMCZGIMI-AZUAARDMSA-N 427.545 2.474 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 754072496 ZTNSSWNMUCTRHF-PBXXJUDPSA-N 428.621 2.127 10 20 IECD COCc1cccc(CNC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759872505 LJGNTBGBAGBXRK-UHFFFAOYSA-N 443.544 2.297 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3cc(-n4cnnn4)ccc3Cl)CC2)cc1 760822134 MSITYHVUCBRWHG-UHFFFAOYSA-N 441.923 2.475 10 20 IECD COC(=O)c1sccc1N1C(=O)C[C@@H](N2CCN(c3ccc(OC)c(F)c3)CC2)C1=O 762438055 WZFOUQLNPYGFJA-MRXNPFEDSA-N 447.488 2.137 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCC(O)(CN4CCOCC4)CC3)c2C)cc1 771499734 ULSZIDYDOSJCMU-UHFFFAOYSA-N 427.545 2.402 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCCNC(=O)c3cccnc3)cc2F)CC1 772081722 OLTBVUGIVOKPMB-UHFFFAOYSA-N 427.524 2.189 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)[C@H](O)c2nc3ccccc3[nH]2)cc1 779620461 SXNVRJRNLSBXBB-YUXAGFNASA-N 438.528 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)c4ccccc4C(F)(F)C3=O)CC2)cc1 782057702 MNSTURLBKWVKSH-UHFFFAOYSA-N 429.423 2.118 10 20 IECD CC(C)CN1C[C@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CCN2C1=O 786999966 PDFODQDWNFYUNM-GOSISDBHSA-N 447.555 2.074 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1noc(-c2ccccc2)n1 788321931 DJPGSRVHJZLFAC-INIZCTEOSA-N 435.484 2.067 10 20 IECD COc1ccc([C@H](C)CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788334676 ZEIGXQJEOWNVJD-GOSISDBHSA-N 425.529 2.458 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCC1(N2CCSCC2)CCCC1 789708360 WZMUMLPTLXEEIH-UHFFFAOYSA-N 428.649 2.219 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCN(C2CCC2)C1 789813277 RNRFLPRSJRYOLJ-IEBWSBKVSA-N 446.567 2.048 10 20 IECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789818373 JNTUEZLYUUFDQW-QWFCFKBJSA-N 448.583 2.436 10 20 IECD CN(C[C@H]1COc2ccccc2O1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854395 HLVBNKBECCXMQO-IBGZPJMESA-N 441.553 2.154 10 20 IECD C[C@@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)(N(C)C)C1 789862456 TWFCESNHYFAKFJ-JPYJTQIMSA-N 432.634 2.483 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803303225 ZZNWRAMEVKGQBF-KRWDZBQOSA-N 426.517 2.037 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H]1Cc1ccccc1 806493693 BBAYMVNUDVSTOT-UPVQGACJSA-N 449.599 2.457 10 20 IECD CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)OCC(=O)C(C)=O 808484725 GNQDSURSZVZHPL-GFCCVEGCSA-N 442.342 2.095 10 20 IECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 815351785 OTJCJQAJJICFJF-UHFFFAOYSA-N 430.530 2.449 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)COc4ccccc43)cc2F)C[C@@H](C)O1 917708659 DJKZBBNHNSRRCS-IYBDPMFKSA-N 427.476 2.481 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)cc1C 917758152 JYQDENJZWIKGAR-UHFFFAOYSA-N 428.488 2.270 10 20 IECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)NC1CCC2(CC1)OCCO2 918848865 ZNZJEHJMJGQQAU-UHFFFAOYSA-N 449.459 2.421 10 20 IECD CC1=CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1802079480 CBBMIVRLNQMQBK-UBUPODRFSA-N 442.512 2.153 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](CNC(=O)C(O)O)[C@H]2c2cccnc2)cc1 1802923171 OPKGCFWKSCPIBI-IFMALSPDSA-N 448.523 2.119 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)C1CC(O)C1 1803052254 NXTOBCJNPTZZFS-YQKAXRLLSA-N 445.903 2.237 10 20 IECD NC[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)c1ccccc1 1809881368 WAVUZGLMNXOQCF-LJQANCHMSA-N 438.528 2.080 10 20 IECD CNCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811804209 SEKDBGJLVLLYSI-MGPUTAFESA-N 446.935 2.465 10 20 IECD CCOC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823481408 MPVOLBQMNRDGJX-CQSZACIVSA-N 445.476 2.111 10 20 IECD Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426887 MEYLTDDUYSNLEG-GOSISDBHSA-N 425.489 2.138 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)cc1 7908321 DKJOLHYEPVLJIE-UHFFFAOYSA-N 425.576 2.262 10 20 IECD NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1Cl 725907427 AADLMQVWFLMHRJ-UHFFFAOYSA-N 425.963 2.471 10 20 IECD CS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)c(F)c1 728293455 RHTJZKQFLQTOLW-UHFFFAOYSA-N 427.523 2.276 10 20 IECD C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 729596873 MMZJVUSTSIVUJJ-WOJBJXKFSA-N 447.599 2.362 10 20 IECD COc1cccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)c1O 729861129 DSPLWSITKTVBHO-HNNXBMFYSA-N 442.534 2.256 10 20 IECD Cc1ccc(NC(=O)[C@@H](C)N(C)Cc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 731843103 VKLLIEUICIZAJF-QGZVFWFLSA-N 447.557 2.181 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1C 737181655 BILTXPUIFWQWBG-ZDUSSCGKSA-N 435.502 2.287 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(CC(=O)N2CCc3ccccc32)CC1 740919138 CNGZGXBRBZRCAM-UHFFFAOYSA-N 445.567 2.479 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743975772 VAYZDBZNKACMDT-INIZCTEOSA-N 446.454 2.371 10 20 IECD CN1CCOc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc21 746784173 SQUFXUGHXXFSKW-GOSISDBHSA-N 425.485 2.367 10 20 IECD COc1ccc(N2CCN(c3nnc([C@@H]4CCOC4)n3C[C@H]3CCOC3)CC2)cc1F 752835649 DCATXVCRXUWFQN-IAGOWNOFSA-N 431.512 2.293 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1F 755158285 OSQAPBGKXTYOBP-CPLUKWAASA-N 428.508 2.278 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(N4CCOCC4)c(F)c3)no2)c1 762254169 YSRRUKOJMOZARC-UHFFFAOYSA-N 434.449 2.456 10 20 IECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 764255791 FXZLBAKIOFAGFH-INIZCTEOSA-N 446.573 2.393 10 20 IECD CS(=O)(=O)Cc1noc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 765246924 KVPMHCYKTUAGQG-UHFFFAOYSA-N 445.448 2.006 10 20 IECD NC(=O)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 768545714 BPQWUAROEWXXHB-QGZVFWFLSA-N 449.485 2.350 10 20 IECD CCOc1cccc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1O 769209803 HCYPTUWINPXVGZ-UHFFFAOYSA-N 448.541 2.459 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](n3ccnc3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 772748013 YQHYWRWBGACROU-IBGZPJMESA-N 441.557 2.458 10 20 IECD CC(C)(C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCC(O)CC1 773488121 SJIRYKLXZDTSFE-UHFFFAOYSA-N 436.524 2.399 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 773741638 UYJNDQJQFNZIMD-NSHDSACASA-N 448.419 2.022 10 20 IECD C[C@@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 775258129 RCEHRQLXHNYXNF-MRXNPFEDSA-N 440.500 2.293 10 20 IECD CNC(=O)Nc1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778224003 OUQNBBGHTVJIIN-ZHACJKMWSA-N 437.500 2.290 10 20 IECD CCN(CC)C[C@@H]1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295558 QTVZHPHIVYBTTR-CFGKVWFZSA-N 428.577 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CO)c3c(F)cccc3F)CC2)cc1 778423724 VUMQSCQORPHGML-QJRAZLAKSA-N 445.466 2.028 10 20 IECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NCc2cc(Cl)cc(F)c2O)C1 779177550 FHWWYOFFKRHDKG-UHFFFAOYSA-N 428.869 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@](C)(O)c3ccccc3)CC2)cc1 779346585 PAFBNCDLEKYJSL-SDQWYYNMSA-N 437.540 2.314 10 20 IECD COc1ccc([C@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)N2CCOCC2)cc1OC 779494044 QFTDRWHSDRYVLQ-MSEQUDFZSA-N 428.485 2.318 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4cccc(Cl)c4)nn3)CC2)cc1 780504358 QIZUEGZQZRRWNP-UHFFFAOYSA-N 440.935 2.481 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 781355850 FEFYCNLDQCLHFI-CYBMUJFWSA-N 427.523 2.283 10 20 IECD COC[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H](C)O1 784660138 ZTZUQHZFLGNVTR-JSGCOSHPSA-N 426.516 2.130 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 787198048 MLFGWCVWQNBOPK-ROUUACIJSA-N 439.560 2.002 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 788312281 GJVOFNMUVMMZOT-HXUWFJFHSA-N 429.492 2.252 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 788321457 WLZKPTPINOLUBD-NRFANRHFSA-N 443.931 2.393 10 20 IECD CN(Cc1cc(F)c(F)c(F)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798407 HFQJISQZLKAMPL-UHFFFAOYSA-N 439.409 2.354 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccn4ccnc4c3)cc2F)C[C@@H](C)O1 789819496 NSAGILQVONGZDX-HZPDHXFCSA-N 439.491 2.020 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N(C)C)cc1 789840662 MAJSNVRBYJNACU-MRXNPFEDSA-N 442.535 2.346 10 20 IECD Cc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 793722082 JXZAPPGABHJOJF-ICSRJNTNSA-N 436.556 2.499 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCCC[C@H]1CCO 803451301 JAELQBYMOPHCMF-KRWDZBQOSA-N 425.476 2.137 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3(NC(=O)OC(C)(C)C)CCC3)ccc21 803688901 FAACPWDXWYQLDE-UHFFFAOYSA-N 430.549 2.249 10 20 IECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCSc2nccs2)C1 804083419 PSZPPLNQXYETSX-OAHLLOKOSA-N 434.587 2.393 10 20 IECD O=C(NCCc1csc(N2CCCC2)n1)C(=O)NCc1ccc(N2CC=CC2)cc1 806334323 DIZJZGNTVGJJKE-UHFFFAOYSA-N 425.558 2.095 10 20 IECD COC[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@H]1CCCO1 809451431 RLEMGHPFHDPJKN-LEWJYISDSA-N 429.517 2.185 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCCc5nn(C)cc54)n3)CC2)cc1 809464682 KFQPFMPHXAIUHD-SFHVURJKSA-N 436.516 2.171 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@@H](C)S(=O)(=O)[C@H](C)C1 810109720 FKVICUIVNPKWSO-RBSFLKMASA-N 440.521 2.296 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1sccc1NS(C)(=O)=O 915877272 NJKYAWKZEFXJEI-UHFFFAOYSA-N 425.532 2.001 10 20 IECD CCOc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1[N+](=O)[O-] 916676359 IWGNNKVDMKYMLX-UHFFFAOYSA-N 433.486 2.158 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(Cc4ccc(F)cc4)CC3)nc12 917084663 ACMMAEBAECVUAB-UHFFFAOYSA-N 427.480 2.459 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1 919944543 IPIZHEPSUBLPKR-UHFFFAOYSA-N 442.534 2.139 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)cc1 1324584543 LVJCATLEOKPQBD-UHFFFAOYSA-N 449.485 2.276 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ncccc1F 1811120818 CRYPHZJMYCHMLI-VBKZILBWSA-N 437.431 2.055 10 20 IECD Cc1ncccc1CCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1841947617 WAAYXIHNKVOLNT-UHFFFAOYSA-N 445.523 2.319 10 20 IECD Cc1c(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)nc2ccccn12 1843658304 CQOFTIACDJWJMK-VQHVLOKHSA-N 448.479 2.290 10 20 IECD O=C(c1cc2ccoc2cn1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039457 SNLRFPWOLLAYKC-HWKANZROSA-N 435.436 2.475 10 20 IECD CN(C)c1ccc(CNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)cc1 15135031 IRCUMNAVYBNNEG-UHFFFAOYSA-N 426.542 2.230 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)NCCc3c[nH]c4ccccc34)nnc2n1 104970227 BAZSUGGCXNKDOU-UHFFFAOYSA-N 439.549 2.315 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)c1ccc(S(N)(=O)=O)cc1S(C)(=O)=O 731447765 XCVFPXDECLNGIG-UHFFFAOYSA-N 437.587 2.364 10 20 IECD CC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 733664008 MYDLOJUIKTYMQE-UHFFFAOYSA-N 426.542 2.131 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c1 739085412 IXRUBOZRXGCBAY-HOTGVXAUSA-N 427.501 2.265 10 20 IECD COC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1C 740609461 MSKQYQMBYVRDDG-UHFFFAOYSA-N 431.514 2.284 10 20 IECD CC(C)CN(C)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 744219945 MNDJKULDLMVTAX-RQZCQDPDSA-N 435.571 2.321 10 20 IECD CCCn1c(N)c(N(CCOC)C(=O)/C=C/c2cnc(C(C)(C)C)s2)c(O)nc1=O 744353612 YLQSNYXCDOXKGH-BQYQJAHWSA-N 435.550 2.388 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H](C(F)(F)F)O1 745690540 CTANMLRPRICVLV-UKPHBRMFSA-N 428.455 2.250 10 20 IECD Cc1cc([C@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)o1 745691388 JWZCUPPHLIDZLN-FDDCHVKYSA-N 428.533 2.305 10 20 IECD CCN(CC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1)c1ccc(OC)cc1 747681640 DUFQOJQESAGQKJ-UHFFFAOYSA-N 428.508 2.444 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)CSc2nncn2C)c1 753637405 VMNLEAWZRSQKJD-ZDUSSCGKSA-N 441.513 2.318 10 20 IECD COC(=O)Nc1ccc(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753857414 LRKJDZPVEQMDFF-UHFFFAOYSA-N 430.480 2.451 10 20 IECD Cc1cc(C(=O)COC(=O)c2ncc(F)cc2F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 758625313 SNMXNFJKPXPYCD-UHFFFAOYSA-N 449.435 2.454 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccnc1OCC(F)F 765926642 OIFWUVNZSRTGGF-UHFFFAOYSA-N 430.205 2.449 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H](C)CO1 769674864 SDQUCXDNRDJDGP-CHWSQXEVSA-N 435.458 2.351 10 20 IECD CCOC(=O)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(OC)c1 769713820 QDZIBNMQROVYRJ-QGZVFWFLSA-N 436.486 2.197 10 20 IECD CS(=O)(=O)Nc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1F 771181413 PLQMRZMMXKPOTO-UHFFFAOYSA-N 425.554 2.114 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4CS3(=O)=O)cc2F)C[C@H](C)O1 775683047 PXJPQVMIKLNEOM-HOTGVXAUSA-N 447.532 2.406 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3C3CCOCC3)CC2)cc1 778423273 QALPELWMSYZZPJ-FMFFHWJCSA-N 427.545 2.318 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(-c4cccc(Cl)c4)nn3)nc12 781393662 YOWUVYLKAJYWQI-UHFFFAOYSA-N 442.819 2.203 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)C2)s1 782301997 GEZVCWQZQSYGTF-AWEZNQCLSA-N 439.511 2.295 10 20 IECD COCCOc1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 786842216 OKTGGFRZMWLWAK-UHFFFAOYSA-N 442.484 2.305 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H](O)C[C@@H]3C)c2C)c1 788274732 AFWYZJAWTHQFNX-DJJJIMSYSA-N 428.485 2.305 10 20 IECD CN(Cc1cccc(N(C)C)c1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845779 LSFRDUMVHNYDHM-UHFFFAOYSA-N 442.535 2.128 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@@H]1C 789950314 OCQVEXVXKSFTKO-KBXCAEBGSA-N 443.466 2.042 10 20 IECD COC(=O)c1nc([C@@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)sc1C 792555616 JBTPRWBSWSHEMV-ZDUSSCGKSA-N 439.515 2.293 10 20 IECD C[C@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793730030 BMVNCOOHCCFGNF-IBVKSMDESA-N 448.567 2.195 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803450425 YVGLWSCVIJTHRD-UHFFFAOYSA-N 438.519 2.362 10 20 IECD COc1cccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)c1 803661577 GUIYDYUTSBJOJQ-KRWDZBQOSA-N 428.508 2.302 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CCOC)[C@@H]3CC[C@H](C)C3)cc2F)CC1 805006976 BNRNHACHRNYNQU-AZUAARDMSA-N 448.583 2.247 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 806277922 JLIIAFUGHOJQGN-UHFFFAOYSA-N 437.562 2.477 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 806847166 ILABQMYLWJTIIN-UHFFFAOYSA-N 438.528 2.212 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccccc1CN1CCOCC1 807387037 WENOSWVOTFIFJY-UHFFFAOYSA-N 448.317 2.242 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccccc1-c1cnn(C)c1 808357390 FRYGUPUJRLPWMA-UHFFFAOYSA-N 447.539 2.199 10 20 IECD CSC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855311 WLXRMGXIGAJFQW-OAQYLSRUSA-N 430.618 2.189 10 20 IECD O=C(NC[C@]1(N2CCOCC2)CCSC1)N(Cc1ccccc1O)C[C@H]1CCCO1 916636636 HMHVRIBFPQCZQL-DENIHFKCSA-N 435.590 2.291 10 20 IECD COc1cccc(N2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)c1 917000333 IAJWJMKCQBOABL-UHFFFAOYSA-N 442.535 2.109 10 20 IECD O=C(CC[C@H]1Cc2ccccc2NC1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340865 XBBPEXNFWVQLRC-IBGZPJMESA-N 441.553 2.129 10 20 IECD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 919860452 YYTLRUOLHXWDSE-UHFFFAOYSA-N 435.521 2.279 10 20 IECD CCN(CC)C(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920316634 CNFVSGJCSHKGRQ-UHFFFAOYSA-N 431.558 2.484 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 920454908 OHIWCGBDAKPNJV-CZAAIQMYSA-N 427.545 2.075 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)O[C@H](C(=O)N3CCC[C@H](C(N)=O)C3)C(C)C)sc2n1 924232439 FKCVHJURYNNFTI-BBRMVZONSA-N 432.546 2.401 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1c[nH]cc(Cl)c1=O 1116942605 ASWBLJUGVNCDDL-UHFFFAOYSA-N 442.882 2.214 10 20 IECD Cn1cc(N2CC[C@@H](NC(=O)c3ccc4c(c3[N+](=O)[O-])C(=O)c3ccccc3C4=O)C2)cn1 1322958527 WNYKNQUSUYDJHH-CYBMUJFWSA-N 445.435 2.112 10 20 IECD CCOC(=O)C1=S=C(NC(=O)c2ccc(-c3nc(C)no3)cc2)C(C(=O)OCC)=C1C 1337208488 AYDFPXDAIRPOLC-UHFFFAOYSA-N 443.481 2.267 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2 1782003049 MJXFDANDXYSHRG-GOSISDBHSA-N 430.835 2.240 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1cc(O)nc(O)c1 1817843653 VDPSNKYETOMOSS-JTQLQIEISA-N 431.346 2.422 10 20 IECD Cc1ccc(OCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1842748752 KTZGEEDTPAAHCO-UHFFFAOYSA-N 446.507 2.370 10 20 IECD CN(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(Cl)cc1 1845842545 CKLOSVGLRBMELR-IBGZPJMESA-N 444.919 2.266 10 20 IECD O=C(COCc1ccccc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038886 DZGSDCOVDFVZHR-CSKARUKUSA-N 438.480 2.237 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(=O)n(-c4ccccc4)n3)cc2F)CC1 303309389 OQCDJYPGVLXDEM-UHFFFAOYSA-N 435.503 2.444 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CN3C(=O)[C@@H](C)Oc4ccccc43)cc2F)CC1 303313697 PTIXRYVAISLWCL-QGZVFWFLSA-N 440.519 2.398 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 726240293 VDONNLAIKXGOOO-QHAWAJNXSA-N 431.625 2.483 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(C4OCCO4)CC3)cc2F)C[C@@H](C)O1 726789592 OOHJPHXFTCOGRT-IAGOWNOFSA-N 435.540 2.140 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1OC 727946906 HJUFWYDATLBMPO-OAHLLOKOSA-N 443.500 2.365 10 20 IECD CCOc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730391597 OEOLIOYOEPNLFQ-UHFFFAOYSA-N 429.496 2.016 10 20 IECD CS(=O)(=O)c1nc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c2ccccn12 731858351 KNQGZDMTVNSLRN-MRXNPFEDSA-N 429.498 2.265 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1 732575580 FHOVCLVOQNGZKW-SFHVURJKSA-N 437.544 2.295 10 20 IECD CCN1CCC[C@H]1CN1C[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 733131731 HIIXRVVPJVCKPX-CTNGQTDRSA-N 430.618 2.189 10 20 IECD COC(=O)[C@H]1CC12CCN(C(=O)NCCCN1CCN(c3ccc(OC)cc3)CC1)CC2 733846695 RGAJLOZTAHJROT-OAQYLSRUSA-N 444.576 2.192 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)c1 735764422 HKHUFONJZQGXAF-UHFFFAOYSA-N 438.440 2.495 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)c1O 737278720 NVJNBPBINJAQJN-UHFFFAOYSA-N 437.246 2.189 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1N1CCCS1(=O)=O 741095240 HRAHPBBEWXCSLE-UHFFFAOYSA-N 444.557 2.198 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1F 742253573 RGCQGSUODUKKSQ-LJQANCHMSA-N 429.496 2.479 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nc(C)n(-c4ccc(F)cc4)n3)CC2)cc1 742927254 LDUDARCXJQTQKR-UHFFFAOYSA-N 438.507 2.275 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NCCCSc2nccs2)c1 751084901 HYABWCSOUSMYMA-UHFFFAOYSA-N 430.529 2.177 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1 752831479 MEYNCGURKRMPPI-UHFFFAOYSA-N 434.449 2.315 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@@H]2CCOC2)n1C[C@H]1CCOC1 752848021 GDXWQGMMDYSCAX-WOJBJXKFSA-N 427.549 2.292 10 20 IECD C[C@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 753478304 RSMRXVMVPZIMDM-INIZCTEOSA-N 432.542 2.461 10 20 IECD COC[C@](C)(NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)OC 757012878 RXLZIEUGNUXQTB-HGZMWJMZSA-N 442.584 2.424 10 20 IECD C[C@@H](OC(=O)c1coc(C(N)=O)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759769831 XCJHBAUQZOWWAF-LLVKDONJSA-N 432.388 2.338 10 20 IECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1cccc(Br)c1O 765751198 RZDIVJBIWNTUKL-HNNXBMFYSA-N 431.294 2.059 10 20 IECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765926563 NBXNLNBEOPHBAL-UHFFFAOYSA-N 430.262 2.205 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c4nccc(Cl)c34)cc2)C1 769637618 IBQBCCMHSINTTJ-CQSZACIVSA-N 447.948 2.397 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)c1 775371826 UWTGSFYZXHENEL-LSDHHAIUSA-N 438.571 2.329 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 785296602 OGACQYBMMGYERP-OAGGEKHMSA-N 427.501 2.397 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 787981740 YAJVZDIISLWCFF-QHCPKHFHSA-N 438.572 2.291 10 20 IECD CCCCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788314122 YTWFPVZRDSWTQL-UHFFFAOYSA-N 426.517 2.030 10 20 IECD CCOc1ccc2c(c1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCO2 788318611 GALNATLWMSFTBD-OAQYLSRUSA-N 439.512 2.178 10 20 IECD COc1ccc(C2(CNC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CCC2)cc1 788319223 BNAXSCSSYZFHGF-UHFFFAOYSA-N 437.540 2.386 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(-n2cccn2)c1 788319610 MIQQGMYDHSKSQN-SFHVURJKSA-N 433.512 2.203 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CC[C@H]3CCCCN3C)cc2F)C[C@@H](C)O1 789824312 IACKAEPPIAWFTH-QWFCFKBJSA-N 448.583 2.388 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)C(C)(C)CN(C)C)cc2F)C[C@@H](C)O1 789824874 KUEUJFVEHLRDAT-BRWVUGGUSA-N 436.572 2.148 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H](C)S1=O 791178665 VVAHXYBFFVXLMM-VXGBXAGGSA-N 428.557 2.236 10 20 IECD CC(C)c1ncc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 796973046 XAVTXQSAVXIXPU-UHFFFAOYSA-N 436.560 2.387 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1F 797353972 VSLABGOTQFLXDO-UHFFFAOYSA-N 443.200 2.474 10 20 IECD O=C(CN1CCC[C@@H](CN2CCOCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 800477850 IRNJPTRHRCHARX-SFHVURJKSA-N 447.535 2.445 10 20 IECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687880 QHIJZOSUNOEEHT-LJQANCHMSA-N 436.556 2.337 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 806846247 HMOHZPXDQDGZBD-UHFFFAOYSA-N 427.480 2.409 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 807287279 IRYFPYUZUNDPTF-DHIUTWEWSA-N 435.524 2.030 10 20 IECD O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCSCC2)cc1 916517335 SBTJZFMRXIKEBX-UHFFFAOYSA-N 448.614 2.159 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 917365108 UZDFPKZFTPFPRP-LJQANCHMSA-N 432.542 2.495 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918138778 SNZWGZYRDKRBDW-UHFFFAOYSA-N 435.521 2.199 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(C(N)=O)c3)cc2F)C[C@H](C)O1 919063178 VOZLAOUPHFVQLF-GJZGRUSLSA-N 443.475 2.011 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cn1C 1804286738 ZRJAGOQVKOUGFY-DTUWPTEXSA-N 425.485 2.416 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ccnnc3)C2)CC1 1808174500 JSIFJFAYJQZHQG-UHFFFAOYSA-N 446.511 2.114 10 20 IECD Cc1nccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1827884405 CYEWBHMMXFXDMT-GOSISDBHSA-N 425.489 2.138 10 20 IECD CN(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccccc1Cl 1843250706 GDNSXHFDMFGLJT-IBGZPJMESA-N 444.919 2.266 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cnc(Cl)s2)C1 1844537509 VRXDPOAJRGTEJJ-HWKANZROSA-N 435.889 2.444 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)cc3F)CC2)cc1 12069519 AVMVRIGKJRHUIP-UHFFFAOYSA-N 432.471 2.240 10 20 IECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 729532062 RUZDHTXFVBRRIA-NRFANRHFSA-N 435.532 2.069 10 20 IECD NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 732233478 TYCHMWNELOSLPY-INIZCTEOSA-N 438.937 2.479 10 20 IECD CCOC(=O)c1c(NC(=O)COC(=O)c2cc(O)cs2)sc(C(=O)N(C)C)c1C 732353982 MPGDAHLSGIIQAM-UHFFFAOYSA-N 440.499 2.498 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCCS(=O)(=O)C1 733959264 UUGNIVPWWKDVHI-HLVNSREUSA-N 444.625 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](c4nncn4C(C)C)C3)CC2)cc1 735872592 MHENOSJBQHSHRP-LJQANCHMSA-N 426.565 2.396 10 20 IECD CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCc2cccc(OC)c2O)CC1 737286411 ZWGSJMSHSZCFPL-UHFFFAOYSA-N 446.935 2.451 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 742071093 FTAVJPDIQHZLAF-QGZVFWFLSA-N 447.605 2.256 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)Cc2nc3ncccn3n2)NC(=O)OC(C)(C)C)cc1 742749971 KPJJXOZJGXTCAK-QGZVFWFLSA-N 439.520 2.115 10 20 IECD O=C(Cn1nnc2ccccc2c1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742802350 XFEXAIGJIAXPKC-CQSZACIVSA-N 429.427 2.178 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c(OC)c1 743900782 QEVJWDWSEXOGCJ-UHFFFAOYSA-N 441.484 2.128 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@H](CO)C3)c2C)c1 746462922 SHLRFHOVRNRPNP-INIZCTEOSA-N 428.485 2.164 10 20 IECD O=C(Cn1c(S)nc2ccccc2c1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746686849 VHXZIIFEVVVKTD-UHFFFAOYSA-N 442.516 2.102 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 748527474 IBBDGRKXERBBQQ-HXUWFJFHSA-N 431.558 2.482 10 20 IECD CC(=O)CSCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 749094052 HVULJNNYYNNZAX-VIZOYTHASA-N 438.552 2.055 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 751186138 HIMWTHHGQMMRQN-QPJJXVBHSA-N 437.426 2.095 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751229179 XEMNTDBRZQBERJ-UHFFFAOYSA-N 436.505 2.442 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@H](C)O1 753078059 KYUHWDJQGDGLSF-STQMWFEESA-N 432.418 2.313 10 20 IECD CCS(=O)(=O)N1CCC(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 758741973 IHBMOWSRRUJBOZ-LJQANCHMSA-N 439.578 2.145 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760557246 BKMZMNKPZJYXKH-ORAYPTAESA-N 446.525 2.473 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 761984163 XIDUGOYDAMXKOQ-ZDUSSCGKSA-N 429.951 2.149 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CCSC)c3nnc4ccccn34)nc12 763022005 SXIMLFCAMFMTCO-HNNXBMFYSA-N 441.517 2.238 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](O)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 768639999 NNAUJXDQZMZPII-NRFANRHFSA-N 442.493 2.201 10 20 IECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OC)c1 773756657 LVTAOYYYPVFTRZ-RDTXWAMCSA-N 428.485 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccnc3Br)CC2)cc1F 774310329 DHMPWUVEVPUBOA-UHFFFAOYSA-N 437.269 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCCc4nc(C)ncc43)CC2)cc1 778284714 QQPUDJQIXQRXGD-YRBAHSOBSA-N 435.528 2.192 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C12CCC2 778290566 XIMPUCVIFMWQNK-KNLQKXEQSA-N 427.545 2.364 10 20 IECD Cn1nc(Br)cc1/C=C1/SC(=S)N(CCCN2CCOCC2)C1=O 779204133 OVBSMRASSCPRGA-FMIVXFBMSA-N 431.381 2.106 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(OC[C@H]4CCCCO4)CC3)CC2)cc1 779222230 JLXBZXDEMXBXNO-RCZVLFRGSA-N 447.620 2.228 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(OC4COC4)cc3)CC2)cc1 781740845 BWVFJHHRCXWWKR-ZHACJKMWSA-N 437.496 2.316 10 20 IECD CC(C)CN1CCO[C@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 785413755 IINPPBOOFBWTDM-JOCHJYFZSA-N 430.593 2.108 10 20 IECD CCOC(=O)c1ccc2c(c1)N(Cc1cc(O)n3ncc(C(=O)OCC)c3n1)CCO2 787998730 IHXFIEUBDWEMSU-UHFFFAOYSA-N 426.429 2.187 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCN2CCC[C@H]2C1 788585478 VNYHJDPBVJMISO-WMZOPIPTSA-N 436.503 2.116 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@H](C2CCCCC2)C1 789798331 FSOYQVSNRMPCFO-NRFANRHFSA-N 433.524 2.086 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(CCO)Cc3ccccc3)cc2F)C[C@@H](C)O1 789812751 OMFHZNKLRPTHAY-HDICACEKSA-N 443.519 2.077 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)sc1C 789821664 UKPLPRMXRBJUHM-STQMWFEESA-N 434.537 2.445 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(c4c[nH]nc4C)CC3)CC2)cc1 790696895 KYKWJGITDMNZRT-UHFFFAOYSA-N 426.565 2.438 10 20 IECD COCCOc1ccccc1CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 793803448 RJFPVLVWFACXMN-UHFFFAOYSA-N 441.528 2.076 10 20 IECD COc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nc1 803449804 OILUEXFKMCGRQV-UHFFFAOYSA-N 434.443 2.093 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@H]3c3ccccc3)CC2)cc1 803750538 NFOVONZJJGRKHQ-QHCPKHFHSA-N 436.556 2.297 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807634515 HJBQGRUCUYFHCL-HKUYNNGSSA-N 442.512 2.492 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 812493855 YBQCQKHIYHSZRC-HUUCEWRRSA-N 428.526 2.202 10 20 IECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 813656392 XGENWAULEREGNE-MRXNPFEDSA-N 448.541 2.496 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc(C(N)=O)c3)cc2F)C[C@@H](C)O1 918023464 PPQVBLMDPLHSMQ-IAGOWNOFSA-N 442.535 2.286 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918029746 RLTOOPAPJSFTSR-KRWDZBQOSA-N 444.557 2.422 10 20 IECD NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 918213371 BNBNYECJRHGCJB-AWEZNQCLSA-N 443.470 2.132 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1 918284570 JTJHQPOQGNVKCZ-UHFFFAOYSA-N 440.475 2.044 10 20 IECD C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1=O 919971576 RGBZDFOETMASHB-HNNXBMFYSA-N 427.476 2.217 10 20 IECD C[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 920881428 NKJPXGWURDNIAD-AWEZNQCLSA-N 433.486 2.326 10 20 IECD CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)no1 1777847590 GMYDIDXDCKFAKR-VGOFRKELSA-N 444.488 2.046 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@@H]3CCCOC3)cc2)CCC1 1792300015 STLRXYHCKJSBFV-CQSZACIVSA-N 447.582 2.407 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(-n2cccn2)cc1 1796604843 QXAFGVFTTFBSGM-GGPHIMKMSA-N 433.468 2.244 10 20 IECD CC[C@@H](NC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815315924 HPQYUQBEBAQMMO-CMPLNLGQSA-N 438.937 2.432 10 20 IECD O=C1CC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)C1 1823410079 ZSHQTLABSPQYLT-BIENSFFJSA-N 440.456 2.211 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cccc(F)c1 1836261945 VYIDJHSPDUPVQC-UHFFFAOYSA-N 442.491 2.131 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CNCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O 725841433 DLIQHSCGDHTWKH-UHFFFAOYSA-N 441.893 2.265 10 20 IECD O=C(NCCCn1nc2n(c1=O)CCCC2)N(Cc1ccco1)Cc1ccccc1O 726102114 STMRYNFNFAJTJX-UHFFFAOYSA-N 425.489 2.482 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3COc4c(cccc4OC)C3)CC2)cc1 728396983 JQUMZLMLHIXBKP-IBGZPJMESA-N 440.544 2.129 10 20 IECD NC(=O)COc1cccc(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c1 728876441 BNPZOYOLHMEYPM-UHFFFAOYSA-N 432.480 2.295 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)cc21 743882869 FACBKIDDNQYDBE-UHFFFAOYSA-N 433.512 2.242 10 20 IECD CCN(CC(=O)c1c(O)nc(=O)n(C2CC2)c1N)Cc1cc(Br)ccc1O 744425127 BONDLIDSWLZJEV-UHFFFAOYSA-N 437.294 2.039 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCNC(=O)[C@H]3c3cccs3)cc2F)CC1 745807192 AAURFQKBCOBGOY-HXUWFJFHSA-N 445.564 2.412 10 20 IECD CCOC(=O)C1=C(CN2CCOc3cc(N(C)C)ccc32)NC(=O)N[C@@H]1c1ccco1 746492792 MBHUDUFWGLYFLV-HXUWFJFHSA-N 426.473 2.416 10 20 IECD CC(=O)CSCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 749094050 HVULJNNYYNNZAX-CHHVJCJISA-N 438.552 2.055 10 20 IECD COC(=O)c1nscc1S(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751372827 PLABFHRAKITMDN-ZDUSSCGKSA-N 445.950 2.232 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)cc1F 753732610 VIMFMDFNHFRXED-UHFFFAOYSA-N 448.476 2.282 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccc(N4CCOCC4)cc3)CC2)cc1F 753861326 QKVGXVXWAZFJBG-UHFFFAOYSA-N 428.508 2.432 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@@H]1CCCS1(=O)=O 766349326 GERRHXNRUAAYSY-LFGHMXSPSA-N 444.625 2.423 10 20 IECD Cn1cc([C@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 766762810 GUQRNLYOAQMFJY-XMSQKQJNSA-N 445.539 2.318 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC(O)(C(=O)OC)CC3)c2C)cc1 769970268 JBUYKJFMXWJCDY-UHFFFAOYSA-N 428.485 2.063 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nc21 771066263 QHHRIOGVCOTLTH-HNNXBMFYSA-N 444.923 2.141 10 20 IECD CC(C)N(CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 774792106 ZVEPTOALDHDENY-HDICACEKSA-N 436.572 2.291 10 20 IECD COc1ccccc1N(CCC(N)=O)C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775254436 IZLQNHQRNALOFX-SFHVURJKSA-N 440.544 2.091 10 20 IECD COC(=O)c1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1O 778403071 FJXMWRMSYJCJRZ-ZHACJKMWSA-N 439.468 2.031 10 20 IECD O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)OCC(=O)c1ccc(O)c(O)c1 782087162 MMONOSBASIILPU-UHFFFAOYSA-N 434.408 2.291 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C)c1ccc(N2CCOCC2)cc1 785596923 CAFGLCJMAACPKX-GCJKJVERSA-N 447.539 2.340 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](Oc4ncccc4F)C3)CC2)cc1 785837681 GIZBCDWWVPFLTA-RBBKRZOGSA-N 444.551 2.256 10 20 IECD CCOC(=O)[C@@H](CC)N(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787678188 CPBQXUREZSSGKK-BIGNBACZSA-N 443.544 2.233 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1(c2ccc(F)cc2F)CC1 789800151 MCMDPCRTBCWALX-UHFFFAOYSA-N 447.457 2.405 10 20 IECD Cc1ccc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)o1 789860945 OKFQYTUFSDTXSA-IBGZPJMESA-N 429.542 2.358 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(CNC(=O)C(F)(F)F)CC1 798373288 VHGPIUSKXDDAHD-UHFFFAOYSA-N 446.445 2.262 10 20 IECD CCS(=O)(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC1 800762007 BPDVJKXJRGFIQW-UHFFFAOYSA-N 428.562 2.361 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3ccc(Cl)cc3)CC2)cc1 803747985 YWVQLQOPWHNEOJ-UHFFFAOYSA-N 444.963 2.245 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCO[C@@H](CC(C)C)C3)cc2F)CC1 805006810 GYUHGOBXOYIYHK-PMACEKPBSA-N 448.583 2.294 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O 807289153 KNTYAAWBAZVBIB-HXUWFJFHSA-N 436.487 2.130 10 20 IECD CN1CCC[C@@H](CN(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771966 ZOLZKJHMCIKRBZ-SJORKVTESA-N 438.519 2.173 10 20 IECD O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807841496 CGXILZCUBVFEFV-LJQANCHMSA-N 439.512 2.421 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1 815550458 PVMYOCDGGJLTPM-UHFFFAOYSA-N 445.273 2.343 10 20 IECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1 915731908 HCOFUZVSHHPGRS-UHFFFAOYSA-N 446.573 2.428 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1 918309970 IKCIDKNLGWQQTI-UHFFFAOYSA-N 438.484 2.077 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1Cc1ccccc1 918337025 BNTFOVKQUHLTGI-UHFFFAOYSA-N 438.553 2.405 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2cccnc12 918464123 QZUYUFFAGAKOHJ-GOSISDBHSA-N 445.523 2.500 10 20 IECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319949616 ACIAMEJMPPKNIZ-IRLDBZIGSA-N 445.627 2.390 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)NC2CC2)c1 1320275000 VQVLJNXQVMBYDH-KRWDZBQOSA-N 427.457 2.286 10 20 IECD O=C(Cc1ccccc1O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782009103 RVWAFXGERPACBK-JOCHJYFZSA-N 446.887 2.143 10 20 IECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807989294 AAHGBIPQXROJII-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cncc(F)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807989785 CZMSEZDKUBSGFW-VBKZILBWSA-N 437.431 2.055 10 20 IECD CC[C@H](C)[C@H](N)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809714198 XYSHDRRPBZUSSW-PHYPQJFDSA-N 445.560 2.421 10 20 IECD CCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816604993 JCRWJPWDTSHVMS-CQSZACIVSA-N 426.433 2.386 10 20 IECD CC(C)/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823500509 BWMZHLYHRCFRQU-UZYOAWRESA-N 435.575 2.474 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cc(Br)c(=O)n(C)c2)n(C)c2ccccc12 472776520 RYJNOSUVBCUUNM-UHFFFAOYSA-N 431.290 2.203 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCN([C@H]4CCN(C)C4=O)CC3)ccc21 579624806 VBOHIIGEPCYGPG-QFIPXVFZSA-N 426.561 2.329 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)Nc4cccc(C)c4)CC3)nc12 726866898 TZGFRWWRCPVQCR-UHFFFAOYSA-N 438.488 2.270 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCCc3ccc4c(c3)CC(=O)N4)CC2)cc1 729346966 JJDPRYIOLMWHEZ-UHFFFAOYSA-N 436.556 2.451 10 20 IECD CCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1 729519694 ALBPQPUCKOVGCI-UHFFFAOYSA-N 433.559 2.493 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cccc4c3OCCO4)CC2)cc1 729875790 DBTFFMNCYYJVEZ-SSEXGKCCSA-N 430.526 2.064 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@@H](NC(N)=O)c3cccs3)cc2F)CC1 730235391 VHCRSFAPJRKDLF-QGZVFWFLSA-N 433.553 2.445 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NCCS(=O)(=O)N3CCSCC3)c2C)cc1 730550766 HZIYEUZIYLDLEM-UHFFFAOYSA-N 437.587 2.211 10 20 IECD CN(c1ccc(CNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc1)C1CCCCC1 742416013 IZBAUHKUTXUZOH-UHFFFAOYSA-N 435.528 2.331 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)CCCn3ccnc3C)CC2)cc1 747394516 PUXSYNMNXSKGRF-UHFFFAOYSA-N 428.581 2.444 10 20 IECD CS(=O)(=O)CC1(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 752020391 PLSNYJSANTXNCU-CQSZACIVSA-N 431.505 2.381 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)c2)CC1 768015451 HBVNHRJRDNYDJO-UHFFFAOYSA-N 437.587 2.421 10 20 IECD C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771395034 JQTMQNWNZJTNAK-KGLIPLIRSA-N 448.501 2.266 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)ncn4C)cc2F)CC1 772936601 IVPJALMJNGBGST-UHFFFAOYSA-N 431.537 2.333 10 20 IECD COC(=O)[C@H]1C[C@@H](C)CCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 775807747 VLOXMUFVFIVOKG-VBKZILBWSA-N 447.557 2.198 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCC(=O)OC(C)(C)C)CC2)cc1 778323698 JRNLZLWCPDDMQQ-ZHACJKMWSA-N 431.533 2.090 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@@H](C)CCC[C@H]3C)CC2)cc1 785531336 UWKWZZCDIWFECD-VQTJNVASSA-N 430.593 2.361 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788256707 XCOWZZGZFCDBBU-SFHVURJKSA-N 430.549 2.419 10 20 IECD Cc1cc(C)nc(-n2nccc2NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 789309869 NHYLKLGCAQPQHM-SFHVURJKSA-N 448.531 2.303 10 20 IECD CCc1nc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)sc1C 789726246 BXMJWEJGKLQNFA-UHFFFAOYSA-N 448.545 2.327 10 20 IECD CCCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789824246 HMAHDLHACAAJCR-BJLQDIEVSA-N 448.583 2.246 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC[C@H]3c3ccco3)cc2F)C[C@@H](C)O1 789828709 YEEWETBRVFOZKB-YRNRMSPPSA-N 445.491 2.249 10 20 IECD CC(C)[C@H](NCc1cc(Cl)cc([N+](=O)[O-])c1O)C(=O)N(C)Cc1nnc2n1CCC2 793247792 SWSGDHVNCLSCSJ-KRWDZBQOSA-N 436.900 2.264 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c1 800894676 GHXXIXILILNHHZ-UHFFFAOYSA-N 425.576 2.262 10 20 IECD CC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803747257 POGUYUWOSLNWBN-NRFANRHFSA-N 438.572 2.071 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(CN4CCOCC4)CC3)cc2)CC1 805024693 TZTDQMFTHJNMFO-UHFFFAOYSA-N 442.604 2.110 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCCc2c[nH]nc21 806427601 LJBAJFKRQIPXEH-RHSMWYFYSA-N 433.459 2.290 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807291386 IMYQOEZDNUCQFC-UHFFFAOYSA-N 446.551 2.408 10 20 IECD Cc1ccc(N2CC[C@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)cc1 807585891 JSZJWAHDRVQJMM-QFIPXVFZSA-N 434.540 2.474 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](c2nc(O)n[nH]2)C1 808777835 XADIPXVSKOTUEG-ZIAGYGMSSA-N 445.479 2.492 10 20 IECD Cn1nc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C1CC1 810397146 UCQDZIONQYTCPA-INIZCTEOSA-N 431.924 2.376 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1NS(C)(=O)=O 919968999 AHEKSFQRKDQDGP-UHFFFAOYSA-N 435.521 2.397 10 20 IECD C[C@@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 920920584 NWVWYHXEKRZPSV-APWZRJJASA-N 443.500 2.052 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)on1 1817843659 VMBYKRZELSZPOW-HNNXBMFYSA-N 426.433 2.061 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(OC2CCN(C(=O)c3cnc[nH]3)CC2)CC1 1837449329 HVFKDKVQKSNMOY-UHFFFAOYSA-N 448.907 2.400 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)COc2ccccc2)C1 1842682415 HMYXDBZUSCYLFL-UHFFFAOYSA-N 432.480 2.062 10 20 IECD COc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc(NS(C)(=O)=O)c1OC 437017810 JTEWUBGLDLHISJ-UHFFFAOYSA-N 435.502 2.181 10 20 IECD CCCN(Cc1ccccc1O)C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727169987 AEBKNYLPRHQUFJ-UHFFFAOYSA-N 434.294 2.037 10 20 IECD COc1ccc(N2CCCN(C(=O)CSc3nnnn3CC(F)(F)F)CC2)cc1 729947803 FNAYHIYRRXSCGD-UHFFFAOYSA-N 430.456 2.075 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 734702344 XUVUDQKDNWPCBO-UHFFFAOYSA-N 444.557 2.100 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)n[nH]1 737118375 UJOCMFXBSUISAE-UHFFFAOYSA-N 434.500 2.214 10 20 IECD O=C(COC(=O)c1ccccc1SCCO)NCc1ccc(N2CCOCC2)c(F)c1 740967846 VGZXKSSKHIQCBS-UHFFFAOYSA-N 448.516 2.220 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC3CCN(C(=O)C(C)(C)C)CC3)CC2)cc1 742940176 QWBDBGWWKKUAIH-UHFFFAOYSA-N 445.608 2.154 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1 747482332 YYBQCNBEIIMAEG-FQEVSTJZSA-N 439.512 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3COc4cc(F)cc(F)c43)CC2)cc1 753304793 WELUNBXHKAPDEI-GHOSXJJBSA-N 443.450 2.428 10 20 IECD CC[C@H]1CC[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)O1 757126781 ANILRDKNEFEFEY-OXJNMPFZSA-N 434.514 2.425 10 20 IECD COc1cccc(-c2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)n[nH]2)c1 764939597 MRTAEBDLLYSSFF-UHFFFAOYSA-N 440.525 2.250 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 769164819 VYNZJSNNHZMBDE-DHIUTWEWSA-N 430.593 2.433 10 20 IECD C[C@H](NC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 772999165 ZOOYEHQKGJZSQL-WMLDXEAASA-N 428.455 2.437 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 774148065 ZGYGBXHBGBDWHL-GDLZYMKVSA-N 435.546 2.371 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1 774357797 IPGOERBVHZYFAR-UHFFFAOYSA-N 436.556 2.125 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H](CC(F)F)C(=O)O 780444081 QCQSCIMYPBXAOH-ZDUSSCGKSA-N 425.354 2.450 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 781520215 CLLWWMKEAMDTNJ-UHFFFAOYSA-N 447.495 2.296 10 20 IECD O=C(Nc1ccc(OC2COC2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 782104574 GZJZSVQQBYDJNF-LJQANCHMSA-N 426.469 2.316 10 20 IECD COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1-n1cnnn1 783315333 DRNGDNRRIKVKFK-UHFFFAOYSA-N 437.504 2.113 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 785522332 FPMPZPACTZFQBI-INIZCTEOSA-N 446.573 2.016 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@H]3CCC[C@H](C)C3)CC2)cc1 785529811 YLMAVQCLVNJUOX-PMACEKPBSA-N 430.593 2.266 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc(OC)c3OC)CC2)cc1 787020894 VDJOMNGWNUOELJ-UHFFFAOYSA-N 427.501 2.114 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccc(CN2CCOCC2)c1 787288631 AHOSBPANCYKHPQ-UHFFFAOYSA-N 425.529 2.279 10 20 IECD Cc1cccc(C)c1OC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797699 DASBYGJWPZJITK-GOSISDBHSA-N 443.519 2.479 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819208 MLYFSMNSZLJSMP-ZIFCJYIRSA-N 434.556 2.046 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(F)cc2C(F)(F)F)ccc1O 790408430 YZHOMDFYUDRFPA-UHFFFAOYSA-N 428.385 2.259 10 20 IECD CC(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793717125 GYELERBBPTYXAX-VAMGGRTRSA-N 428.577 2.336 10 20 IECD Cc1cccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 793727900 WDVQYYVIZKDCBK-VXKWHMMOSA-N 448.567 2.329 10 20 IECD COc1ccc(CNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1 794388962 DIPLGCNFMLJVKI-NSHDSACASA-N 432.420 2.403 10 20 IECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)nc1 797653484 VSJLCJADJXJQHC-UHFFFAOYSA-N 435.575 2.207 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4cc(OC)ccc4C3)CC2)cc1 801967781 MLYNJTDNODGHRL-NRFANRHFSA-N 427.545 2.081 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(N2CCOCC2)cc1 803299127 ZIQCYAKDPYUERK-JXHRLWIKSA-N 440.588 2.176 10 20 IECD COC(=O)c1cc2c(cc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O)OCO2 807512209 OGBGIHRSXAJZRA-UHFFFAOYSA-N 441.223 2.469 10 20 IECD CC[C@]1(CO)CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768411 JGKBQSZUULTUMN-QVKFZJNVSA-N 425.476 2.137 10 20 IECD CN1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@@H]1c1ccccc1 808057318 VYQWRVZLMSMGLI-FUDKSRODSA-N 437.540 2.461 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)Nc3cnc4c(c3)c(=O)n(C)c(=O)n4C)c2C)cc1 838974464 IEDPBVAIRHWPND-UHFFFAOYSA-N 433.468 2.301 10 20 IECD Cc1ccccc1[C@@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(N)=O 914642913 NLAZPLLPHUWLLK-HXUWFJFHSA-N 426.517 2.362 10 20 IECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917713004 ZFWAEWNSHCXIMI-UHFFFAOYSA-N 446.870 2.230 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1 918429402 IPRNKLRJOAOBGZ-UHFFFAOYSA-N 433.512 2.444 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(-c2nnco2)c1 918439110 SGXOOBVVFWDIQU-UHFFFAOYSA-N 439.447 2.092 10 20 IECD CC(=O)NCCN(Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@@H](C)C(=O)OC(C)(C)C 1320822947 QAZNZOBAOJMAQL-KRWDZBQOSA-N 436.572 2.246 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1 1336289731 PIGHSYJJWKJAAF-UHFFFAOYSA-N 427.530 2.485 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc([S@](C)=O)cc3)CC2)cc1 1337366973 YJCLDAIAQIFKBM-NRESKRBGSA-N 427.526 2.276 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)C1CC2(CCC2)C1 1782793849 LPJOOMVLNXVWOZ-UZUQRXQVSA-N 429.517 2.201 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243081 QLYIUWKNFPQCPZ-NRLVLPFVSA-N 434.920 2.391 10 20 IECD Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1808532507 CKPBSEVNACUQRE-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CCSCC1 1814235514 NWEGFFVKFVZMHV-UZLBHIALSA-N 442.541 2.351 10 20 IECD Cc1cnc2c(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)cnn2c1 1844059040 ODPHCYGJKGKKJN-UHFFFAOYSA-N 441.875 2.233 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)n(C)c2ccccc12 570669846 PLTUHFGBDKJGJE-NRFANRHFSA-N 448.567 2.163 10 20 IECD CC(C)c1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1[N+](=O)[O-] 727177393 HMCNHODOAYBZNW-ZROIWOOFSA-N 429.545 2.469 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc(O)c(OC)c3)CC2)cc1 734215832 JOCOHVKGUFSDQQ-UHFFFAOYSA-N 428.533 2.073 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 737110612 HADICBFDQWYIQW-INIZCTEOSA-N 430.432 2.464 10 20 IECD CCNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 738904695 JXVVMHWKECRRPI-UHFFFAOYSA-N 444.557 2.301 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCCCSc1nccs1 750255043 CUXXZSWGLUDSAD-UHFFFAOYSA-N 436.559 2.481 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751136964 OFLKHJKMLLCDIK-KRWDZBQOSA-N 439.555 2.474 10 20 IECD CC(=O)N1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc21 751241081 VGPUCLBZYHFLEV-UHFFFAOYSA-N 443.569 2.283 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1F 753521010 IASCJUJKGUAEFI-UHFFFAOYSA-N 433.439 2.392 10 20 IECD COC(=O)c1cccc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 757586275 UGZRWCSFDGLJRN-UHFFFAOYSA-N 440.544 2.493 10 20 IECD COc1cc(N2CCN(C(=O)CCn3c(C)c(C)sc3=O)CC2)cc(OC)c1OC 759222715 VCVDRFBVOMVTIW-UHFFFAOYSA-N 435.546 2.291 10 20 IECD Cc1c(NC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)c(=O)n(-c2ccccc2)n1C 759591198 ZZDQROJAASJPFZ-KUGGDMIFSA-N 437.452 2.479 10 20 IECD CC1(C)C(=O)Nc2ccc(C(=O)COC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc21 763945909 RQQHLNNRJIUFSQ-UHFFFAOYSA-N 432.454 2.033 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 765927569 UEDWUEQUFYAYNK-UHFFFAOYSA-N 432.274 2.302 10 20 IECD COc1cccc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1O 769209916 JHNNAQLIQRAWIP-UHFFFAOYSA-N 434.514 2.069 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(Cc3cc(Br)ccc3O)CC2)cs1 769335911 UHJDYDDPTYELEC-UHFFFAOYSA-N 432.365 2.426 10 20 IECD Cn1ccnc1[C@@H](O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 772593968 UBVSPPSWRBXJTC-NRFANRHFSA-N 445.539 2.176 10 20 IECD CCN(CC)c1ccc(CNC(=O)N(CCCOC)[C@H]2CCS(=O)(=O)C2)cc1F 774210925 MCISJXZZDVYYDD-KRWDZBQOSA-N 429.558 2.407 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc(Cl)o1 775233138 PULFQMGSMPJDLB-UHFFFAOYSA-N 430.936 2.398 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1F 780408119 APIIXVQQPODGFF-UHFFFAOYSA-N 434.493 2.253 10 20 IECD CCn1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 781417917 DYFUPDHVQVIUQS-HOTGVXAUSA-N 432.496 2.058 10 20 IECD COc1ccc(OCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 785561308 PRCOBUWAFHCQRX-HXUWFJFHSA-N 428.485 2.104 10 20 IECD COc1ccc(OC)c(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 786684611 QMMIGGBOVRECPT-HXUWFJFHSA-N 442.512 2.276 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 787908801 GLESPOIZVXXZSH-RTBURBONSA-N 448.583 2.153 10 20 IECD Cc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 789818396 JTEWCBAEMZHVBN-CALCHBBNSA-N 428.508 2.118 10 20 IECD CCO[C@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789845100 KDWQCAUHUFZVLI-PMACEKPBSA-N 435.540 2.065 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3C3CCCC3)cc2)C1 793716422 BMHGRAIMWXAGRU-CTNGQTDRSA-N 426.561 2.186 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)CN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 793907166 AHNYAZUNFRCCJR-SLFFLAALSA-N 430.593 2.217 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CC[C@@H](CS(C)(=O)=O)C3)c2C)cc1 795090850 POZPAXLCYHYTSQ-QGZVFWFLSA-N 432.542 2.430 10 20 IECD CN(C[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)OC(C)(C)C 803663124 KAMVYTQDMRWAGU-MRXNPFEDSA-N 436.528 2.366 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3COC4(CCC(C)CC4)O3)CC2)cc1 804317784 PVMPSAONNRJEHL-LBVATQBMSA-N 445.560 2.218 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1F 804853004 RGSHEPOCFQJFLW-UHFFFAOYSA-N 446.483 2.257 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H](CCOC)C3)cc2F)CC1 805007633 OLXVTIBXORFVDG-LJQANCHMSA-N 448.583 2.249 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 807102720 IAXHFUTYKDAXRY-IBGZPJMESA-N 441.507 2.239 10 20 IECD O=C(NCCc1ccc(OCC(F)(F)F)nc1)C(=O)NCc1ccc(N2CC=CC2)cc1 807289661 DHZFBLAYIJISSV-UHFFFAOYSA-N 448.445 2.374 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(O[C@H]2CCOC2)c1 807291170 UGSVDXSHBMLADA-QFIPXVFZSA-N 435.524 2.472 10 20 IECD Cc1ccccc1CC(=O)N1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807672373 YFKHSKPFHDWOAF-IBGZPJMESA-N 436.556 2.152 10 20 IECD C[C@H](NC(=O)C(=O)N1CCn2c(Cc3ccccc3)nnc2C1)c1ccc(N(C)C)cc1 807673340 RARMEXZDIWASKW-KRWDZBQOSA-N 432.528 2.155 10 20 IECD CN(CCn1cc(Br)cn1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 808237896 KATQWLBRADKRST-UHFFFAOYSA-N 440.317 2.463 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(c4ccccc4)C3=O)cc2)C1 814587901 DCWLZNYLQZOJAC-DENIHFKCSA-N 434.540 2.448 10 20 IECD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c(C)n1-c1ccccn1 914906651 PIYKVXBDWFOXSU-HNNXBMFYSA-N 442.497 2.321 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(=O)n(-c2ccccc2)n1C 918267360 RHRISOMDYQGJDW-UHFFFAOYSA-N 433.512 2.340 10 20 IECD C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1)n1cncn1 918305165 GHTCGMPQSUULBJ-INIZCTEOSA-N 449.515 2.141 10 20 IECD COCCOCc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918311915 WTGULPYPJLWACG-UHFFFAOYSA-N 441.528 2.283 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCC(F)(F)F)cc2F)C[C@H](C)O1 919154508 KPJWRZQUCNDNPO-STQMWFEESA-N 436.402 2.178 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 1116570498 AACAURGCZGACSM-DAYGRLMNSA-N 443.500 2.011 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](c1ccccc1)N1CCOC1=O 1116669731 XDBFLGMJQNZTIZ-ZWKOTPCHSA-N 442.468 2.272 10 20 IECD Cc1cc2cccc(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)c2[nH]1 1777869484 DCQSVOWVZKFIHD-QHCPKHFHSA-N 436.468 2.040 10 20 IECD O=C(CC[C@H]1CCOC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007221 DXKFWUPIJNRPCX-QKKBWIMNSA-N 438.908 2.011 10 20 IECD Cn1c(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)cccc1=O 1788424323 WMFAFGKEFKZSNR-UHFFFAOYSA-N 434.452 2.253 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(F)CCC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245586 PMMVCNNCTJRJIQ-RBOXIYTFSA-N 426.872 2.237 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990063 DGQQYPFQMNLSJL-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994506 HILUWBOMMKPIJM-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469902 RAQKHBKXNJLOGK-UYZIEWPDSA-N 449.486 2.238 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)C1CCCCC1 1834378044 WWTZAPFHYAWCAP-UHFFFAOYSA-N 430.549 2.258 10 20 IECD CC(C)(C)n1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n1 1847033751 BLPCSRSZTRPMKN-SOFGYWHQSA-N 440.500 2.285 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](CNC(=O)C(C)C)C2)c1 726182940 OZRBYZPUZZJMNH-LJQANCHMSA-N 431.577 2.411 10 20 IECD COc1ccc(CNC(=O)CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726707624 FBWKSWVWFWPZGO-UHFFFAOYSA-N 426.517 2.288 10 20 IECD CNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 729579992 SAIBNZKHHHHXNC-UHFFFAOYSA-N 426.517 2.342 10 20 IECD C[C@@H]1CN(C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 729597907 UEWLXJZFNVILRU-GGPKGHCWSA-N 434.556 2.446 10 20 IECD COc1ncnc(OC)c1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729875408 ZYNNUOFHHXKQDE-UHFFFAOYSA-N 447.403 2.065 10 20 IECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 732595107 MRFCZEQGKRNCKR-OALUTQOASA-N 438.528 2.461 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN([C@H]4CCCN(C)C4)CC3)cc2F)C[C@@H](C)O1 734660023 JMNKMWKDWQEFHR-ZVDOUQERSA-N 447.599 2.361 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(F)c1 737174385 OZLQGDZXRYNHQS-UHFFFAOYSA-N 429.448 2.345 10 20 IECD CS(=O)(=O)Nc1ccc(F)cc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739766933 UMBKHQDAZFEHOT-UHFFFAOYSA-N 434.493 2.151 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742499216 XVBGWMMFFHSSAR-WKDRNLAYSA-N 425.529 2.188 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1Cc1cccc(F)c1 743559516 JAPOSLTXZZQMGL-UHFFFAOYSA-N 426.492 2.216 10 20 IECD O=C(N[C@@H]1CCCC[C@H]1O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 757904054 DCACXHHGCGFLNF-SJLPKXTDSA-N 435.458 2.135 10 20 IECD CS(=O)(=O)N1CCc2c(NC(=O)NCc3ccc(N4CCOCC4)cc3)cccc21 758302775 PYQUKVOQMCMJBK-UHFFFAOYSA-N 430.530 2.167 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C)c3C(F)F)cc2F)C[C@@H](C)O1 758965164 ITCXZAYTBIMLCO-VXGBXAGGSA-N 439.438 2.365 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NCCc2ccc(O)c(O)c2)cc1 762268483 HUIJWVTXYINDHF-UHFFFAOYSA-N 434.514 2.060 10 20 IECD COc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCCC1 763284723 UNBSNDGWMKZOKM-AWEZNQCLSA-N 434.514 2.252 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3csc(S(C)(=O)=O)c3)cc2F)CC1 766432021 TWMNIJGJSLVICP-UHFFFAOYSA-N 425.551 2.363 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]4[C@H](CCCN4C)C3)CC2)cc1 766845882 MHPVKAYGMSAVCP-NFBKMPQASA-N 429.609 2.333 10 20 IECD O=C(COC(=O)[C@H](O)c1ccccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 768609460 QYZFPVJPKZRZSD-HXUWFJFHSA-N 436.867 2.209 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1C(=O)OC(C)(C)C 772866998 XGGBPMUHJYZWDF-CHWSQXEVSA-N 427.523 2.234 10 20 IECD C[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 773829080 ZBJIAVPLCVVZJK-QWHCGFSZSA-N 427.523 2.282 10 20 IECD Cc1cc(C(=O)CN(C)[C@@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776856315 ACGGRYQYLAROKS-INIZCTEOSA-N 448.589 2.159 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H](CC(F)F)C(=O)O 780444079 QCQSCIMYPBXAOH-CYBMUJFWSA-N 425.354 2.450 10 20 IECD Cn1cc(-c2nc([C@H]3COCCN3C(=O)NCc3ccc(N4CC=CC4)cc3)no2)cn1 780835956 ODFIJFHZGUOJLI-LJQANCHMSA-N 435.488 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccccc3CN3CC[C@@H](O)C3)CC2)cc1F 781833543 HIWNOCPDDOSCOX-OAQYLSRUSA-N 442.535 2.433 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CC(c2c(F)cccc2F)=NO1 785897622 OYLAKTYGDKLDCD-LJQANCHMSA-N 449.479 2.009 10 20 IECD CN(CCCCCO)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 788896667 SVGRKLLOCFAXKY-UHFFFAOYSA-N 430.528 2.246 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ncsc4C3)cc2F)C[C@@H](C)O1 789823238 ZQJCMQOOGWBJOG-OKILXGFUSA-N 432.521 2.097 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)C(C)(C)CN(C)C)cc2F)C[C@@H](C)O1 789824873 KUEUJFVEHLRDAT-BBWFWOEESA-N 436.572 2.148 10 20 IECD Cc1cc(C(=O)CN2C[C@H](C)O[C@H](C3CC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791561494 YQSXPENMJJVSHG-NYHFZMIOSA-N 431.558 2.424 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCCC1 793725558 QHBRCVJHJLFOCA-TZIWHRDSSA-N 428.577 2.480 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@H]3C[C@H](O)c3ccccc3)ccc21 803685767 KDYXCJGAQQICJW-GGAORHGYSA-N 437.540 2.036 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccncc1 805740621 XXAANGYJNFHZJC-QHCPKHFHSA-N 435.572 2.497 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@](O)(C(F)(F)F)CC3)cc2)C1 806494197 MVYXHQNCYMLRIN-JXFKEZNVSA-N 442.482 2.377 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCn4cnnc4[C@@H]3C)cc2Cl)C1 807952336 LGATZCIXWIBJES-GJZGRUSLSA-N 430.940 2.387 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1Cc2ccc(Cl)cc2C1 808324543 LKDRUGNVTPLZSZ-HXUWFJFHSA-N 427.932 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 897671915 CMOGTHBEKLSRGM-GOSISDBHSA-N 445.585 2.440 10 20 IECD O=C(CN1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1)N1CCCCC1 916626286 WMSPJUMVCILGIX-UHFFFAOYSA-N 445.633 2.080 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1OC 917385573 BJDPFUBFLZYKDK-UHFFFAOYSA-N 435.571 2.087 10 20 IECD COc1ccc(OC)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918005253 UBDXZBAVTIKUCE-KRWDZBQOSA-N 426.517 2.405 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(NC(=O)C2CC2)c1 918284406 FPMXHCQCOCHBDF-UHFFFAOYSA-N 440.475 2.266 10 20 IECD CC(=O)NCC(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 919509161 YEUQGWQGIAQCMW-UHFFFAOYSA-N 427.501 2.196 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3nc4ncc(Br)cn4n3)CC2)cc1 1116421473 PXGCUZRKIBACFK-UHFFFAOYSA-N 431.294 2.248 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc(S(=O)(=O)CC)c3)CC2)cc1 1323152716 XBSMTIZRDHFHLA-UHFFFAOYSA-N 438.571 2.390 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC(=O)N1Cc1ccc(C)cc1 1323859987 MIZGZQWTXZLAAD-OALUTQOASA-N 440.496 2.188 10 20 IECD COCc1nocc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1327658733 YGSVGVSBACXWNB-UHFFFAOYSA-N 426.452 2.007 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C2CC(O)C2)CCO3)cc1 1781752266 KRVFKKHLSSRWBP-YNJPUODISA-N 437.540 2.309 10 20 IECD O=C(COc1ccccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806467179 AABGEGSMHPFTHZ-GAJHUEQPSA-N 448.479 2.286 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H]1C[C@H]1C1CC1 1814762901 HDSDYUMMMUXQTL-YDHLFZDLSA-N 447.586 2.308 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1cc(O)nc(O)c1 1817844833 MMYBYSNJGVECMJ-CQSZACIVSA-N 448.443 2.107 10 20 IECD CN(C)c1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)o1 1825754235 IHSAHBROKPUIQA-INIZCTEOSA-N 443.504 2.094 10 20 IECD Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1F 1827426741 DLTXVRZUFVRPJR-HNNXBMFYSA-N 431.468 2.211 10 20 IECD O=C(c1ccc(Cl)nc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034385 DTLHVTIBFALTDT-QPJJXVBHSA-N 429.860 2.382 10 20 IECD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1848306747 VXGJUDSBZLNARV-HOTGVXAUSA-N 444.875 2.234 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCCC3=CCCCC3)CC2)cc1 12069515 TWPPGEQASWLQGM-UHFFFAOYSA-N 428.577 2.330 10 20 IECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC12CC3CC(CC(C3)C1)C2 728729546 PHTYFUHVZXGYTP-PXRHCINRSA-N 436.530 2.394 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H](C(N)=O)c3ccc(Br)cc3)cc2)C1 729677002 WVXXNSVNBHTRMY-VQIMIIECSA-N 445.361 2.467 10 20 IECD NS(=O)(=O)c1ccc(Br)c(C(=O)NCCCSc2nccs2)c1 733880290 DXOWAMJXEODRDQ-UHFFFAOYSA-N 436.378 2.465 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(CCN3CCOCC3)CC2)c1 738112550 WHYSBBCAMCHJCK-UHFFFAOYSA-N 445.604 2.361 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](C(=O)Nc4ccc(C)cn4)C3)nc12 746458504 ZPURUKWWBBHKSA-HNNXBMFYSA-N 438.488 2.166 10 20 IECD COC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)c1 754181614 YHYVSHYJSXFKPL-SFHVURJKSA-N 448.491 2.191 10 20 IECD COc1cc(N2CCN(CC(=O)NC(=O)N[C@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 759872380 IIOFPJXXSVAXHX-WMZOPIPTSA-N 448.564 2.239 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)CN(Cc4ccc(F)cc4)C3=O)CC2)cc1 761183810 KOTRVWHYVPQGAN-UHFFFAOYSA-N 426.492 2.421 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)CC[C@@H]3C)cc2F)C[C@@H](C)O1 763196115 QWIOMKUGVPBAFA-HRCADAONSA-N 427.542 2.158 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ncn(Cc2ccccc2)n1 765904849 XZXVAGUWZDWELQ-UHFFFAOYSA-N 430.262 2.049 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(CCC(N)=O)CC3)cc2F)C[C@@H](C)O1 767777540 XCEPMFCNEYPLJI-IAGOWNOFSA-N 434.556 2.033 10 20 IECD C[C@@H]1CN(C(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)C[C@H]1O 769129300 RLOBYMXOXYRQBC-YVYLTZLRSA-N 441.372 2.490 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1=O 771057804 KLMQDOOFCFHJGE-MRXNPFEDSA-N 436.940 2.237 10 20 IECD COc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1-n1nnnc1C 771974824 KDLVMAKIVDNHLT-UHFFFAOYSA-N 428.836 2.307 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@H](c4ccc(F)cc4)C3)CC2)cc1 779219101 HVYOBJWYBMHCHK-ISKFKSNPSA-N 429.536 2.391 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCCN(C(=O)c4ccccc4)C3)CC2)cc1 779610050 PQZTXJMIAPDACS-QFIPXVFZSA-N 443.569 2.452 10 20 IECD COC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)on1 781276025 GMORFADNHDTRLZ-LLVKDONJSA-N 448.387 2.421 10 20 IECD O=C(OCC(=O)C1CCOCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785414491 XPEFKNOVJZYUNX-UHFFFAOYSA-N 425.484 2.407 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(OC)c1 785489769 OJJXOMLGWDZPAZ-UHFFFAOYSA-N 434.514 2.391 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12 786754488 RIESGKRKUDRVJX-UHFFFAOYSA-N 438.503 2.461 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)CN1CCCCC1 787753261 XOCBXJUUKWZQNP-CQSZACIVSA-N 426.355 2.494 10 20 IECD CCc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789823754 FXVUEZCHQNXPOL-KBPBESRZSA-N 434.537 2.391 10 20 IECD CN(Cc1cc(Cl)cn1C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842248 CKKZASQXNOQTQI-UHFFFAOYSA-N 436.915 2.054 10 20 IECD CCc1[nH]nc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1Br 790045637 IXGFHQPBWSAQLM-UHFFFAOYSA-N 434.338 2.333 10 20 IECD CO[C@@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 790911354 GXIDJCXHAOANGU-HXUWFJFHSA-N 443.475 2.387 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cnc1C 793357002 GHMGGVWZMKRIPL-UHFFFAOYSA-N 433.895 2.002 10 20 IECD Cc1ccc2c(c1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)CC2 793731509 FJPQHMWSXSQYDG-DENIHFKCSA-N 434.540 2.117 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCC(=O)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796250888 MXGQQHRQESQNCI-HOCLYGCPSA-N 446.525 2.473 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 796385440 SCIILALKFXYITA-RUZDIDTESA-N 435.616 2.261 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)OC3CCCCC3)cc2)C1 802012314 JWENUOGZHBSDPM-SFHVURJKSA-N 430.549 2.454 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@@]4(CCCOC4)C3)cc2)CC1 805023363 GFBZGUSERPSRNC-CYFREDJKSA-N 429.561 2.336 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@H]1CCCc2c[nH]nc21 806427603 LJBAJFKRQIPXEH-YOEHRIQHSA-N 433.459 2.290 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 807372879 NJDKHSKRUBYSEN-SJORKVTESA-N 431.558 2.217 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCc3nnn(C)c3C2)NC(=O)OC(C)(C)C)cc1 810448166 WJHCIFLOVCCNID-APWZRJJASA-N 442.564 2.368 10 20 IECD COCCc1nc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 811033649 OVLDXGSUTXAPCM-UHFFFAOYSA-N 437.364 2.299 10 20 IECD Cc1cc(C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1cccc(Cl)c1 920289820 DACICOGLOALZSZ-INIZCTEOSA-N 437.949 2.123 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccnc(F)c1 1804282932 HRMSPRQCKDJAGH-KOTZLPFRSA-N 427.432 2.303 10 20 IECD CCc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285193 IETOVVFRJDOGAE-RRJKNOHSSA-N 427.457 2.319 10 20 IECD Cc1nccn1CCCC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550883 UCBVKPPJMIBIRU-UHFFFAOYSA-N 441.532 2.323 10 20 IECD O=C(/C=C/c1cccnc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721662 NZIGQDWVWOGHNZ-BOTMBNHJSA-N 437.481 2.284 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)cc2F)C[C@@H](C)O1 734842791 XNALKHCNWQTCIE-HUUCEWRRSA-N 447.532 2.204 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 742799121 GNGCJDOFBLIOII-LBPRGKRZSA-N 429.445 2.188 10 20 IECD C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 746862367 PJROHEACGUIFML-WMLDXEAASA-N 427.567 2.115 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 749500220 RMAATGGGFGJSEE-UHFFFAOYSA-N 436.505 2.012 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(Cl)nc3Cl)c2)CC1 751213495 XABPGOOHBYPRIS-UHFFFAOYSA-N 436.342 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(C(=O)NC4CC4)c3)CC2)cc1F 754215318 PGMNDYXQLQBIRO-UHFFFAOYSA-N 440.475 2.014 10 20 IECD COc1cc(N2CCN(CC(=O)NCCOc3cccc(C)c3)CC2)cc(OC)c1OC 759885344 CLTFANJNGMMYKO-UHFFFAOYSA-N 443.544 2.338 10 20 IECD O=C(c1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1)N1CCOCC1 761150712 KZLLVUALEBTSNH-UHFFFAOYSA-N 443.887 2.482 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn(Cc4ccccc4)c3)CC2)cc1F 762465944 SQNAQIUCXPKLQD-UHFFFAOYSA-N 437.475 2.366 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 763654235 BUZDPIMCWSGBCY-UHFFFAOYSA-N 446.573 2.415 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@@H]1CCOC1 764372379 KFKVJVXJGGVXHH-CHWSQXEVSA-N 435.458 2.256 10 20 IECD CS(=O)(=O)c1ccc2ncnc(NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2c1 764786111 ZIULUMPARKPPQL-MRXNPFEDSA-N 439.541 2.347 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCCN(CC(F)F)CC3)CC2)cc1 766753552 VKALKFSBYZXMNK-UHFFFAOYSA-N 439.551 2.190 10 20 IECD Cc1nn2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc2c1Cl 766779740 ZDTKUAUCJHEIAG-UHFFFAOYSA-N 439.900 2.145 10 20 IECD COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 768027015 YSGUTBNZAOFAPW-UHFFFAOYSA-N 447.557 2.160 10 20 IECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](c1ccc(C)cc1)n1cncn1 770116386 MPYYMNXPRNUMSG-ICSRJNTNSA-N 443.529 2.462 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3sc(C)nc3C)CC2)cc1 778259928 DVTQXXBABCQFFG-HJWRWDBZSA-N 428.558 2.332 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CCCCS3(=O)=O)cc2F)C[C@@H](C)O1 784222700 NJSXAWNLDYUONY-INMHGKMJSA-N 427.542 2.206 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12 788321943 DLVYWBRCJRWVIW-VWLOTQADSA-N 435.524 2.188 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2CCCN(C(=O)c3cccc(O)c3O)C2)CC1 790557136 AMLZUQNCUXCPCH-OAHLLOKOSA-N 433.505 2.029 10 20 IECD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 792198009 IQSWNQDOHRXXPW-OPAMFIHVSA-N 435.471 2.294 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1OC 793915501 WNQBKHAPKNJYPM-UHFFFAOYSA-N 439.512 2.064 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 798034122 FRTONPOUSAYLFD-UHFFFAOYSA-N 444.463 2.404 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)OCCCO2)c1ccc(N2CCOCC2)cc1 803307192 YDFNGBGYALJZDK-KRWDZBQOSA-N 439.512 2.178 10 20 IECD COCCC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803450304 GQHKYHGILPDWRJ-UHFFFAOYSA-N 425.476 2.306 10 20 IECD CN1CCC(Oc2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CC1 803665663 IZDMPNTWICCBTE-UHFFFAOYSA-N 433.530 2.167 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 806424012 YEYVKIBYYMEWOW-UHFFFAOYSA-N 445.467 2.304 10 20 IECD CC1(C)[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]2CCO[C@H]21 807195238 AJTBQOUQFZQAKL-BVPBIZIASA-N 437.487 2.303 10 20 IECD Cc1c(NC(=O)C(=O)NCc2cc(Br)ccc2O)cccc1N1CCNC1=O 807387759 VTSVFLZMEPHUMN-UHFFFAOYSA-N 447.289 2.248 10 20 IECD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1 872051371 JUUJOBFSBJZLMQ-UHFFFAOYSA-N 439.537 2.476 10 20 IECD COc1ccccc1N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 916969039 AERAUIYHUTUMFP-UHFFFAOYSA-N 442.535 2.109 10 20 IECD CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 917832521 CJVIVBKCBBIMGJ-MJGOQNOKSA-N 428.558 2.334 10 20 IECD O=C(CCn1cc(Cl)cn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919701365 ZICSWHWBBKFJJJ-UHFFFAOYSA-N 443.914 2.499 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C)OCC2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920781116 HMGCNQANPLFGLS-OAHLLOKOSA-N 434.514 2.283 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1788686929 XSQBFPIMPWJKLX-FEDSJOOMSA-N 441.484 2.091 10 20 IECD Cc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790242233 XCBPGLXFCGNMPB-JDFRZJQESA-N 449.891 2.263 10 20 IECD CC(=O)O[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(C)C 1798277557 YAAXNVAYVDCCSI-NQEVSOEBSA-N 446.500 2.043 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H]1C[C@H]1c1ccccc1 1804336342 QDEOOYJDWUTULJ-ADHGMGHFSA-N 443.594 2.289 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1CCC(CO)CC1 1815687655 FQHWOPQQSUEEJN-KVULBXGLSA-N 443.504 2.321 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@H]1CC=CCC1 1836387010 CGGMIJKWVVMVIM-INIZCTEOSA-N 428.533 2.034 10 20 IECD O=C(CC1CCC1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840848733 NAAULIUDVKKYAE-OAQYLSRUSA-N 438.908 2.011 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc[nH]c3nccc2-3)C1 1843274491 OWXBHRSHQFCRBT-HWKANZROSA-N 434.452 2.162 10 20 IECD CC(C)(C)OC(=O)NCC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846089528 IMYUEDZTUCIWOR-UHFFFAOYSA-N 439.896 2.093 10 20 IECD Cc1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)ccc1F 1848341665 NGNWCKAXGQLMEH-PMACEKPBSA-N 435.459 2.137 10 20 IECD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1 110676611 XHNLBQXWFIVLRP-QFIPXVFZSA-N 436.512 2.337 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCCC[C@@H]3CCNS(C)(=O)=O)CC2)cc1 726714241 WMSSGDZKTUBGGD-LJQANCHMSA-N 438.594 2.167 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729359747 IYKSKTWEOKMZMA-UHFFFAOYSA-N 431.443 2.260 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cc3nnc(-c4ccccc4)n3C)CC2)cc1 731572164 NRBWJWPAJCOXHI-UHFFFAOYSA-N 448.571 2.362 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)cc([N+](=O)[O-])c2C)cc1F 742252753 NLZNJPQMOQKZHI-UHFFFAOYSA-N 438.481 2.466 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(Cn2cccnc2=O)c1 743955051 GFEWAHZJUDQCHD-UHFFFAOYSA-N 432.480 2.131 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743956339 REQAZRVCBMBZMP-UHFFFAOYSA-N 438.528 2.416 10 20 IECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NCc2cc(OC)ccc2O)c1 751415539 RXJSABFOMRKYBR-YVMONPNESA-N 437.470 2.083 10 20 IECD CCC(=O)NCc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OC 751978844 BKMGAFHDMDEQOX-UHFFFAOYSA-N 447.557 2.037 10 20 IECD COC(=O)c1cccc([C@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)OC)c1 754003613 OSMSZIKFMRPZQB-CTNGQTDRSA-N 439.512 2.179 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)c1 761981875 JHYQFPIEHITJKZ-INIZCTEOSA-N 449.573 2.430 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1 769745124 YIUXVJGQAKXIJF-UHFFFAOYSA-N 435.483 2.211 10 20 IECD COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769869565 AXQQACMTCCAOCQ-QGZVFWFLSA-N 447.513 2.324 10 20 IECD COCCOc1cccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 772069588 GHNDJTQUVJKTFO-FQEVSTJZSA-N 425.529 2.272 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 774148066 ZGYGBXHBGBDWHL-LJAQVGFWSA-N 435.546 2.371 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)cc2F)C[C@@H](C)O1 775178778 CYROVAANSQPUQY-SCRDCRAPSA-N 432.323 2.366 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778313203 QAUUGSVPCFQLRV-PYOMTESSSA-N 447.601 2.096 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)cc1 778914804 MHMASABNDUHWEX-UHFFFAOYSA-N 434.514 2.214 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1C 782252157 VHRRYLVYJFZCCT-UHFFFAOYSA-N 430.479 2.483 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 785390015 QFRAQVPPBXCNPR-FPOVZHCZSA-N 436.556 2.315 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 785563105 YYCXHULOOSUOIQ-AUSIDOKSSA-N 438.572 2.428 10 20 IECD C[C@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N(C)Cc1ccccc1 788320906 RILUIZGNFDSDMB-HXUWFJFHSA-N 438.572 2.166 10 20 IECD CC[C@@H](CSC)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949819 KRFFDTRPEIRSKQ-AWEZNQCLSA-N 433.496 2.416 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1)c1ccc(N2CCOCC2)cc1 792968980 CLQYQMRMCFPOPD-MRXNPFEDSA-N 434.496 2.191 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cn2c(n1)CCCC2 799319982 VTMQVFFLMCZYFN-UHFFFAOYSA-N 435.507 2.405 10 20 IECD COCCN1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 801589639 IGOLKCVXBRJUAW-UVTDQMKNSA-N 439.584 2.004 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4ccc(F)cc4F)C3)ccc21 803687399 LRUNORIUVUZPJW-SFHVURJKSA-N 428.483 2.359 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 807289562 ZRFGVRHJAKPSNF-QGZVFWFLSA-N 426.467 2.352 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1 807292508 RRJFFEKMMLGFMO-HSZRJFAPSA-N 446.551 2.490 10 20 IECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)c2)CN1 807386720 GGYJCOKQZUUKTA-GFCCVEGCSA-N 432.274 2.013 10 20 IECD COCCCN(C(=O)/C=C/c1cccnc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 864046152 BDVBHUQXBULGEB-ZHACJKMWSA-N 435.484 2.057 10 20 IECD C[C@@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 917709711 WIBPLBZOYGAWIO-INIZCTEOSA-N 427.476 2.483 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(CNC(C)=O)ccc3OC)CC2)cc1 917759066 AXYIOAZAZHSKQH-UHFFFAOYSA-N 447.557 2.241 10 20 IECD C[S@@](=O)Cc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918923695 JFGWGFWNBZXLAX-WJOKGBTCSA-N 448.516 2.014 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nc(-c2ccccc2)no1 1321360000 JRBKNBCAWOKRKK-INIZCTEOSA-N 425.441 2.371 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccn2n1)c1cc(O)c(O)c(Cl)c1 1796564658 LUOLWBAFTOFOQN-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)C3CC(F)(F)C3)C2)CC1 1805005492 LIBRQNKAYXIFHB-UHFFFAOYSA-N 445.557 2.123 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ccn1 1810787822 QMZABOBODNIXGF-UWJYYQICSA-N 433.468 2.225 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817364820 ZYHZAQNNVICLLS-BNOWGMLFSA-N 441.488 2.206 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccn3cncc3c2)[nH]n1)c1cc(O)nc(O)c1 1817846289 PDTODMZXSCCADL-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CC1=CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1 1834987693 WMWGCEHKZISFDA-QGZVFWFLSA-N 442.560 2.424 10 20 IECD Cc1cc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)no1 13949660 FAJVQLTULUHOGN-UHFFFAOYSA-N 435.443 2.121 10 20 IECD CCc1ccc(C(=O)NCc2ccc(N(C)C)c(F)c2)cc1S(=O)(=O)N1CCOCC1 116151193 SGRABMOENDPDCX-UHFFFAOYSA-N 449.548 2.405 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCNc3ccccc3[N+](=O)[O-])C=C2)cc1 466294876 CXYCUKFTHUKJEI-UHFFFAOYSA-N 440.481 2.167 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cnc4c(c3)c(=O)n(C)c(=O)n4C)ccc21 481976348 VEKCSDLQGXMYSS-UHFFFAOYSA-N 435.484 2.102 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3C3OCCO3)cc2F)C[C@@H](C)O1 728172995 QENMDEBXXWZEEG-LZJOCLMNSA-N 435.540 2.283 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1 729536879 NNHIKFRUBDYAAX-SECBINFHSA-N 429.292 2.302 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccc(NS(C)(=O)=O)c3)cc2F)CC1 730235660 KZPYZDYTQONSGH-UHFFFAOYSA-N 434.537 2.269 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc(C)n(-c4ccccc4)n3)CC2)cc1 731743677 LNZPTKFXVMMKPM-UHFFFAOYSA-N 435.484 2.090 10 20 IECD COC(=O)CCCc1nc(COC(=O)c2ccc3c(c2N)C(=O)c2ccccc2C3=O)no1 733385825 OVJUDHNNXVSSJS-UHFFFAOYSA-N 449.419 2.280 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(NC(=O)[C@H](C)n2cncn2)cc1 734703276 LLNCVKQHJPWVTK-INIZCTEOSA-N 449.515 2.107 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1OC 742027524 GXVFLOBZEPINPW-UHFFFAOYSA-N 441.531 2.240 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 746755375 PAJFPOMAPDOHIK-OAQYLSRUSA-N 426.561 2.374 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4ncccc4c3)CC2)cc1 747266261 IGUHQYAMTKGGMC-UHFFFAOYSA-N 426.542 2.344 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@](C)(O)[C@@H](C)c3ccccc3)CC2)cc1 748483293 FXIOGRXPEOESJA-MHECFPHRSA-N 426.513 2.442 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cc1F 753739311 XAVFIDZLBCCCQS-UHFFFAOYSA-N 433.505 2.237 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 754195493 ZRHWPQAPLKNMSR-UHFFFAOYSA-N 438.528 2.225 10 20 IECD C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 755128218 SHDPIDPNNGRFFS-IBGZPJMESA-N 445.633 2.078 10 20 IECD COc1cc(N2CCN(C(=O)NCc3nnc4n3CCCCC4)CC2)cc(OC)c1OC 759215824 HOLZRODKOIZDFA-UHFFFAOYSA-N 444.536 2.062 10 20 IECD COc1cc(N2CCN(CC(=O)NCc3cc(F)cc(F)c3)CC2)cc(OC)c1OC 759878311 MGOAZHAOAHLQDD-UHFFFAOYSA-N 435.471 2.429 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](c4ccc5c(c4)CCO5)C3=O)CC2)cc1 761185757 RAGDEWMTYMWNSJ-QFIPXVFZSA-N 436.512 2.045 10 20 IECD CN(CCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)S(=O)(=O)c1cccs1 762221997 MBBGFJIAZKRZIB-UHFFFAOYSA-N 443.934 2.192 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](C)S(=O)(=O)C3CCOCC3)cc2F)C[C@@H](C)O1 764927553 ZOYNNVOCMGURBA-BZUAXINKSA-N 442.553 2.038 10 20 IECD Cc1c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cnn1-c1ccccn1 765041330 NXABZDXMFBGIBP-UHFFFAOYSA-N 441.922 2.401 10 20 IECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCc1cccc(Br)c1O 765731520 JIYPGVVXYYZRCI-YDHLFZDLSA-N 428.352 2.497 10 20 IECD CC[C@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](O)C(F)(F)F 766244220 RSJBEKBJLQBYPC-ROUUACIJSA-N 432.487 2.208 10 20 IECD O=C1C[C@H](c2cccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2)CN1 772474650 MSRVIFCWYOBYEO-ICSRJNTNSA-N 437.496 2.142 10 20 IECD O=C(Cn1nnnc1CCCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 772896919 FTZVDQRUTHSYCX-UHFFFAOYSA-N 438.507 2.141 10 20 IECD CS(=O)(=O)N[C@@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 775652997 YXHSJRAXOMJSEB-LLVKDONJSA-N 442.173 2.431 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCCc2c1cnn2C 789589192 CLLFIKSTXWVGKV-HNNXBMFYSA-N 435.322 2.431 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C3CCC(NC(=O)C4CC4)CC3)CC2)cc1 792863896 UOGGFDAQOAUNKL-UHFFFAOYSA-N 442.604 2.409 10 20 IECD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800048584 FPBILLWWVIKKRE-QRWLVFNGSA-N 434.968 2.320 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1)c1ccc(N2CCOCC2)cc1 803310623 MKNPLKSSPMIXAN-WMQCIHAUSA-N 441.528 2.408 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)CC2)cc1 804314877 BOZGRQMRQGEZDZ-QRVBRYPASA-N 435.615 2.276 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCOc2ccccc2C1 808852314 RRSMAVBISAQJLH-UHFFFAOYSA-N 448.567 2.256 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccnn1C 809793470 FLLYQVMWIFIISM-RBUKOAKNSA-N 428.533 2.189 10 20 IECD CN(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)cn1 811822426 HFLYJZUGMCIRIY-UHFFFAOYSA-N 438.556 2.475 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCc3nncn3C2)NC(=O)OC(C)(C)C)cc1 815710896 YNHCPILQTGAOQI-SJLPKXTDSA-N 428.537 2.289 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1)N1CCC[C@@H]1CO 864044823 LXURQGUGKUUPDD-LJQANCHMSA-N 449.548 2.420 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCN(C)C(=O)C3)c2C)cc1 912704580 OPSFRZWQWXMHAN-KRWDZBQOSA-N 426.469 2.475 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ccc(=O)n(C)c2=O)c(C)n1-c1ccc(F)c(Cl)c1 915394029 HZURXXNPZZJPSV-UHFFFAOYSA-N 447.850 2.173 10 20 IECD CCOC(=O)[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917043425 YEIFXEKKRNKKJH-LZJOCLMNSA-N 435.540 2.473 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2)C1 917833870 UNAAECJBBXXGSX-ZWKOTPCHSA-N 438.503 2.197 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3cc(C)nn3[C@H]3CCS(=O)(=O)C3)CC2)cc1 918029772 RWUNREYCUIFTDV-SFHVURJKSA-N 447.561 2.304 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918294037 BRPXZEPXTOXIHG-IBGZPJMESA-N 442.468 2.090 10 20 IECD CCCNC(=O)[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc2O1 918306095 RINVNYCCGKIMOU-NRFANRHFSA-N 438.528 2.031 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC(F)F 918337555 MTDALTJIRQVMOZ-UHFFFAOYSA-N 440.468 2.461 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(OC)cc1Cl 920194288 AWMNVBYBZFDTAA-UHFFFAOYSA-N 433.892 2.449 10 20 IECD Cc1ccc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc2c1 1777740351 UJKQCDKIWZYCTN-QHCPKHFHSA-N 436.468 2.040 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CNC(=O)C2)cc1 1801675717 RXCMWRXWHNUZEA-MPJJRAAHSA-N 434.540 2.482 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1 1824854063 JTOGIUBJCYIYSL-SZHMKSFOSA-N 433.461 2.387 10 20 IECD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccn1 1827067399 VKBJTOGQBFKEGV-WCQYABFASA-N 439.497 2.374 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(=O)[nH]c4)CC3)c2C)cc1 97551779 PSRPFCZJBRJNIS-UHFFFAOYSA-N 434.496 2.389 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)CN4CCCC4)CC3)ccc21 487499014 GDOYADCDQMMZFO-UHFFFAOYSA-N 426.561 2.285 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)cc2F)CC1 730192489 BOZJMHLRXSDJTH-UHFFFAOYSA-N 448.564 2.148 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)COCC(=O)NCc1ccc(N(C)C)cc1C 734402000 BDWYNRXKQKXVTB-UHFFFAOYSA-N 426.561 2.385 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)CC2)cc1 737175441 ZWFZSPLMVXHYAN-UHFFFAOYSA-N 438.463 2.139 10 20 IECD CN(C)C1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)Cc2ccccc2C1 743634598 WGKLSMAZKGUBJS-JOCHJYFZSA-N 449.599 2.287 10 20 IECD CCOC(=O)c1ccc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)o1 752006677 IXDIVOGYYQZMNF-UHFFFAOYSA-N 430.505 2.086 10 20 IECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 753076656 IERHGMPQXIZRLR-WENCNXQZSA-N 447.630 2.471 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 762638600 IFEDOPRLTDGGCC-WJOKGBTCSA-N 443.569 2.029 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cccnc3OCC(F)F)cc2)C1 763574108 ZPLWYQFSYABKBQ-KRWDZBQOSA-N 447.486 2.427 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 765925584 ISORADAHXJSOGA-UHFFFAOYSA-N 433.262 2.153 10 20 IECD COc1cccc(O)c1CN1CCCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 769210966 QUHABBMSVAEAJM-UHFFFAOYSA-N 434.514 2.069 10 20 IECD CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 769614971 MTXYJKKHPRWMRQ-UHFFFAOYSA-N 441.531 2.093 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1N1CCCS1(=O)=O 773844704 FEASFHLUNGHXMD-MRXNPFEDSA-N 444.557 2.417 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 775402215 AOPZDJIOSPMEPL-OAHLLOKOSA-N 433.530 2.085 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](C4CCOCC4)C3)CC2)cc1 778396261 XQYZTZRXJNZGST-ROUKRRSUSA-N 427.545 2.175 10 20 IECD CC(=O)N[C@@H](CC(C)C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783257799 BEQVDUQKRHOAGZ-FQEVSTJZSA-N 436.464 2.495 10 20 IECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCCC1 784555929 HFKDCDYUTAAGBY-SFHVURJKSA-N 430.549 2.311 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOCC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 784598416 OCPMQPJNEVIXKC-RTBURBONSA-N 449.567 2.185 10 20 IECD C[C@H](NC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(N2CCOCC2)cc1 786119870 JPWLDFSXDQMIIU-IBGZPJMESA-N 447.539 2.245 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 787980035 JEPRAQVYKAIBFO-QGZVFWFLSA-N 426.517 2.199 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c(O)c1 797390552 JFTRQSFYOMPUFX-LJQANCHMSA-N 449.511 2.299 10 20 IECD NC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 798440082 HQMUPLVFAYNLCY-UHFFFAOYSA-N 437.949 2.126 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)n2)c[nH]1 799636603 SXDKIQDINSWMOT-UHFFFAOYSA-N 434.499 2.427 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H]1COC2(CCCCCC2)O1)c1ccc(N2CCOCC2)cc1 803312107 VIJLCEFXHFBIGS-WIYYLYMNSA-N 445.560 2.283 10 20 IECD CC1(C)C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803450558 KYUPQLIEIFOTGY-OAHLLOKOSA-N 425.476 2.447 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1 805186564 LSROJWNTUAVHQL-SFHVURJKSA-N 438.528 2.015 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCC[C@H]1N1CCOCC1 806088062 LTRJWJUMUVPKBY-FCHUYYIVSA-N 430.593 2.249 10 20 IECD CCO[C@@H]1COCC[C@@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 807121340 CNKODNAJZVQDMI-LEWJYISDSA-N 429.517 2.185 10 20 IECD C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288865 AVZKSKZHSYSMLF-HKUYNNGSSA-N 442.560 2.441 10 20 IECD C[C@](O)(C1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)C(F)(F)F 807289745 HKKLAEBKTKYLKQ-FQEVSTJZSA-N 425.451 2.231 10 20 IECD C[C@H]1N(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOC1(C)C 807768352 HQHZPSVCFCQEQF-CABCVRRESA-N 425.476 2.399 10 20 IECD CO[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1(C)C 807769697 UXZXLRYRAJTWQC-XOKHGSTOSA-N 425.476 2.303 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)c3ncc(C)s3)CC2)cc(OC)c1OC 808484192 MJMYMRKQLSOWNM-CQSZACIVSA-N 448.545 2.003 10 20 IECD CS(=O)(=O)C[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 813586438 RMTQNHDXSQNDLQ-AWEZNQCLSA-N 449.495 2.118 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c[nH]1 814531863 MKBRBAHJJAHKLK-ZIAGYGMSSA-N 447.463 2.027 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nn1cnc3ccccc3c1=O)c2[N+](=O)[O-] 822134871 XXWOOAZQPVZMEE-UHFFFAOYSA-N 440.371 2.464 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCc3nc(O)c4cnn(C)c4n3)cc2F)C[C@@H](C)O1 917715601 ROQJPXWPBJKISV-ZIAGYGMSSA-N 442.495 2.071 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCN(C)CC3)cc2F)C[C@@H](C)O1 918202915 QFTRAYAIBWWDEK-QZTJIDSGSA-N 435.588 2.265 10 20 IECD CCOC(=O)C1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 921123853 XSOPKOGQVRBLQF-XBMUEBEBSA-N 430.549 2.309 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(N2C[C@H](C)O[C@H](C)C2)ccn1 1116812575 HERQHSBQYYWMJO-KHYOSLBOSA-N 443.500 2.011 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccoc1Cl 1799508800 UOAFGDVNQORUEM-JGPRNRPPSA-N 427.935 2.045 10 20 IECD N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccccn1 1800715494 QLZVMQKYMWMTPS-AHXJXLJNSA-N 430.892 2.098 10 20 IECD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1 1801768298 JKMZLNLTLPGPPH-BCDXTJNWSA-N 445.610 2.426 10 20 IECD Cc1noc(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805530796 BELBYJUBTZZFND-FOIQADDNSA-N 437.456 2.126 10 20 IECD O=C(C[C@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721645 NMPHTTKXEQELLK-CHWSQXEVSA-N 432.502 2.134 10 20 IECD COc1ccsc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844585388 FEOREGQWTMUQEV-GQCTYLIASA-N 430.482 2.404 10 20 IECD Cn1nc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c2c1CCC2 1845501512 XPZDPCOPRTYLMI-UHFFFAOYSA-N 430.892 2.104 10 20 IECD O=S(=O)(NC1CC1)c1cc(NS(=O)(=O)c2cccc3nsnc23)ccc1F 610124124 CJMPUDJDHGJVJC-UHFFFAOYSA-N 428.492 2.072 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1F 727946678 CEWZUYNZCMKQTO-UHFFFAOYSA-N 438.459 2.153 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nc(-c4ccccc4)n[nH]3)cc2)C1 729814794 UUGFADFMIMVZRP-GOSISDBHSA-N 433.516 2.173 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(Cc4ccccn4)n3)CC2)cc1 743165315 VKQWZWBVBYZGJO-UHFFFAOYSA-N 435.532 2.279 10 20 IECD Cc1nn(C)c(C)c1C[C@@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 745274914 HBHFVNDUDLDIRU-OAHLLOKOSA-N 446.523 2.051 10 20 IECD Cc1ccccc1-c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n(C)n1 746376355 DORQQDIBFWHQRM-UHFFFAOYSA-N 433.512 2.487 10 20 IECD CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 748185792 LIYYQJHFAKPGHA-UYAOXDASSA-N 428.577 2.432 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)COc2ccccc2)cc1 750874602 MZRHWFXHMFCVSQ-QFIPXVFZSA-N 425.529 2.455 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1[N+](=O)[O-] 751229056 SFNPBMMQQHODPG-UHFFFAOYSA-N 439.465 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(OC)c(OC)c(OC)c3)CC2)cc1F 754213856 WQESZNAOYZZRPR-UHFFFAOYSA-N 447.463 2.147 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCN(CC(C)C)C3)CC2)cc1 756988096 KTILQSZTKSCPIK-OAQYLSRUSA-N 431.625 2.484 10 20 IECD COc1cc(N2CCN([C@@H]3CC(=O)N(c4ccccc4)C3=O)CC2)cc(OC)c1OC 758820196 NCQXMZYPAAJATC-GOSISDBHSA-N 425.485 2.167 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cnc(Cl)c(C)c3)CC2)cc(OC)c1OC 759410858 XYNHBJHHMFOMCY-UHFFFAOYSA-N 448.907 2.357 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C3(NC(=O)OC(C)(C)C)CC3)CC2)cc1 760311897 WAGZWCVKARHHFI-UHFFFAOYSA-N 432.565 2.381 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCN3CCCO[C@H](C)C3)cc2F)CC1 764409404 RMZJMJLGNJHNAK-LJQANCHMSA-N 435.588 2.268 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(c2cccc(F)c2)C(=O)C1 765880114 YNIUBMYBQQBVKY-UHFFFAOYSA-N 444.482 2.484 10 20 IECD C[C@@H](O)C[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770088396 IHYYAYZFAZRBIL-UKRRQHHQSA-N 449.485 2.477 10 20 IECD COC(=O)c1ccccc1CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 770464794 BPXAFDWGFLKFPE-UHFFFAOYSA-N 425.529 2.353 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cc(C)cc(F)c3)CC2)cc1 770607725 QDYBHGSVLPXJDI-UHFFFAOYSA-N 428.508 2.410 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OC)c(OC)c1 773844867 DCWNPGKDKNFGGX-ZDUSSCGKSA-N 429.473 2.372 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 774537718 MIZVUQPRUFNPER-CALCHBBNSA-N 443.519 2.423 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1cccs1 774863234 YQOXLUAVHMWVPO-GOSISDBHSA-N 432.615 2.337 10 20 IECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1 775701571 GZPDCEZFZDXNIO-UHFFFAOYSA-N 432.468 2.170 10 20 IECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2cc(Cl)cc(F)c2O)CC1 776175122 HSYZCXUQDMWQEM-UHFFFAOYSA-N 427.929 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3ccc(Cl)cc3)CC2)cc1 778230469 BNICXKMLSAWURM-KUFMOJEASA-N 443.931 2.403 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCCc4nc(C)ncc43)CC2)cc1 778284704 QQPUDJQIXQRXGD-NELJVSICSA-N 435.528 2.192 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N=c3cc[nH]cc3Br)cc2)C1 780624962 RXZMOFCWIRHUDL-CQSZACIVSA-N 432.322 2.289 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1F 784766660 JINSVYOKXUHUEV-OAHLLOKOSA-N 448.882 2.003 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C2CC2)cc1 787120749 CJZQVWOMHVNLON-QFIPXVFZSA-N 428.577 2.003 10 20 IECD CC(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 789382322 LTKKULRVIJODQW-HNNXBMFYSA-N 429.546 2.223 10 20 IECD CC(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789823258 DCJIBSKECXVVCE-IAGOWNOFSA-N 435.540 2.472 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H](C)[C@H]1OC 789844424 SANZEKPSWHJQIJ-IPHXSNPTSA-N 449.567 2.359 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 793910942 KRWYYAYMWJCYLD-YOUFYPILSA-N 431.577 2.382 10 20 IECD C[C@H](NCCS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 799321523 GJBXUURBDGWFRY-INIZCTEOSA-N 439.603 2.127 10 20 IECD CC[C@H](C)N(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804220133 YFUKROFTWYQTRR-JKSUJKDBSA-N 426.508 2.220 10 20 IECD CN(C)C(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806495604 IKWGCBVMCRTEQL-UYAOXDASSA-N 445.564 2.151 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)n1 807096045 ROYVRHNXNXIXAP-IBGZPJMESA-N 437.544 2.258 10 20 IECD CS[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807759826 MJCGOUGZHXSMQH-TZIWHRDSSA-N 430.618 2.235 10 20 IECD CO[C@]1(C)CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768702 OVRICLBMEFUZEH-YCRPNKLZSA-N 425.476 2.401 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CCOCC1 807984860 WOYWZHISURLAAY-QHCPKHFHSA-N 442.604 2.156 10 20 IECD O=C(NCc1cc2n(n1)CCCO2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816650649 URCXCJAQWFGEAJ-UHFFFAOYSA-N 434.499 2.164 10 20 IECD Cc1ccccc1CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 916977254 ODSISIZMGHULFW-UHFFFAOYSA-N 440.563 2.405 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cc2c(nc1O)CCC2 919762179 XTHHWCLIUAATKZ-UHFFFAOYSA-N 448.502 2.462 10 20 IECD CCc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1807994930 LRRJLTWYBWHKSI-VLIAUNLRSA-N 437.456 2.072 10 20 IECD N=C(N)SCC(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809638436 JBLSPAYLUWPPDU-UHFFFAOYSA-N 440.953 2.223 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362394 NEYUJYYCKZXYSF-SNVBAGLBSA-N 433.440 2.113 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)c1nc[nH]n1 1817761687 YBFJNMAQSOLMHB-GFCCVEGCSA-N 431.840 2.212 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832221902 OOTUQCJNLIFJHM-LPHOPBHVSA-N 441.532 2.259 10 20 IECD O=C(Cn1nnc2ccccc21)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500608 TUDJGWDOZGOGKK-UHFFFAOYSA-N 441.875 2.013 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)[C@@H](C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 733341546 AGASSLMAVRODKI-KLHDSHLOSA-N 429.558 2.402 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(CCN4CCOCC4)C3)c2C)cc1 734467271 HIGLVEIEYBEDLM-FQEVSTJZSA-N 426.561 2.239 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 746862365 PJROHEACGUIFML-PBHICJAKSA-N 427.567 2.115 10 20 IECD COc1ccc(O)c(CNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)c1 748039559 NJTOPGCLULAQSA-UHFFFAOYSA-N 429.292 2.049 10 20 IECD COc1cc(Cl)ccc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751213584 RKIXLBKIPQXIIQ-UHFFFAOYSA-N 430.935 2.384 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(F)cn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 751814837 KPESZFQQOSXBRN-UHFFFAOYSA-N 431.445 2.315 10 20 IECD COc1ccc(N2CCN(CC(=O)N(CCC(N)=O)c3ccc(F)cc3)CC2)cc1F 753859085 ZQOKCPNOWFNQCQ-UHFFFAOYSA-N 432.471 2.004 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4c(ncn4-c4ccccc4)C3)CC2)cc1 754243457 VHOOIVXAAPLORE-HSZRJFAPSA-N 447.583 2.422 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCC1CCS(=O)(=O)CC1 756059883 YZRTYSMGVMNYGG-UHFFFAOYSA-N 449.495 2.166 10 20 IECD COc1cc(N2CCN(S(=O)(=O)Cc3ccc(Cl)nc3)CC2)cc(OC)c1OC 759099406 ABUSFJRLSLBELU-UHFFFAOYSA-N 441.937 2.413 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc3nnc(O)n3c2)NC(=O)OC(C)(C)C)cc1 762986759 BIRABODNKUDMCU-QGZVFWFLSA-N 440.504 2.497 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)ccc1OC 765764437 KAZZNFOOGHBMCW-UHFFFAOYSA-N 429.292 2.001 10 20 IECD CN(C)c1ccc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1F 768209359 POIPKLMFECNCJT-UHFFFAOYSA-N 434.537 2.390 10 20 IECD COc1cc(O)c(CN2CCN(c3ncc(Br)c(OC)n3)CC2)cc1OC 768464417 QUYAAHAUMREZAI-UHFFFAOYSA-N 439.310 2.293 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(F)c1 772535246 WIQBBTVWUCHMOD-UHFFFAOYSA-N 430.432 2.127 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Cc1ccccc1 774926900 XUQRCMBJZQWHSO-JOCHJYFZSA-N 440.613 2.145 10 20 IECD Cc1csc(N[C@@H](C)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 775905222 MPTAOTVOSNUVAR-AWEZNQCLSA-N 436.509 2.087 10 20 IECD CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCc1ccc(N3CCN(CC)CC3)c(F)c1)CC2 776137811 ZVYKCVVXZLVEEB-VXKWHMMOSA-N 448.583 2.429 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 778236282 WUGDHXQLORCORK-YDZSZYSISA-N 449.511 2.359 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc4c(c3)CCO4)CC2)cc1 778278229 WJDPNQNLIZEPJZ-HJWRWDBZSA-N 435.524 2.194 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(F)cc(F)cc3F)cc2)CC1 786119663 BDTNBSCPPTWMOC-UHFFFAOYSA-N 427.448 2.251 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3csc(C)n3)CC2)cc1 788951484 KXTZTDWKAVFTMV-UHFFFAOYSA-N 429.590 2.258 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CSCCS3)cc2F)C[C@@H](C)O1 789817180 GQKGNPQEAVQTQI-IJEWVQPXSA-N 441.594 2.020 10 20 IECD Cc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 789818397 JTEWCBAEMZHVBN-IAGOWNOFSA-N 428.508 2.118 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](CS(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 795088764 WHCOTYGPJMEKDF-QGZVFWFLSA-N 432.542 2.415 10 20 IECD CS(=O)(=O)N1CCN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1 798208593 RLVDDAGHIAXYDU-IBGZPJMESA-N 441.513 2.311 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3C[C@H](O)c3ccco3)CC2)cc1 804319591 PUVRMZZWBLXXAV-FPOVZHCZSA-N 441.528 2.488 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3c3nc(C)no3)CC2)cc1 806334607 QPZJMHFUAZSVLA-HXUWFJFHSA-N 428.537 2.445 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)c1 806897418 KKBGYQIIUDNTGM-UHFFFAOYSA-N 439.443 2.313 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccc(N(C)C)cc1 806985659 CTGCMVNNBIWRHY-CYBMUJFWSA-N 426.448 2.361 10 20 IECD Cc1ncc2n1CC[C@@H](C(=O)NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)C2 810191539 AXYSVLWEOUDKDK-LJQANCHMSA-N 449.534 2.326 10 20 IECD COCCn1cnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917157640 OMQOFJDVWPIOMS-GJZGRUSLSA-N 437.541 2.086 10 20 IECD Cc1cc(=O)oc2cc(OCC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc12 917832542 AEFABFNVVMTRGC-GOSISDBHSA-N 449.507 2.498 10 20 IECD CCc1[nH]c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1C(=O)OC 917834155 WTAHGZXHJYHYPV-INIZCTEOSA-N 426.517 2.304 10 20 IECD Cc1cccc(C)c1NC(=O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117924 SREIEWPZZODQPZ-LJQANCHMSA-N 437.544 2.443 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1 918434830 UUPWAKXHIHTVCH-UHFFFAOYSA-N 426.517 2.255 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(NC(C)=O)ccc3O)CC2)cc1 919808233 VFOSKYINKYVQMU-UHFFFAOYSA-N 426.517 2.301 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895181 DYCIRJKNBGSJLE-UHFFFAOYSA-N 428.558 2.379 10 20 IECD Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c1Cl 1785028359 OPKQQNFTBKSVCF-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cn2ccc(Cl)cc2n1 1796601372 ZYINNYTWSDSGDA-QDMKHBRRSA-N 441.875 2.360 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[nH]n1)c1cc(O)nc(O)c1 1817846794 BKLIHUNQFUAVDE-NWHUKAGGSA-N 427.486 2.397 10 20 IECD CC1(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CCCC1 1834985575 VOLVETXUARJMNH-UHFFFAOYSA-N 430.549 2.258 10 20 IECD Cc1ccc(C(=O)C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847036820 HBEQQNQLFSQZIG-CSKARUKUSA-N 436.464 2.211 10 20 IECD Cc1cc(C(=O)COC(=O)CN2CCS(=O)(=O)CC2)c(C)n1-c1ccc2c(c1)CCC2 108761335 XQHPLSFXNPQSBD-UHFFFAOYSA-N 444.553 2.039 10 20 IECD C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)cc1)C2=O 108807068 CHSLXCRWEMJTNK-XDHUDOTRSA-N 442.560 2.276 10 20 IECD O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NCc1ccc(N2CCOCC2)cc1 729498360 IUCAUGIZEIDSDB-UHFFFAOYSA-N 438.572 2.479 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 732999589 GVXRFQGBQCNMMB-UGSOOPFHSA-N 449.485 2.340 10 20 IECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1 737279029 SVBJNFQYRHANIA-UHFFFAOYSA-N 449.529 2.076 10 20 IECD Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2)n1C 746380737 FOQHZQGHRYZNOP-MRXNPFEDSA-N 448.527 2.443 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCc1cccc(F)n1 747951360 QYSHRMRYJIYXJG-UHFFFAOYSA-N 439.470 2.476 10 20 IECD COC(=O)c1ccccc1CS(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751240479 NJNKSYWXDNHKBQ-UHFFFAOYSA-N 432.542 2.302 10 20 IECD COc1ccc(N2CCN(CC(=O)NCCc3ccc(OC)c(OC)c3)CC2)cc1F 753861575 SHKWFOQOTQMLOR-UHFFFAOYSA-N 431.508 2.332 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(N4CCOC4=O)cc3)CC2)cc1F 754040276 LYKCKYHCQQZAFX-UHFFFAOYSA-N 435.477 2.302 10 20 IECD C[C@@H](CO[C@@H]1CCOC1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 754045109 HYBQDUOFHKWWNH-GXTWGEPZSA-N 426.516 2.178 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(CC(F)(F)F)CC3(C)C)CC2)cc1 754164159 KNZYQBOWOFLUOL-IBGZPJMESA-N 444.542 2.137 10 20 IECD COc1cc(N2CCN(c3cc(N4CCCC[C@@H]4CO)ncn3)CC2)cc(OC)c1OC 764883513 DTXDWQXVKWYHTJ-QGZVFWFLSA-N 443.548 2.180 10 20 IECD COC(=O)[C@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767883287 IYVLVDKWGPQJRO-JOCHJYFZSA-N 429.492 2.295 10 20 IECD CN(CC(=O)O)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 769449009 OWJAKMZAHYVKAL-IZZDOVSWSA-N 429.317 2.193 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccnc1Br)c1ccc(N2CCOCC2)cc1 774162060 BNUWJELZAKFBFC-CYBMUJFWSA-N 433.306 2.497 10 20 IECD CCS(=O)(=O)N1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775647997 LLAJFPIXKCLZGT-UHFFFAOYSA-N 442.173 2.385 10 20 IECD CN(Cc1cc(Br)cc(Br)c1O)C[C@@H](O)CN1CCOCC1 775714612 VCFRQOCRYMLJDB-CYBMUJFWSA-N 438.160 2.042 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc21 776051626 YZHHHHQMGULDBF-UHFFFAOYSA-N 447.583 2.466 10 20 IECD C[C@H]1[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 776718447 QXTWTLDZQMUXAE-OLZOCXBDSA-N 427.523 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](CCO)c3ccccc3)CC2)cc1 778321788 VRVFNBIEZXBIRR-GMGKOPGTSA-N 437.540 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(C(C)=O)c(C)n3)CC2)cc1 778405438 NGOYMEDANHVNHB-ZHACJKMWSA-N 436.512 2.122 10 20 IECD COCCOc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780407058 DZFRUCUAAFUUPD-UHFFFAOYSA-N 433.530 2.181 10 20 IECD COC(=O)N1CCC(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 786065143 KVDGPOADUUTCAA-UHFFFAOYSA-N 437.408 2.331 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 787202208 MADIEVGHMTWIKN-GOSISDBHSA-N 439.560 2.038 10 20 IECD Cc1[nH]c2ccccc2c1CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799495 HTOSMZBIWORLGZ-UHFFFAOYSA-N 438.503 2.427 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 789812616 NPYVFESKRJCKCW-VXKWHMMOSA-N 441.503 2.315 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCOC2(CCCCCC2)C1 789844441 SKNYOOHJOAFBLK-UHFFFAOYSA-N 447.551 2.355 10 20 IECD Cc1ccc(CN(CCO)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789855915 LKVDHDLIWGHTKL-UHFFFAOYSA-N 427.570 2.186 10 20 IECD COc1ccc(CNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c(O)c1 797608953 PSVDGSHSWJTWPN-UHFFFAOYSA-N 442.516 2.396 10 20 IECD O=C(NCCN1CCCc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803999390 XXUYILLGIFVBRT-NRFANRHFSA-N 437.540 2.469 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cccc4cccnc34)cc2F)CC1 804009080 OWYJBPMNTKJLNB-UHFFFAOYSA-N 449.530 2.448 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3COc4c(F)cc(F)cc4C3)cc2)C1 812011251 YUGGLBTXKKDUAT-MAUKXSAKSA-N 444.482 2.469 10 20 IECD CO[C@@](C)(C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CC1 812659275 TUIYZLUGKGURBE-OAQYLSRUSA-N 434.514 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@]4(CCCO4)[C@H]3C3CC3)CC2)cc1 819261432 MNUHPKDLYXNKKV-SLUIGLDYSA-N 425.529 2.070 10 20 IECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)cn1C 914789663 RCCJVVKPLMJGAI-UHFFFAOYSA-N 434.499 2.080 10 20 IECD CCN1C[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1=O 914910275 CORCXFPFVDGRRO-INIZCTEOSA-N 426.469 2.460 10 20 IECD CCN(CC)C(=O)CN1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916624564 GSLHYSISYFIHNG-UHFFFAOYSA-N 447.649 2.326 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3cc(F)cc4c3OCOC4)cc2)C1 917832845 HTOIHYFPSMSCRQ-INIZCTEOSA-N 427.476 2.253 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc2c(c1)OCCCO2 918284633 LFCHYWRAWJQGSZ-UHFFFAOYSA-N 429.448 2.079 10 20 IECD COCCNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1Cl 918306090 RFAXBBAQTHJPOS-UHFFFAOYSA-N 446.935 2.379 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)cc1 920186442 WDSKKWQAMAYFCS-UHFFFAOYSA-N 446.573 2.225 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 920881991 UGDCCFKYSUIMGZ-SSOJOUAXSA-N 448.523 2.094 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(C)(C)CN3CCCC3)CC2)cc1 1321050416 URZMJPTYDBYTFV-KHPPLWFESA-N 428.577 2.138 10 20 IECD CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc1C 1796604243 UTMPKYHCDCHGKW-BCDXTJNWSA-N 438.484 2.325 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1799770782 GRLUSPNNRARAPW-FVCICTRLSA-N 447.875 2.134 10 20 IECD C[C@@H](Oc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550892 VKYFEBKWEBOXHM-MRXNPFEDSA-N 440.500 2.200 10 20 IECD CC[C@@H](NC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815315927 HPQYUQBEBAQMMO-ZYHUDNBSSA-N 438.937 2.432 10 20 IECD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)COC1 1832876786 YRNLXFYBHNUEJZ-JHTBKMLMSA-N 444.528 2.473 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)N2CCOc3cc(N(C)C)ccc32)CC1 437008964 YBWOOERVHWFYIH-UHFFFAOYSA-N 448.545 2.184 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1=O 729628701 XTVYLYXXBLDHAD-RCZSKKKRSA-N 428.577 2.033 10 20 IECD Cc1cc(C(=O)[C@H](C)N2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(OC(F)F)cc1 730806624 QGBHSIYLZNGBDG-INIZCTEOSA-N 434.487 2.370 10 20 IECD CCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1=O 735520354 YRVQOJQETOCCQP-GOSISDBHSA-N 437.496 2.097 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)CC1 742278559 GFONWHVIOJRFHX-UHFFFAOYSA-N 427.592 2.280 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OC)n1 743381927 KUFUXBDOKJETSN-KBPBESRZSA-N 446.479 2.106 10 20 IECD CCOC(=O)N1CCN(C(=O)CN(CC)Cc2cc(Br)ccc2O)CC1 743870896 GJDSVZXGVYZIBZ-UHFFFAOYSA-N 428.327 2.277 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)CS(C)(=O)=O)c2C)cc1 747074608 HMLCGNOIDJDZEA-ZDUSSCGKSA-N 435.498 2.287 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1 747462357 JIRDKONNZRKXCA-UHFFFAOYSA-N 431.558 2.327 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C4CCOCC4)CC3)cc2F)C[C@@H](C)O1 747496199 TVHKSAMFCWXGDG-QZTJIDSGSA-N 434.556 2.446 10 20 IECD CO[C@H](C)c1noc(CN2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 750061052 UEMOHDMYJXQURN-GOSISDBHSA-N 444.580 2.009 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 752399890 IDERCUVRHUJMMZ-KRWDZBQOSA-N 426.492 2.345 10 20 IECD CS(=O)(=O)CCN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 753645300 LRTDIGPFGCGBRZ-AWEZNQCLSA-N 431.505 2.475 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@@H]3OCCc4ccccc43)CC2)cc1 754026612 XCKPDAKFYAIHAQ-RDGATRHJSA-N 425.573 2.424 10 20 IECD Cc1ccnc2nc(C(=O)OCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)nn12 756281778 LOZAHQUUACWGGG-UHFFFAOYSA-N 441.403 2.004 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)c1O 756781011 JLWGQYOZNWVNKM-UHFFFAOYSA-N 430.411 2.487 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](N2CCCC2=O)C1 761115541 SZFFNAKRGMXKNL-WBVHZDCISA-N 431.492 2.486 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(-c3ccc(F)c(F)c3)no2)c1 768016255 IZSKPENQEQVZOA-UHFFFAOYSA-N 425.369 2.449 10 20 IECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)N1CCc2ccccc21 768823107 FQMRUPJICUGRPA-UHFFFAOYSA-N 438.547 2.369 10 20 IECD CCCCCCn1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(O)nc1=O 769633674 MYXJNGBVYJQSPD-UHFFFAOYSA-N 436.534 2.183 10 20 IECD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1OCc1ccncc1 774362589 BEQVNAUXYGDRHT-UHFFFAOYSA-N 437.452 2.378 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3F)cc2F)CC1 775192901 HDBNTUYFZALJIX-UHFFFAOYSA-N 430.499 2.082 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 781447616 JVEKMKVOCAKZJW-UHFFFAOYSA-N 429.448 2.298 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C 785600446 SOOUSWIWZUNQGZ-QFIPXVFZSA-N 447.539 2.121 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(F)cc1 787638529 NKRKTXKGAXWWFN-SFTDATJTSA-N 443.519 2.458 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCSC[C@@H]1c1ccccc1 788333213 QEFYHADEYRVMNK-OAQYLSRUSA-N 425.554 2.456 10 20 IECD CC(C)(C)OC(=O)N[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 788910356 AFXKQEKQESKTJB-LJQANCHMSA-N 430.549 2.323 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 788931191 YFIPYFFXXNYQSZ-UHFFFAOYSA-N 437.500 2.160 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@H]1SCCc2ccccc21 789802417 YIGBBIBTQJAKRA-OAQYLSRUSA-N 443.544 2.425 10 20 IECD COc1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c(O)c1 795357446 PKYJCIAGAZZTLK-UHFFFAOYSA-N 440.543 2.054 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc(Cl)cc(C(N)=O)c3)CC2)cc1F 798443062 CTBCDMCCLBBUCZ-UHFFFAOYSA-N 427.885 2.098 10 20 IECD C[C@H](NC(=O)C(=O)NCC[C@](C)(O)c1ccccc1)c1ccc(N2CCOCC2)cc1 803315493 JTLBBXBJUQSDFZ-UUOWRZLLSA-N 425.529 2.114 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](CNC(=O)OC(C)(C)C)C3)ccc21 803687907 QXMKOOACQVDWHP-GOSISDBHSA-N 444.576 2.449 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317316 ZQLZCXRNKKUJJR-SFHVURJKSA-N 429.517 2.137 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(CC(F)(F)F)CC2)cc1F 804854229 ZLLPOHDUGGHLCP-UHFFFAOYSA-N 432.462 2.385 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 806931254 XFNOCGFKIUZQQP-UHFFFAOYSA-N 437.522 2.439 10 20 IECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 807166108 BQKDJYCJFOEAOS-IAGOWNOFSA-N 433.549 2.446 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807385645 OJNGIWAYLOBCDD-UHFFFAOYSA-N 436.262 2.043 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)s1 807695095 OGSMCDQSXROLKT-UHFFFAOYSA-N 437.587 2.271 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 809232830 UBRJYDRRIYCNRM-DLYXMFSASA-N 436.574 2.096 10 20 IECD CCCc1nnc(SCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1N 813429784 HCEVJZQIJCOEJR-SFHVURJKSA-N 432.594 2.310 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)c1 814271430 JZYGDSPLEUGTSC-CQSZACIVSA-N 432.498 2.458 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2cnccn2)CC1 862391770 RQBSQKCSZOTSAY-MRXNPFEDSA-N 441.491 2.401 10 20 IECD CC(C)CN1C[C@@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914676066 KNWZIMFULCSJJZ-HNNXBMFYSA-N 448.475 2.448 10 20 IECD Cc1cc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)n([C@H]2CCS(=O)(=O)C2)n1 917073997 LVDHXXGOUUXGGE-FQEVSTJZSA-N 445.589 2.220 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)C(=O)CC3)cc2)C1 917834181 YEORIBWLCARCBH-GOSISDBHSA-N 433.512 2.188 10 20 IECD NC(=O)c1cc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1Cl 918036216 WJCLAUXZEYCQQM-CQSZACIVSA-N 429.908 2.462 10 20 IECD NC(=O)CCOc1ccccc1NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 918295681 SJGHQXRWXXIPBB-UHFFFAOYSA-N 437.452 2.407 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)c1 919819402 PMGMERASWWIDJY-UHFFFAOYSA-N 439.484 2.436 10 20 IECD O=C1CN(S(=O)(=O)c2cccc(C(=O)Nc3cccc(N4CCCCC4)c3)c2)CCN1 919823122 AJIZKQZUCCRVAT-UHFFFAOYSA-N 442.541 2.050 10 20 IECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1CNCc1ccc(N2CCOCC2)cc1 920180762 JMPACOZEBDVZFZ-GOSISDBHSA-N 438.981 2.331 10 20 IECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 1321295703 GVTUHDIPKRTMFQ-OAHLLOKOSA-N 439.465 2.293 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1)CCO2 1785508129 YKOXFIWCHCESLA-BVBLWJPBSA-N 442.443 2.099 10 20 IECD COc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)cn1 1787559588 NNUOKFKJYOILAV-UHFFFAOYSA-N 435.440 2.353 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C[C@@H]2CCCCO2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994099 RMZSIUIQLOECKA-SGXKBVARSA-N 440.500 2.167 10 20 IECD Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)ccc1F 1810542949 GCRSLOZMEOTIEN-UHFFFAOYSA-N 428.464 2.494 10 20 IECD C[C@H](Oc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550454 KREOBAZUYMFJFC-INIZCTEOSA-N 440.500 2.200 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)[nH]n1)c1cc(O)nc(O)c1 1817846793 BKLIHUNQFUAVDE-MWDQSAOVSA-N 427.486 2.397 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1)c1cc(O)nc(O)c1 1817846853 DXMQYNQZQSWPTP-MRXNPFEDSA-N 448.443 2.107 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc[nH]n2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293169 HJJAYKYUMREARO-LBPRGKRZSA-N 431.840 2.212 10 20 IECD Cc1cc(C)n(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1825240697 ANVQUKPDHREIFW-LJQANCHMSA-N 441.532 2.240 10 20 IECD CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)CCC1 1828242130 HEUGKMCCMSYTLW-SNVBAGLBSA-N 438.600 2.106 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccnc(Cl)n2)CC1 1829239253 NMASVIAQYRWQEZ-INIZCTEOSA-N 445.907 2.483 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1 12068976 IAZBCBZMJPSRBA-UHFFFAOYSA-N 446.573 2.144 10 20 IECD NC(=O)CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1 732807036 FTFVGWAFEYABLL-UHFFFAOYSA-N 427.460 2.388 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738899154 KNIXENDTOJSNPD-UHFFFAOYSA-N 435.477 2.169 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(CCCCO)CC3)c2C)cc1 750052411 FQZREZTTWAZJFP-UHFFFAOYSA-N 427.545 2.454 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC3(CC2)CNC(=O)C3)c([N+](=O)[O-])c1Br 751963003 XATVCTCMMHJTMH-UHFFFAOYSA-N 429.227 2.381 10 20 IECD COCc1cccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759100563 DNNNFTLKERUSPJ-UHFFFAOYSA-N 436.530 2.370 10 20 IECD CC[C@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 765240466 SOFMFMRJAPXLLD-NRFANRHFSA-N 431.606 2.340 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(OC)c1 765904318 QXTAESPPJZDMPL-UHFFFAOYSA-N 437.246 2.205 10 20 IECD Cc1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1C(N)=O 768011704 DSFOHDPAWXTXQU-UHFFFAOYSA-N 428.558 2.427 10 20 IECD CCOC(=O)[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 774022727 HRAMKDWSSKZGFW-HGZMWJMZSA-N 442.584 2.160 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H](c1ccco1)N1CCCC1 774871447 QMHFUQZCBIWCRB-OAQYLSRUSA-N 440.544 2.028 10 20 IECD CS[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H]1N(C)C 775997475 BEJWQQDUAKAEAF-LXDRIQHSSA-N 438.613 2.033 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3ccc4c(c3)CC(=O)N4)CC2)cc1 778235103 VMGIFTQMBBJNNA-FVNWOWOISA-N 448.523 2.272 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 787196929 IIJBQVSRIFETAU-KSZLIROESA-N 439.560 2.255 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccccc3F)cc2F)CC1 787974020 JRPNSWZZSFYRKT-QGZVFWFLSA-N 444.526 2.470 10 20 IECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1 789819431 MSFCEWXZHCOPRA-IAGOWNOFSA-N 428.508 2.418 10 20 IECD Cc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843109 IQSOCJWQCSOGKX-QGZVFWFLSA-N 443.519 2.295 10 20 IECD Cc1c(S(N)(=O)=O)sc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1Cl 791195590 CNOGWXUTTHSBRI-UHFFFAOYSA-N 443.978 2.466 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)o1 806793346 KXPMJWKOHRZJMH-FQEVSTJZSA-N 429.517 2.141 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](CC)CS(=O)(=O)c1ccccc1 808816157 MENZFMLAALNJIW-GOSISDBHSA-N 432.542 2.500 10 20 IECD COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918017766 GEQJEXJMPITMMO-MRXNPFEDSA-N 441.488 2.305 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cccc(C(=O)NC4CC4)c3)cc2)C1 918123263 SCIXJRJDXLYIKO-HXUWFJFHSA-N 449.555 2.280 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CC2)cc1 918664546 HTBKYAZYRHVSPQ-SFHVURJKSA-N 431.558 2.409 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)nc1-c1ccccc1OC 1320393753 MOKPYAKOIFHVPM-KRWDZBQOSA-N 439.468 2.411 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnc(O)[nH]4)C3)C2)cc1 1779645052 GMXNINMHEOWVGY-XMMPIXPASA-N 449.511 2.280 10 20 IECD O=C(Cc1ccsc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782000936 GJFOMZNLMRPSFN-FQEVSTJZSA-N 436.917 2.499 10 20 IECD C[C@@](O)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)C(F)(F)F 1793933776 OOADRIHGKBDWLC-WMEBDMIVSA-N 436.814 2.316 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccnc1OCC1CC1 1796599196 CZEMVVUJPUSHMG-BJWYYQGGSA-N 438.484 2.242 10 20 IECD Cc1nscc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767290 KYSRQWKZOKIFED-DRXBFXEBSA-N 437.905 2.033 10 20 IECD CCn1nc(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816724733 DSWRIDWXSMFJAS-LBPRGKRZSA-N 442.501 2.014 10 20 IECD O=C(CCN1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823568799 CQJLOPDDERLPMU-INIZCTEOSA-N 428.493 2.008 10 20 IECD COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827423635 AUQCYIPQFFPKGV-GOSISDBHSA-N 440.500 2.444 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CSc2ncccn2)C1 1843073557 LPKSUXJNWGRWCR-UHFFFAOYSA-N 434.905 2.151 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c1 729063939 LVLKQSMKARLPTL-SNVBAGLBSA-N 428.413 2.213 10 20 IECD CN(CCCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 737037657 QISPXYHJTKMAEF-SFHVURJKSA-N 447.580 2.445 10 20 IECD O=C(O)COc1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)cc1Br 742432318 VTVKJGXMUXGYMY-MDWZMJQESA-N 427.276 2.215 10 20 IECD Cc1ccc(Cn2nccc2NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 746381491 JWZZVGFXJHPXKD-QGZVFWFLSA-N 437.500 2.485 10 20 IECD O=Cc1ccc(OCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c([N+](=O)[O-])c1 749406363 OQWXTAVNQWWKCV-UHFFFAOYSA-N 431.420 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F 753738408 JCMIRSXFCSUXKR-UHFFFAOYSA-N 430.436 2.211 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3nnc4ccccn34)cc2F)C[C@@H](C)O1 754583351 LCVJKEHDZAFVGC-BRWVUGGUSA-N 440.523 2.449 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(Br)o1 760362071 LJIRLBNHCUPTJB-UHFFFAOYSA-N 445.291 2.482 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NCc1ccc(N(C)C)c(F)c1 761270924 KOMYNQOJAJWDIV-UHFFFAOYSA-N 445.538 2.140 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(CC(F)(F)F)c1 762415091 BBIWIUXRPPGVNH-UHFFFAOYSA-N 427.452 2.254 10 20 IECD COc1ccc(OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 768149510 HXVMLOIEVHVUBK-UHFFFAOYSA-N 446.475 2.218 10 20 IECD COC(=O)[C@H](CC(F)F)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770149916 SKOJHOPVNPMIMW-NSHDSACASA-N 434.442 2.181 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(S(N)(=O)=O)c(C)c3)CC2)cc1 775221546 CGVGHEDFQPQYBY-UHFFFAOYSA-N 432.546 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc(CN(C)C)c3)CC2)cc1 778226030 NHGWWAIKBFMKJQ-QXMHVHEDSA-N 436.556 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3ccc4c(c3)CC(=O)N4)CC2)cc1 778235107 VMGIFTQMBBJNNA-OAGJVSPASA-N 448.523 2.272 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 780991094 YFGLOTDVQXMMJR-MRXNPFEDSA-N 442.896 2.183 10 20 IECD COC(=O)Cn1ccc(N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 783569894 AGEHYWJZDSQQNK-ZDUSSCGKSA-N 432.436 2.271 10 20 IECD COCCn1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 784326406 XPZOXZXOSNDBHI-CQSZACIVSA-N 447.447 2.489 10 20 IECD O=C(COC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1ccc(O)c(O)c1 784340820 XMZVIBYVGPEWSD-AWEZNQCLSA-N 433.844 2.405 10 20 IECD C[C@@H]1CN(C[C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H](C)O1 788934605 WMVQAVNMDRYCCV-KNKQGSTJSA-N 428.577 2.003 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1(c2cccc(F)c2)CC1 789800136 LUUMNPLKWKAJRW-UHFFFAOYSA-N 429.467 2.266 10 20 IECD CCc1cnc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789826241 PHVDSEZCZUGATO-HUUCEWRRSA-N 448.564 2.433 10 20 IECD COCC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCC1 792690574 JWOOICMUBZBIQU-UHFFFAOYSA-N 434.514 2.284 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccc(C)cc3)N(C)C)CC2)cc1 793723336 WOCJUWGKPWNOCX-HSZRJFAPSA-N 438.572 2.461 10 20 IECD CCC[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793731396 DMPWGRUMCDVJNR-YADARESESA-N 428.577 2.433 10 20 IECD Cc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)cc1 793733323 MGVRBHQIICWBST-FGZHOGPDSA-N 448.567 2.329 10 20 IECD COc1ccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(O)c1 794371125 WTQABTOVWFTZOY-HXUWFJFHSA-N 446.525 2.463 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cc2c(cc1O)OCO2 796392711 ASLALXZLOQKOBX-UHFFFAOYSA-N 436.486 2.153 10 20 IECD CC(=O)N[C@@](C)(C(=O)NCc1ccc(N(C)C)cc1C)c1ccc(S(C)(=O)=O)cc1 797453045 LYYHYOWBGXYMNV-JOCHJYFZSA-N 431.558 2.132 10 20 IECD Cc1[nH]c(C=O)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 801409371 GAJJHHQZCSCBOL-OKILXGFUSA-N 431.464 2.362 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)c2)CCO1 803131660 SLGDDWULXMVQSV-KRWDZBQOSA-N 442.535 2.045 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661859 BYFKHZMLIDFDSG-PBHICJAKSA-N 436.528 2.270 10 20 IECD CC(=O)NC1CCC(N(C)C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 805023563 JQPVHOCOXCDUQD-UHFFFAOYSA-N 428.577 2.445 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)cc1C 805135206 QDTOTYJYKHMXRA-UHFFFAOYSA-N 439.342 2.394 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCSc2nccs2)C1 806281293 SWMXLWREKSLXMF-HUUCEWRRSA-N 426.608 2.285 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 806281948 CFRSVXKQMYKNTO-GOSISDBHSA-N 448.614 2.149 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)Oc3cccc(F)c3)CC2)cc1 807633458 AVZMJMZZQHGQMI-KRWDZBQOSA-N 429.492 2.457 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 814180185 DGYSBHUJYXSEBL-UXHICEINSA-N 428.577 2.399 10 20 IECD CCC[C@@H](C)C(=O)NCCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 814431332 JOFIGXUTZDDXQQ-MRXNPFEDSA-N 436.553 2.096 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H]1CCS(=O)(=O)C1 918220497 KFFUKWZOFCLBBQ-UXLLHSPISA-N 427.542 2.158 10 20 IECD O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918337330 JBOWIINTTBSTLJ-UHFFFAOYSA-N 426.542 2.437 10 20 IECD COc1cccc(C(=O)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 918702980 FSDGRUJBQPOUPL-HZPDHXFCSA-N 429.492 2.494 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1n[nH]cc1I 1116622612 CCYAIYDYOBFVFG-UHFFFAOYSA-N 440.285 2.153 10 20 IECD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)c1ccccn1 1784657557 RXQAJZHMQKHJCY-PEBXRYMYSA-N 445.903 2.393 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1coc(Cl)n1 1796932728 XEWHNBAHIHAPTI-YOWGUQMCSA-N 441.875 2.373 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cnc(Cl)nc3)C2)CC1 1804670896 RBNAMGGLLKVFKQ-UHFFFAOYSA-N 431.880 2.095 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccncc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995597 GYKDENBOIWPWNC-VLIAUNLRSA-N 437.431 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1[C@H]3SC=C[C@H]31)CC2)c1cc(O)nc(O)c1 1816728565 IGVFMNIKWVCAKG-SRDTZFQFSA-N 430.511 2.050 10 20 IECD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)n1cccc1 1816729230 YDJVFCCXYLRVHL-AAEUAGOBSA-N 427.486 2.238 10 20 IECD O=C(Cc1cnc[nH]1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1817049768 MCPYRFIMFBHGGS-JTQLQIEISA-N 447.904 2.399 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1cc(O)nc(O)c1 1817845042 VVBVXNRQUQKLQW-HNNXBMFYSA-N 448.443 2.107 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1cc(O)nc(O)c1 1817848693 XXHYCMOXEPVVRD-CJNGLKHVSA-N 429.477 2.339 10 20 IECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)c[nH]1 1818333437 QLDFBTPAHPNGJB-CQSZACIVSA-N 446.558 2.212 10 20 IECD Cc1cc[nH]c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896416 HLRIRECYIVFNRE-MRXNPFEDSA-N 448.614 2.417 10 20 IECD O=C(c1cc2n(n1)CCCC2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501490 VDGACMIDFXXRIW-UHFFFAOYSA-N 430.892 2.415 10 20 IECD Cc1ccn2c(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)cnc2c1 1847039284 BEIUUZUYFUFYQE-GQCTYLIASA-N 448.479 2.290 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 557935309 NVQGJEZATYOTEV-QGZVFWFLSA-N 441.553 2.472 10 20 IECD CN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 729228172 AHWLAUCSYVZHNF-QGZVFWFLSA-N 433.553 2.054 10 20 IECD Cn1ccnc1[C@@](O)(CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(F)(F)F 731857995 HWUJVQZBPPSARZ-BEFAXECRSA-N 427.423 2.474 10 20 IECD COCCN1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 736652669 CJLCASWLPGCCJG-MRXNPFEDSA-N 430.471 2.062 10 20 IECD Cc1ccc(Cn2nccc2NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)o1 746364437 DTUPEZMFHNLLEW-UHFFFAOYSA-N 437.500 2.267 10 20 IECD CN(C)c1ccc(CNC(=O)COCC(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 746798268 RIHBLNBZUGXRIM-UHFFFAOYSA-N 434.487 2.046 10 20 IECD CC(C)OCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 747580922 KOHXYKZBGAUQRE-FQEVSTJZSA-N 445.608 2.077 10 20 IECD CCOC(=O)c1c[nH]nc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 751062229 HYCOWVHHWFRDDM-UHFFFAOYSA-N 444.460 2.135 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](N2CCCC2=O)C1 751067806 AQNSRHIONUBCHF-OAHLLOKOSA-N 449.554 2.482 10 20 IECD O=C(c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c[nH]1)N1CCCC1 751136420 IPGMQIWCNMXFHD-QGZVFWFLSA-N 433.530 2.326 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(C)cc2F)cc1OC 753773891 FCZVBJQRKHKAOB-UHFFFAOYSA-N 446.478 2.403 10 20 IECD C[C@@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1ccc(Br)cc1O 756523172 BIRWUZLOXCHFFD-CQSZACIVSA-N 434.338 2.334 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)[C@@H](C)N(c4ccccc4)C3=O)CC2)cc1 758192518 LPTYEPHYTWJAJQ-WIYYLYMNSA-N 438.528 2.035 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(C(C)=O)cc3[N+](=O)[O-])CC2)cc1 758225742 UTQQHKVIPJJIFY-LJQANCHMSA-N 429.473 2.368 10 20 IECD CCCC(=O)N1CSC[C@@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759223642 SIGIBMQEXOYBJN-MRXNPFEDSA-N 437.562 2.063 10 20 IECD O=C(COC(=O)c1cc(F)cnc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 767746244 GOUSXETZLIJWGR-UHFFFAOYSA-N 425.819 2.323 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc4c(n3)CCCC4)CC2)cc1 769028922 IILJZNTYESCJNJ-SEYXRHQNSA-N 434.540 2.490 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO 769042497 UZMVYGRNLJGEIG-VWNXMTODSA-N 438.572 2.205 10 20 IECD O=C(NC1CC1)[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769702208 UPCDLEBNDUAVQX-HNNXBMFYSA-N 435.527 2.138 10 20 IECD O=C(NCc1ccc(OC(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 775234482 QMASQQVFODOURJ-UHFFFAOYSA-N 437.418 2.196 10 20 IECD CCn1cc(-c2n[nH]cc2C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 779092185 XHGGMKXMRROREC-UHFFFAOYSA-N 440.504 2.281 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCC(=O)N4)c2)CC1 780408942 PXZNSWKIJIZDGI-UHFFFAOYSA-N 442.541 2.431 10 20 IECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785303813 LPLFJGHBHHIQLH-AWEZNQCLSA-N 434.514 2.107 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](c3ccc(F)cc3)c3nccn3C)ccc21 785599806 PNFXCZFQRWXQKY-OAQYLSRUSA-N 435.503 2.464 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785600753 IMYCWLGFOORIPK-UHFFFAOYSA-N 448.449 2.479 10 20 IECD C[C@@H]1CCCN(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 787671676 PAGYDRSDEZCAKE-SJORKVTESA-N 438.519 2.221 10 20 IECD Cn1ncc2c1CCC[C@H]2NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 789592103 QQKCGGHSYNMSHW-GOSISDBHSA-N 447.486 2.300 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](c2ccsc2)O1 789813319 SXIPRUYFHCZKIN-YWZLYKJASA-N 447.532 2.329 10 20 IECD COc1ccc(CNC(=O)[C@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)c(O)c1 794381821 OTNSOCDPSXTWBC-KRWDZBQOSA-N 428.485 2.125 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 798035047 NYVHOAZGFDDATC-UHFFFAOYSA-N 426.473 2.265 10 20 IECD CC[C@@H](C)N(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804220132 YFUKROFTWYQTRR-HZPDHXFCSA-N 426.508 2.220 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](CNC(=O)OC(C)(C)C)C1 807099387 UIWJJCAPCAJYNX-QGZVFWFLSA-N 432.565 2.441 10 20 IECD CO[C@@]1(C)CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768701 OVRICLBMEFUZEH-VFNWGFHPSA-N 425.476 2.401 10 20 IECD COc1ccc(C[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 808818223 UHIJFLSJUURCBT-IBGZPJMESA-N 439.556 2.485 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C(N)=O)[C@H](C)c3ccccc3)cc2F)CC1 813632487 HBHATYRAAAAZOC-VGSWGCGISA-N 441.551 2.424 10 20 IECD CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 816890917 CBMXLIIITAJFFV-STXHMFSFSA-N 441.569 2.162 10 20 IECD CCOC(=O)NCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915027708 FZXPRCDOQOECFG-ZDUSSCGKSA-N 438.436 2.468 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)c4cccc(Cl)c4)CC3)nc12 917093744 JTJVCSXWMGAZRY-UHFFFAOYSA-N 443.891 2.223 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(NC(=O)OC(C)(C)C)CC3)CC2)cc1 917124908 RRXXUGUEBNRSLJ-UHFFFAOYSA-N 432.565 2.333 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCCO4)cc2F)C[C@H](C)O1 918286269 GIAZEZLIFRUOOV-GJZGRUSLSA-N 443.475 2.465 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 918305810 LRENFOXUMZKBNX-UHFFFAOYSA-N 438.528 2.351 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cc3Cl)cc2)C1 918464432 VSGAAXJZFTZNOR-CQSZACIVSA-N 432.883 2.436 10 20 IECD CCc1c(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1C 919174234 GLUXOCQCYOQAOE-GJZGRUSLSA-N 432.496 2.208 10 20 IECD CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 921086731 OOPLMABVYXPENU-CQSZACIVSA-N 427.523 2.283 10 20 IECD CN1CCN(c2ccc(CNCCOc3ccc(NS(C)(=O)=O)cc3)cc2F)CC1 1337281159 LVJHAHAFJDHEFJ-UHFFFAOYSA-N 436.553 2.118 10 20 IECD CCN(CC)C1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1337363601 GVCKINNKNHMEDX-ZHACJKMWSA-N 428.577 2.233 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1ncccc1F)CCO2 1782007175 LHZYGZRXBPFMDO-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C2)C3)C1 1782788813 AADLBJCWVLTYAK-ZFFFYTDFSA-N 442.512 2.131 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1sccc1Cl 1789040242 NVUYILYJTMURAA-JKOKRWQUSA-N 437.905 2.115 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCCC1(F)F 1793718314 ALECXWUKGBWFJZ-XJFOESAGSA-N 445.557 2.310 10 20 IECD COC(OC)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803355324 NMCDAGLTUOVHDM-GUYCJALGSA-N 449.891 2.085 10 20 IECD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)n1cccc1 1807998776 OMJATRIJXGODFB-KUDFPVQQSA-N 435.484 2.270 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)F)CC2)c1cc(O)nc(O)c1 1816720366 NVCMUABJEYJUGM-SSDOTTSWSA-N 434.371 2.076 10 20 IECD Cc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423987 MHXXYXFEBRQWPR-GOSISDBHSA-N 427.505 2.082 10 20 IECD CC(C)(C)c1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)[nH]n1 1847038988 WSPQAAYUHZCSSO-SOFGYWHQSA-N 440.500 2.354 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1 105175663 RYNZIOMDKDVNQD-UHFFFAOYSA-N 449.573 2.487 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 726039526 UKWWDWSXESEJDS-MOPGFXCFSA-N 445.560 2.172 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(NC(=O)C(C)C)CC3)cc2F)CC1 730133198 LICQKUBXWMVPIV-UHFFFAOYSA-N 433.572 2.414 10 20 IECD CN(CCCC(=O)NCc1ccc(N(C)C)c(F)c1)C1=NS(=O)(=O)c2ccccc21 741915250 OLFUMFMOAVVQMN-UHFFFAOYSA-N 432.521 2.369 10 20 IECD CN(C)C(=O)Cn1ccc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 743136643 NUILNYASBGPIIZ-AWEZNQCLSA-N 436.463 2.363 10 20 IECD CC[C@@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC1 753010217 SIPZOCJWKSIRQL-CRAIPNDOSA-N 440.491 2.193 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 754878099 KOQQUFJLRCEVBW-QGZVFWFLSA-N 426.565 2.246 10 20 IECD COc1c(F)ccc(F)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 756675730 KOUKTAAIKPJWRR-UHFFFAOYSA-N 438.402 2.422 10 20 IECD CCN(CC)CCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 757968560 XNMVUZQOGQONEG-IBGZPJMESA-N 432.590 2.460 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@](C)(O)c3ccc(F)cc3)CC2)cc1 758739639 WRODOLZORANSNG-HSZRJFAPSA-N 430.524 2.163 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1Cc1ccc(F)cc1 760209208 BGBBONCJMWKPFI-UHFFFAOYSA-N 437.475 2.162 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(C3CCN(c4ccc(OC(F)F)cc4)CC3)C(=O)[C@H]2C1 761158203 JJPAMMUVUDGIJC-CXAGYDPISA-N 437.443 2.473 10 20 IECD CCc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc12 762537344 PCLNPQXQQSUNGH-UHFFFAOYSA-N 434.493 2.364 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766983941 VFQGOHGGIGXTCP-AVRDEDQJSA-N 444.601 2.340 10 20 IECD CC(C)C[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 768513041 VJGYYFXTVMJHEF-KXNSMUHISA-N 448.539 2.412 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 768910877 AVRHXLGGITXWIU-SFHVURJKSA-N 443.997 2.188 10 20 IECD CNS(=O)(=O)c1csc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771055141 BELKQMGBVBAPQM-AWEZNQCLSA-N 443.978 2.410 10 20 IECD COc1cccc(CNc2ccc(S(=O)(=O)NCCCN(C)C)cc2[N+](=O)[O-])c1O 774524270 LJBNTIYVMQKEAT-UHFFFAOYSA-N 438.506 2.151 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c1 776041496 KLEKRFNZYBIDKQ-UHFFFAOYSA-N 431.342 2.330 10 20 IECD CCCn1c(COC(=O)c2cccc(O)c2O)nc2cc(S(=O)(=O)N(C)C)ccc21 776282084 NNEBMVQCKNIDEG-UHFFFAOYSA-N 433.486 2.465 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc([S@](C)=O)c3)CC2)cc1 778267745 FNXJYUQOUSVPEL-HTMFBGPLSA-N 427.526 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@H]3c3noc(C)n3)CC2)cc1 778287324 MSJFDQNRZGWISO-CFGKVWFZSA-N 439.516 2.345 10 20 IECD CCCn1c(=O)nc(O)c2c(C(=O)OCC(=O)c3ccc(O)c(O)c3)cc(C(C)C)nc21 782695617 FLXYOPJHGCSWPW-UHFFFAOYSA-N 441.440 2.481 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786120129 IRDQYDWLUITGMI-UHFFFAOYSA-N 445.541 2.010 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)c3ccc(Cl)cc3)cc2)CC1 786254307 CDPMCNJABKGRNK-INIZCTEOSA-N 442.947 2.443 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3csc(NC(=O)C(C)C)n3)cc2)CC1 786260048 VMDAWYTUBLKCNH-UHFFFAOYSA-N 443.573 2.265 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@H](c2ccc(F)cc2F)C1 788323668 NHFWYTDHIYTUKM-NRFANRHFSA-N 445.466 2.018 10 20 IECD CC1CCN(c2ccc(CNC(=O)CNS(=O)(=O)c3c[nH]c4ncccc34)cc2)CC1 796271720 SJBJDHCBGAQHNJ-UHFFFAOYSA-N 441.557 2.394 10 20 IECD CN(CCOCC1CC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768762 BEOQLQYJNMJWGW-MRXNPFEDSA-N 425.476 2.258 10 20 IECD COC(=O)COC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 913360522 DQWCKXDEWYXBKY-WDZFZDKYSA-N 430.301 2.367 10 20 IECD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915699454 FRNWYHUOVFZTKH-JOCHJYFZSA-N 438.507 2.400 10 20 IECD NS(=O)(=O)c1ccc(OCCSCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 916736079 HJSRKZVRQPTBHP-UHFFFAOYSA-N 449.598 2.363 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)c4ccc(F)cc4)CC3)nc12 917098430 JFYOFMMSBRBEPO-UHFFFAOYSA-N 441.463 2.145 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3c(F)cc(F)cc3F)cc2)C1 918745571 HJFSLHOTNDUQNU-CYBMUJFWSA-N 427.448 2.284 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 919817685 VOEKBDKMGUZXGL-UHFFFAOYSA-N 446.573 2.096 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1 1116645497 INUGSIHXRSGLDZ-SFHVURJKSA-N 449.525 2.113 10 20 IECD O=C(CC[C@@H]1CCOC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007224 DXKFWUPIJNRPCX-SZNDQCEHSA-N 438.908 2.011 10 20 IECD CC(C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931129 OPQIWEWVDZMYNE-VBUUOAMHSA-N 426.517 2.233 10 20 IECD CC(C)n1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1798156198 KQQRDNIKOSTAQQ-ZSBFGKGUSA-N 448.907 2.046 10 20 IECD Cc1ccsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802081370 RMVLLXHIKUCPBF-DZISSUGISA-N 444.509 2.090 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804008851 ZXICSFGYEBYQAG-IAQYHMDHSA-N 442.369 2.108 10 20 IECD O=C(CCc1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807644207 DRTSWMQCHZMXQV-WZONZLPQSA-N 447.495 2.235 10 20 IECD Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)n1 1808205063 TURLOJUZFTXVFI-UHFFFAOYSA-N 446.598 2.095 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844239 UTIAKJPPFAWCOK-MRXNPFEDSA-N 435.440 2.405 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824258121 NRVWRTGEBBVVFW-SLLDUXSESA-N 446.544 2.453 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1 1826213136 NULSZNOPEMAOHZ-SFHVURJKSA-N 426.473 2.141 10 20 IECD O=C(c1cnc(Cl)s1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038914 UZNPXWCXNSYMLR-HWKANZROSA-N 435.889 2.444 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2sccc2F)=NN1c1ccccc1 1847924074 RSCHNLOXMLJQJY-IRXDYDNUSA-N 426.473 2.496 10 20 IECD C[C@@H]1Cc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1S(C)(=O)=O 117528354 MFTOEPGSVIFLHP-OAHLLOKOSA-N 447.532 2.303 10 20 IECD O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 117630247 IEYBXQSPYFVSFE-OQLLNIDSSA-N 447.532 2.259 10 20 IECD COc1ccc(CN2C[C@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2=O)cc1 726503868 QBRNXVNAUFXANT-LJQANCHMSA-N 441.503 2.336 10 20 IECD C[C@@H](OC(=O)CCN1CCCC1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 727913341 DJYMAULPZLLVQJ-CQSZACIVSA-N 434.448 2.345 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C4OCCO4)C3)cc2F)C[C@@H](C)O1 728053418 JUBOYPHTABAEDI-ZHALLVOQSA-N 435.540 2.140 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(N2CCCC2=O)cc1 738884171 DAJZHWAOORYUMV-UHFFFAOYSA-N 442.541 2.370 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@@H]4C[C@H]5CC[C@H]4C5)CC3)cc2)C1 748617247 JUJYYEZHLYYRTO-NNXSRULWSA-N 439.604 2.404 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)Cc2c(F)cccc2F)cc1)C1=S=CC=C1 748978505 QKNDKJOUMRKUMV-UHFFFAOYSA-N 436.461 2.441 10 20 IECD COc1ccc(N2CCN(CCC(=O)N3CCN(c4ccccn4)CC3)CC2)cc1F 753858537 WHQROKFUAAMBAQ-UHFFFAOYSA-N 427.524 2.090 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](c4cc(F)ccc4F)C3=O)CC2)cc1 761184347 LHBQLGJUNXREKS-HXUWFJFHSA-N 430.455 2.389 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 768082920 SREBSOBMSHHUED-UHFFFAOYSA-N 448.523 2.099 10 20 IECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](c1ccc(C)cc1)n1cncn1 770116379 MPYYMNXPRNUMSG-AZUAARDMSA-N 443.529 2.462 10 20 IECD COc1cccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)c1O 771416488 HMMFHPKQHABPJK-HXUWFJFHSA-N 435.839 2.277 10 20 IECD O=C(NC[C@@H]1COC2(CCOCC2)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 776941678 XWUWBBKPPQCVCA-GOSISDBHSA-N 441.475 2.478 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc(OC)c3OC)CC2)cc1 778238920 RSMVTTBBIOJCRW-VAWYXSNFSA-N 439.512 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3[C@H]3CCCC3=O)CC2)cc1 778404423 AYMRVEOCLMLTQQ-HTQPURHSSA-N 425.529 2.260 10 20 IECD C[C@@H]1C(=O)CC[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 781314742 WFLRRTFFCJWAMZ-NVXWUHKLSA-N 434.508 2.463 10 20 IECD CC(=O)N(Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1)C1CC1 785296595 GXAPCVHVQALWAX-AWEZNQCLSA-N 425.485 2.295 10 20 IECD O=C(NCCc1ccc(OC(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 785411200 KHKWTTULEKQMJF-UHFFFAOYSA-N 433.455 2.100 10 20 IECD CC(=O)Nc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 786231475 TWEJWMIYFUHZED-HXUWFJFHSA-N 425.485 2.175 10 20 IECD CC(C)Nc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 787250928 ANWGOAFKCQHCOW-UHFFFAOYSA-N 430.480 2.351 10 20 IECD CC(C)(C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCOCC1 787527822 AOPZXBQFENXVKL-UHFFFAOYSA-N 436.464 2.055 10 20 IECD COc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)cc1 789797959 AAHHFIVQNMCGFH-LJQANCHMSA-N 441.503 2.303 10 20 IECD CCOC(=O)N[C@@H](CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)CC(C)C 789931667 BOVKIJWWVAUIHU-GOSISDBHSA-N 448.564 2.011 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN2C(=O)NC[C@H]2C1 802432720 JKYXPNZVDXMBOR-IBGZPJMESA-N 435.532 2.213 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](CCCO)c1ccccc1)c1ccc(N2CCOCC2)cc1 803299937 OWDNNZRHUNEGED-PGRDOPGGSA-N 425.529 2.330 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-c4nc(O)n[nH]4)c3)CC2)cc1 803404429 PGAMSSPNISVZAU-KTKRTIGZSA-N 448.483 2.029 10 20 IECD CN(Cc1nc(O)c2sccc2n1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686124 WXMYYWDESJSYFL-UHFFFAOYSA-N 425.514 2.054 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 810400490 KAWWFRYBBQKJDJ-VIFPVBQESA-N 438.234 2.454 10 20 IECD COc1cc(N2CCN(CCNC(=O)c3ccccc3F)CC2)c([N+](=O)[O-])cc1OC 811804460 OJNLHKAPMXLSOS-UHFFFAOYSA-N 432.452 2.303 10 20 IECD COc1cccc(/C=C(/C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n2nnnc2C)c1 818074591 SYDFOVLIQGVKPP-KQWNVCNZSA-N 448.527 2.483 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccnc1OCC(F)F 820781747 HYHQLJCETFPGAV-UHFFFAOYSA-N 427.473 2.383 10 20 IECD CCCCN(C(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 914903913 UPTSBZZUFOBDTG-SFHVURJKSA-N 447.557 2.462 10 20 IECD Cc1ccc([C@@H](CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)N2CCOCC2)o1 918200964 LMRAJQVZYPNBTC-OAQYLSRUSA-N 446.523 2.436 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccc(C)c(F)c2)C1 1320397087 DQENAMPLVDMSQX-QAPCUYQASA-N 444.459 2.189 10 20 IECD CC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1792863842 XSORAPOQEYXEBS-MXNKGDRCSA-N 425.529 2.068 10 20 IECD Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1814971678 DZLMXLYABYZPDP-KRWDZBQOSA-N 436.472 2.468 10 20 IECD COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nc1 1827427604 NAWXAZJZWKZCAP-IBGZPJMESA-N 440.500 2.444 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)CC2)cc1 21857100 TXQOLEUYWSIITF-LJQANCHMSA-N 441.459 2.152 10 20 IECD CNS(=O)(=O)C1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 732206375 WWZIQPSXZSLUMW-UHFFFAOYSA-N 447.557 2.077 10 20 IECD Cc1nc2n(n1)C[C@H](N[C@@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 732918425 MEPGWOVIBOATGI-XJKSGUPXSA-N 429.480 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@@H]3CCCN(c4ccccc4)C3=O)CC2)cc1 734489032 RDFGBSSDNLXCBY-HSZRJFAPSA-N 436.556 2.471 10 20 IECD CN(C)c1ccc(CNC(=O)CSc2nnc(-c3cccc(N(C)C)c3)n2N)cc1 735980958 USGWQQSNAMXJMN-UHFFFAOYSA-N 425.562 2.199 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)c2)CC1 739767563 CYNBATGGCOSFIZ-UHFFFAOYSA-N 435.444 2.130 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCc2c[nH]nc2C1 742573805 NYVVPXNUBVDBFY-QGZVFWFLSA-N 435.507 2.087 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCOC1 743555947 DLYBJXVSQNMWSH-SJLPKXTDSA-N 428.512 2.167 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1C 746787911 YYPCFTNBTSERHZ-UHFFFAOYSA-N 439.512 2.245 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F 749730856 XMISAKMALGCFQQ-UHFFFAOYSA-N 435.499 2.377 10 20 IECD Cn1cnnc1C1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751065622 QOHCIVYUEMYUIC-UHFFFAOYSA-N 447.542 2.403 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)NCCN1CCC1 752296970 XXVTZPBWNKIAPF-GXDHUFHOSA-N 440.388 2.472 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 753078041 KYUHWDJQGDGLSF-BETUJISGSA-N 432.418 2.313 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(S(C)(=O)=O)cc1 753205563 UJNQGKGMVBKRMG-VQIMIIECSA-N 443.569 2.212 10 20 IECD CCCCNC(=O)C1(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 754668138 NOEQAXCJQXPIJB-UHFFFAOYSA-N 448.583 2.487 10 20 IECD CCc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 758669095 YGOZFZURQXMLED-UHFFFAOYSA-N 436.555 2.140 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cn4ccsc4n3)CC2)cc(OC)c1OC 760105678 XWRNNQYFMSCGLG-UHFFFAOYSA-N 431.518 2.453 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2nccn2C)CC1 760875013 KIHOWJJYERTDFD-INIZCTEOSA-N 443.507 2.345 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 760972551 MDXAGTYJLVIATO-FXAWDEMLSA-N 434.581 2.325 10 20 IECD COC(=O)c1sccc1N1C(=O)C[C@H](N2CCN(c3ccc(OC)c(F)c3)CC2)C1=O 762438052 WZFOUQLNPYGFJA-INIZCTEOSA-N 447.488 2.137 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCC[C@H]1N1CCOCC1 763662200 YBNCIKJBTNMIFQ-IFMALSPDSA-N 434.556 2.229 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)cc(OC)c2)cc1OC 767733660 UXJOJFLCDZNBSD-UHFFFAOYSA-N 430.504 2.275 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCC3=O)cc2Cl)C1 774473160 SDNCKFTZLPYIQW-INIZCTEOSA-N 434.968 2.321 10 20 IECD Cn1cc(N2CCN(Cc3cc(Br)cc(Br)c3O)CC2=O)cn1 775707650 XVQZVVBGJJJLIW-UHFFFAOYSA-N 444.127 2.500 10 20 IECD CC(C)(C)NC(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 776119029 ZLROYYXEXOCBIV-UHFFFAOYSA-N 435.544 2.122 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccc(N(CC)CC)cc1 777898627 UFZVPVPGESNXLI-UHFFFAOYSA-N 425.576 2.310 10 20 IECD CCNC(=O)c1ccccc1NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778232914 JLKAQSGIPPRSQO-SEYXRHQNSA-N 436.512 2.288 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(-n4ccnc4)cc3)CC2)cc1 778249988 KHZWXGHAJOCVTH-ZHACJKMWSA-N 445.523 2.402 10 20 IECD Cc1nc([C@H]2COCCN2CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)no1 779632654 QLORNBWFGGSYCU-GOSISDBHSA-N 432.436 2.165 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(C)c(C(=O)O)c3C)c2)CC1 780409371 WALZJYBNXRMNHW-UHFFFAOYSA-N 431.514 2.471 10 20 IECD O=C(COC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1)c1ccc(O)c(O)c1 782371134 XHXQDGVAZKCBPE-UHFFFAOYSA-N 431.422 2.209 10 20 IECD Cc1cc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 782592671 LANCXPGEGZEUJM-INIZCTEOSA-N 426.473 2.347 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H](c1ccc(C)cc1)n1cncn1 785440771 CELPBKSYVQPZAA-FGZHOGPDSA-N 434.544 2.453 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)[C@@H]4CCCC[C@H]43)CC2)cc1 785530032 ZMTGSZQFSSKYLX-AJSBUHFISA-N 442.604 2.361 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(-c2ccccc2)no1 788312315 HKAPMQVXSLZMDL-QGZVFWFLSA-N 449.511 2.109 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1COc2ccccc21 789840825 NWJXJZGVAHQTIA-DNVCBOLYSA-N 441.503 2.084 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789855652 VFWLPLQNBGTMCM-OTWHNJEPSA-N 432.634 2.339 10 20 IECD CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793734559 UPBZEMGZRZDWDS-YZGWKJHDSA-N 446.617 2.137 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)c(F)cc(F)c2F)cc1C(=O)O 795319138 KSYBQBQGVFDZKQ-UHFFFAOYSA-N 442.368 2.114 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C[C@@]2(CCOC2)O1 805026733 YRCZVASAPJGZIC-ZJSXRUAMSA-N 429.561 2.336 10 20 IECD CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806494136 LPPZQONXQXKURV-QUCCMNQESA-N 445.564 2.199 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C[C@H]2O 807673625 WTOKCKPVTDCIJI-RDTXWAMCSA-N 427.501 2.023 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cccc(OC(C)(C)C)n1 807857173 LJCWIJRMRJXIPE-UHFFFAOYSA-N 440.544 2.370 10 20 IECD COc1nnccc1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 808902125 OPASYAFYRWOLRL-UHFFFAOYSA-N 438.467 2.063 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)CC2)cc1 813772616 MUXWSBBRNLFNRY-DPFQIHSTSA-N 439.556 2.100 10 20 IECD COCCCNC(=O)[C@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 822948424 QXTGJKAVHBCQTE-LBPRGKRZSA-N 440.408 2.068 10 20 IECD CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194890 KWLUBUFJHPMDDN-UHFFFAOYSA-N 438.528 2.164 10 20 IECD Cc1cc(C(=O)NC2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)no1 1115952622 MDTPJANKMISLLS-KRWDZBQOSA-N 441.532 2.485 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@](O)(c1ccc(C)o1)C(F)(F)F 1321367159 SGZZJFMUCQSZPF-ORAYPTAESA-N 445.390 2.430 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(C[C@@H]4CCCN4CC)C3)CC2)cc1 1341406047 CIBRNWIRDSENIZ-FPOVZHCZSA-N 428.577 2.067 10 20 IECD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1cccc1 1784332551 WPRBXASPEUOWCJ-LHSJRXKWSA-N 433.892 2.257 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4nc[nH]n4)C[C@@H]32)cc1 1790126931 XBVAESPSULLAKH-JBACZVJFSA-N 448.527 2.119 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800720079 YPKGNWCKSIJNPH-IVSAIRAKSA-N 437.924 2.308 10 20 IECD C[C@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CC=CCC1 1802082542 QZLFPOXGRXZLNG-VMIJDXDNSA-N 442.512 2.153 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990061 DGQQYPFQMNLSJL-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(F)(F)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997893 GNZHWQDZHNKOIZ-IAQYHMDHSA-N 426.807 2.039 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2ccccn2n1 1818501531 QIGYMRSKYJJJEB-KRWDZBQOSA-N 447.455 2.483 10 20 IECD CCOCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715889 VGUCOXSDDAKDRU-OAQYLSRUSA-N 440.544 2.436 10 20 IECD CC(C)(C)CC(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828242191 CJAYHCRBLJHFOS-JTQLQIEISA-N 440.616 2.352 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2csc(C(F)(F)F)n2)C1 1844549408 ICGXLMSZZJNTMB-UHFFFAOYSA-N 428.392 2.099 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3ccc(F)c(F)c3)cc2F)CC1 303276642 HPSVRZBHXFDJTQ-UHFFFAOYSA-N 434.462 2.292 10 20 IECD CCN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCS(=O)(=O)C1 726722108 MPODWGXIBOEHGQ-INIZCTEOSA-N 431.505 2.475 10 20 IECD COc1ccnc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 734913689 KGJBGCNMHOYAOR-HUUCEWRRSA-N 431.464 2.316 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1C 737118066 YVEAXSGUZSNXTD-UHFFFAOYSA-N 432.546 2.420 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 737168148 YTHLJMQSWZZBLG-UHFFFAOYSA-N 429.496 2.037 10 20 IECD Cc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737245760 PMYHMQUTGJGDLA-UHFFFAOYSA-N 435.933 2.138 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C2(C(=O)NC3CC3)CC2)NC(=O)OC(C)(C)C)cc1 742752272 FRBCFWOIBABJSA-SFHVURJKSA-N 430.549 2.493 10 20 IECD COC1CCN(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751070076 NVUBFPNIBTXFBS-UHFFFAOYSA-N 439.559 2.095 10 20 IECD O=S(=O)(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn([C@H]2CCOC2)c1 751999969 JVTJZAKEFGWVTQ-SJORKVTESA-N 440.953 2.146 10 20 IECD Cc1cc(C(=O)CN2[C@H](C)C(=O)N(C)S2(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 752889390 ZBYYKZPKXBCAQD-CYBMUJFWSA-N 441.456 2.286 10 20 IECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 755071839 HLMWCSUMQFFVHB-QGZVFWFLSA-N 446.529 2.392 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756711117 IGELPENGVWLANO-WMZOPIPTSA-N 441.532 2.125 10 20 IECD COc1cc(N2CCN(C(=O)c3ccccc3SCC(N)=O)CC2)cc(OC)c1OC 759238968 FKPLIUMLXBFTJN-UHFFFAOYSA-N 445.541 2.252 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O 764894412 HSPNWFJTKGHCSR-HXUWFJFHSA-N 436.512 2.031 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O 767338413 OHFASDNELPHFAI-UWJYYQICSA-N 433.574 2.137 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCN(C(=O)c2ccccc2)CC1 769760246 VZRLNCHGQWHGCW-UHFFFAOYSA-N 431.514 2.141 10 20 IECD CN(C)C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 769862344 UVLVRMYPCVERHE-AWEZNQCLSA-N 448.501 2.125 10 20 IECD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Br 772952848 HCTNBBYIVBZORW-UHFFFAOYSA-N 433.306 2.244 10 20 IECD CCN1CCOC[C@H]1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775013076 MOEALEPRIKIAGB-VLIAUNLRSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccn(CC(F)(F)F)n3)CC2)cc1 778390617 CHMKTRFYHPRYMQ-VOTSOKGWSA-N 437.422 2.298 10 20 IECD Cc1cc(C(=O)N2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)c(C)n1-c1ccc(F)cc1 779582944 GFWDDWKRTSVZNA-HXUWFJFHSA-N 449.548 2.500 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)C[C@H]3C)cc2F)C[C@@H](C)O1 780312807 SMOZJQSKUSEYAH-KURKYZTESA-N 436.572 2.426 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC[C@H](N2CCNC2=O)C1 782962040 ZYXCZDWLQQFPDE-KRWDZBQOSA-N 437.491 2.456 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 786820966 SVCQJNNPQLCBRA-UHFFFAOYSA-N 429.492 2.382 10 20 IECD CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)N1CCOCC1 787322389 QGCFXMBVQQGUDV-QHCPKHFHSA-N 430.593 2.108 10 20 IECD CCC(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCC1 789814099 XWLWMEWBHQUIKE-QFIPXVFZSA-N 448.583 2.295 10 20 IECD Cc1cccc(=O)n1C[C@](C)(O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792238303 OSFRTBCEBMTUDA-GCJKJVERSA-N 433.936 2.048 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnc(CC(C)C)nc3)cc2F)CC1 792344246 RVNCEOUAFVIPPN-UHFFFAOYSA-N 442.539 2.211 10 20 IECD CC(C)[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734021 OWMHJAHISBQEGF-HLAWJBBLSA-N 428.577 2.336 10 20 IECD COc1ccc(CN2CC[C@@H](NC(=O)NCc3cccc(OC)c3O)C2=O)c(OC)c1 807577551 WERGROIXALYPIV-QGZVFWFLSA-N 429.473 2.018 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(N(C)C)cc1 807670758 HYWZHASGXGJUHR-LJQANCHMSA-N 437.588 2.490 10 20 IECD COCCc1nc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)no1 811199742 UVEGCBXUQGRPEZ-UHFFFAOYSA-N 439.471 2.183 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccccc1-n1cccn1 918438568 HOQCKIUQTKPSMP-UHFFFAOYSA-N 437.475 2.227 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 919860359 WAYYDXNADKUKCX-NHCUHLMSSA-N 443.544 2.121 10 20 IECD C[C@@H](NC(=O)NCc1cccc(NS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920866446 DVCBDGPJNJDJHJ-MRXNPFEDSA-N 432.546 2.455 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c1 1318418899 BDWZRHYPLANVJM-HNNXBMFYSA-N 437.949 2.123 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cc4c(c(S(N)(=O)=O)c3)CCC4)c2)CC1 1342839561 ILVYAZIJXBVOCM-UHFFFAOYSA-N 428.558 2.217 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2 1782009252 VCYTVDFJVDIUSW-NBHSMZAVSA-N 433.263 2.119 10 20 IECD COc1ccc(F)cc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602880 XCMRIVNCAZGQFU-BJWYYQGGSA-N 429.448 2.135 10 20 IECD Cc1nn(C)c(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931103 LSZCSBDLLLAQIE-GGPHIMKMSA-N 448.527 2.082 10 20 IECD CC(C)=CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1799207880 BWXRPTWQRUDNNU-HHVYCJAJSA-N 430.501 2.153 10 20 IECD NC(=O)c1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718078 BEIWXTHSNDHRFT-BTTYYORXSA-N 443.887 2.416 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H]2CCOC2)cc1 1801519086 SQBNTGPIMRGTOM-CUDBPUKSSA-N 437.540 2.334 10 20 IECD Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808788657 MSPKPPZDNOEQNM-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1 1809511435 NXTOBCJNPTZZFS-GTACMHHNSA-N 445.903 2.237 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@@H]1C[C@H]1C1CC1 1814762896 HDSDYUMMMUXQTL-GUTXKFCHSA-N 447.586 2.308 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1c(F)cncc1F)CC2)c1cc(O)nc(O)c1 1816724963 FGQMEZUWZDMVKN-SECBINFHSA-N 447.423 2.162 10 20 IECD CC[C@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)N(CC)CC 1841677040 KTSFDFZARSZFHM-QXLXQBSBSA-N 431.533 2.140 10 20 IECD C[C@@H]1CCc2c(C(=O)N3CC4(CCCN4C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)n[nH]c21 1843441501 DJYBDRYUQICLNA-OAHLLOKOSA-N 446.511 2.069 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2Cc3ccccc3C2)C1 1847129763 YYEYQYAULVYVGP-UHFFFAOYSA-N 442.519 2.398 10 20 IECD Cc1ccc2ncccc2c1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726976517 MHDWHBRRNCNXQG-UHFFFAOYSA-N 445.566 2.257 10 20 IECD COC(=O)c1cc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-] 732622026 NHHICFFKBKQFTG-UHFFFAOYSA-N 447.419 2.052 10 20 IECD CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H](C)CS(C)(=O)=O 732984874 HZDJVNOVIFUUGK-AWEZNQCLSA-N 428.510 2.156 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743975774 VAYZDBZNKACMDT-MRXNPFEDSA-N 446.454 2.371 10 20 IECD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NCc1ccc(N2CCCC2)cc1 748452831 HJXFFFHBDNBEGT-UHFFFAOYSA-N 436.560 2.220 10 20 IECD C[C@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749848620 WCDQGVBJILJQEG-FXAWDEMLSA-N 428.577 2.480 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C[C@@H]2CCOC2)CC1 749852441 FYJQANBGLYTLNW-ROUUACIJSA-N 447.535 2.443 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nc4nc(C)cc(C)n4n3)CC2)cc1 758183574 BANXCXZBUUCPET-SFHVURJKSA-N 428.562 2.025 10 20 IECD COc1cc(N2CCN(C(=O)Cc3ccc4c(c3)NC(=O)C4)CC2)cc(OC)c1OC 759223685 UWGCAPFUMMTZDR-UHFFFAOYSA-N 425.485 2.098 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 759400194 KXIOALVTXUAGAY-UHFFFAOYSA-N 431.558 2.023 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCN(CC(F)F)CC3)cc2F)C[C@H](C)O1 767119600 LXNSOGKPGZWLCZ-IRXDYDNUSA-N 442.526 2.328 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 774210590 ACMNHZMXWPAZLX-SNVBAGLBSA-N 441.893 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H](CS(C)(=O)=O)c3ccccc3)CC2)cc1F 774274338 DXYZZCJVQURBRP-LJQANCHMSA-N 435.521 2.452 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3cc(CCCO)c(C(F)(F)F)n3)CC2)cc1 775323677 PRRKEIRDVNWCJG-UHFFFAOYSA-N 426.439 2.184 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)N(Cc2cccs2)[C@H]2CCS(=O)(=O)C2)c1 775371824 UWTGSFYZXHENEL-GJZGRUSLSA-N 438.571 2.329 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(C(=O)C(F)(F)F)CC3)cc2)C1 776123937 OSCFMJQXXVYXOZ-MRXNPFEDSA-N 440.466 2.441 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cc1F 781934291 QVTXTOGDJRTBEZ-QGZVFWFLSA-N 426.558 2.428 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](C)C[C@H]2[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785546100 MNUIXJZBYGORBJ-LFRPXUGBSA-N 433.574 2.406 10 20 IECD COc1cc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccn1 786583079 LTWOOMIPVCVZII-HNNXBMFYSA-N 434.443 2.093 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)cc2)CC1 786660269 CGYRXVUNDKHIMQ-FQEVSTJZSA-N 426.561 2.153 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N4CCCC4)nc3)CC2)cc1 787180977 KFKNHBULCDPZPN-UHFFFAOYSA-N 437.544 2.092 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 787993825 YRFCFDNHABZUIP-SFHVURJKSA-N 441.528 2.042 10 20 IECD Cc1cncc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 789949393 HXWPODQZJDBWRU-UHFFFAOYSA-N 436.434 2.178 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)N(C)C)cc1 793716380 AZFKCNHWACKQDS-WMZHIEFXSA-N 438.572 2.428 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(Cc4ccccc4)CC3)cc2)C1 793725652 QYWGSPIIDXGWOC-OAQYLSRUSA-N 448.567 2.144 10 20 IECD C[C@@H]1CCC[C@](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)(N(C)C)C1 793809016 DPXNJPZCUFIZNA-IECBHUPTSA-N 430.593 2.327 10 20 IECD C[C@@H](NC(=O)C(=O)N1CC[C@@]2(C1)OCc1ccccc12)c1ccc(N2CCOCC2)cc1 803299864 BMCQEIKUSVWEIM-CJAUYULYSA-N 435.524 2.358 10 20 IECD O=C(NCCOc1ccc(F)cc1F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804913840 NYQFBTPCQAQDQN-QGZVFWFLSA-N 434.439 2.373 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@]4(CCCOC4)C3)cc2)CC1 805023366 GFBZGUSERPSRNC-YADARESESA-N 429.561 2.336 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1 805767875 PFCCUCOHYVGENR-MRXNPFEDSA-N 438.516 2.497 10 20 IECD COc1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c(O)c1 806027977 AZXUUVPFDNQMGX-GOSISDBHSA-N 429.473 2.018 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@](O)(C(F)(F)F)CC3)CC2)cc1 806620483 XUZMQGAPKBJGPB-FQEVSTJZSA-N 444.498 2.306 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C 807095919 CEZPSKGEAGXOTR-DNVCBOLYSA-N 432.565 2.439 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4cccc(Cl)c4)C3=O)ccc21 808590285 MRVOCSDVFOBQNZ-IBGZPJMESA-N 440.931 2.260 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc4c3OCC(=O)N4)CC2)cc1 810256709 CSHFAELBYONYBM-UHFFFAOYSA-N 439.516 2.360 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918140714 OJXFROCCWONLJT-HUUCEWRRSA-N 435.521 2.325 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2NC1=O 918298051 WVFWGKNPXHRWQD-WMLDXEAASA-N 439.468 2.258 10 20 IECD C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644498 ZRGBYIXTECIQKP-HNNXBMFYSA-N 449.960 2.010 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc(C(=O)NC4CC4)c3)CC2)cc1 1253811702 KVPKTKACOPGTDN-UHFFFAOYSA-N 429.542 2.488 10 20 IECD CN1CCN(c2ccc(CN3CCN(C)C[C@H]3CNC(=O)OC(C)(C)C)cc2F)CC1 1321777564 CWHPXADFNLEHDS-LJQANCHMSA-N 435.588 2.218 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1 1780509762 MFSHJBSMSJQVBR-FQEVSTJZSA-N 435.839 2.043 10 20 IECD N[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)c1ccccn1 1788426448 KBYIWTWNNYNAGH-FQEVSTJZSA-N 433.468 2.336 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)F)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243539 WRRADOBRVHMTDU-CHIMOYNISA-N 436.814 2.297 10 20 IECD COc1ccc(F)cc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802498666 GPUTYNIJNRTHHW-BJWYYQGGSA-N 429.448 2.135 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1CCCC1 1806188602 FKYRPSDKCGXAHR-APWZRJJASA-N 446.598 2.138 10 20 IECD CCc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807990890 KNOUEISBWUMPSD-VBKZILBWSA-N 437.456 2.072 10 20 IECD Cc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816724750 FZQXSKUWAHOQBI-GFCCVEGCSA-N 425.470 2.192 10 20 IECD O=C1CC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)n[nH]2)C1 1818147869 NWJHYUFYXRZVPB-LJQANCHMSA-N 448.483 2.174 10 20 IECD COCc1c[nH]c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1820157370 JKYFHTXROJDAQN-INIZCTEOSA-N 440.460 2.310 10 20 IECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c1cccc2nsnc12 609985674 PVYDXYACYUBLSV-UHFFFAOYSA-N 442.544 2.141 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1-c1ccc(C(C)C)cc1 727392485 RYFGWFFEPMHNRE-UHFFFAOYSA-N 435.532 2.189 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 731453256 AZPGBVQDMAZIEB-UHFFFAOYSA-N 426.408 2.081 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)o1 748091553 BMLYXYNTMMHSQE-UHFFFAOYSA-N 425.444 2.495 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCCN3C(=O)CC(C)(C)C)CC2)cc1 748381119 CKAXFECATIVQHK-HXUWFJFHSA-N 445.560 2.314 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCN3CCC(N(C)C)CC3)cc2F)C[C@@H](C)O1 748960715 QJOWLIQCPHDQMR-QZTJIDSGSA-N 435.588 2.265 10 20 IECD CS(=O)(=O)Nc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 750723851 AHYHJYHEMBLWHU-UHFFFAOYSA-N 425.457 2.103 10 20 IECD COc1ccc(N2CCN(CCOc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1F 753857019 IIISCWHDESQRTQ-UHFFFAOYSA-N 437.537 2.286 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 756161648 NPUWOZMXYIXTIY-UHFFFAOYSA-N 439.921 2.431 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(NS(=O)(=O)CC)c(C)c3)ccc21 767451267 RKBVIXJUDDDZBA-UHFFFAOYSA-N 439.515 2.485 10 20 IECD CCC[C@@]1(C(=O)OCC)CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 769999765 GWZAFSWWZOSUOR-QHCPKHFHSA-N 435.540 2.476 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1 771168022 MHPJNLHBWCTHMK-UHFFFAOYSA-N 429.539 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccco3)N3CCCC3)CC2)cc1 774865089 GMDMALFUAPGWQO-OAQYLSRUSA-N 440.544 2.280 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 778234146 MLLJPCWRUXGTFP-XMHHWPDXSA-N 442.604 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4ccc(OC)cc4C3)CC2)cc1 778243302 CGZGGZBDORJBOF-MDZDMXLPSA-N 435.524 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCO[C@H]3C(C)C)CC2)cc1 778305565 BFNVMOVLAJKNMV-WVNUFQETSA-N 429.561 2.467 10 20 IECD COc1ccc(CCS(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 778883808 LIWFOKJJCBDWCA-UHFFFAOYSA-N 444.534 2.214 10 20 IECD O=C(NCc1cn2ccsc2n1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 785585550 VKEUOZQAFWYLKV-ZDUSSCGKSA-N 449.483 2.399 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)c(F)c3)cc2)CC1 786425832 AWNRYZUCCFDGGS-UHFFFAOYSA-N 432.883 2.403 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ncc(Br)cn3)CC2)cc1 786997448 XKSRRQFORUKRBW-UHFFFAOYSA-N 434.338 2.190 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(Cc2ccc(F)cc2)CC1 788323997 PFRRQMDRZRRLBD-UHFFFAOYSA-N 425.504 2.418 10 20 IECD CC(C)n1cc2c(n1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCC2 789800144 MAODHVTXQLSWSL-IBGZPJMESA-N 443.523 2.250 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCSC[C@@H]3c3cnn(C)c3)CC2)cc1 790262527 JGKOUVMCQHFVSU-OAQYLSRUSA-N 444.605 2.050 10 20 IECD CC(C)[C@H](NCc1cccc(Br)c1O)C(=O)N(C)Cc1nnc2n1CCC2 793246454 HZVIGAHVTHTHFL-KRWDZBQOSA-N 436.354 2.465 10 20 IECD O=C(NCCOC1CCCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793678218 VVIIODIHROBRIQ-HNNXBMFYSA-N 425.476 2.448 10 20 IECD C[C@H](COc1cccc(F)c1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793785387 QBRDZYOWYVHCGL-QGZVFWFLSA-N 429.492 2.204 10 20 IECD COc1ccccc1OCCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803302443 ONMVGNUUTYIGAG-SFHVURJKSA-N 441.528 2.246 10 20 IECD C[C@H](NC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803306511 VVHXKEOALLIBFB-KRWDZBQOSA-N 448.564 2.074 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)c1ccc(N2CCOCC2)cc1 803308823 KTENLMYTSWJMCI-VGOFRKELSA-N 441.503 2.440 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccncc1 805010226 XWMXJLJUKHEYTJ-HXUWFJFHSA-N 427.524 2.246 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387098 ZDCBNWUONSVVFR-UHFFFAOYSA-N 425.210 2.335 10 20 IECD COc1cccc2c(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n[nH]c12 808676257 JJIWRODJKRIGMS-UHFFFAOYSA-N 442.447 2.020 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@H](c2ccco2)C1 808853723 CUMDKSULAUVCBO-NRFANRHFSA-N 436.556 2.444 10 20 IECD C[C@H](O)C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 809461001 DAQJDEBYQKCMDH-SIKLNZKXSA-N 439.556 2.153 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@](C)(c4ccc(F)cc4)C3=O)CC2)cc1 810022758 YXMRWECSGCVTKQ-XMMPIXPASA-N 439.487 2.200 10 20 IECD Cn1nnc(Br)c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 810160198 XNEGPPCNEZQZQQ-UHFFFAOYSA-N 448.243 2.363 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCCC4)cn3)cc2)C1 917391178 OILADPVXXZRRQW-SFHVURJKSA-N 443.573 2.180 10 20 IECD CS(=O)(=O)c1ccc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c([N+](=O)[O-])c1 917391550 ZRHXLUWJKVNRFI-OAHLLOKOSA-N 432.502 2.312 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCN(CC(F)(F)F)C3)cc2)C1 918116901 CAKANGITHQKOHF-IAGOWNOFSA-N 441.498 2.072 10 20 IECD Cc1cc(CN2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)on1 918219893 QDIFYEWAGAEHSQ-UHFFFAOYSA-N 431.512 2.111 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(NC(=O)[C@H]2CCCO2)c1 919839118 BPBVVKNLLSNIJN-HXUWFJFHSA-N 443.525 2.291 10 20 IECD O=C(CS(=O)(=O)CCCc1ccccc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969385 KUQHUVZKIHYKNI-UHFFFAOYSA-N 448.560 2.451 10 20 IECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 920495831 GCVQZYYWFGFSAE-NTKDMRAZSA-N 437.496 2.367 10 20 IECD C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 920868007 ZXEWPMXHBXXUMX-MOPGFXCFSA-N 440.544 2.140 10 20 IECD COc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778337710 UETLVLHDKMEULJ-IIBYNOLFSA-N 447.513 2.004 10 20 IECD Cc1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)sc1C 1779981907 OKUVQVAKWKGHCD-QVKFZJNVSA-N 446.529 2.007 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC1(c2ccc(NC(=O)Cn3ccnn3)cc2)CCC1 1788294428 WBPJVBCSBKDPLV-YCRREMRBSA-N 449.467 2.242 10 20 IECD CN1CC(C(=O)NC2(c3ccc(NC(=O)C4=NN(c5ccccc5)C(=O)C4)cc3)CCC2)C1 1788673718 DTQVJWHYGIWVOP-UHFFFAOYSA-N 445.523 2.475 10 20 IECD O=C1CC(C(=O)NC2(c3ccc(NC(=O)c4cc(O)c(O)c(Cl)c4)cc3)CCC2)=NN1 1790776476 DQMDAWKCKQPVRX-UHFFFAOYSA-N 442.859 2.375 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1F 1799528908 IGXJQAZGOUCEQX-CLLJXQQHSA-N 439.509 2.077 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnc[nH]2)C3)cc1 1799620002 HNWKQNLHGZBRJC-HATOLVCRSA-N 433.512 2.334 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cccc(Cl)c1 1804335823 JEKJWFRQVKEBSR-QDMKHBRRSA-N 437.974 2.452 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(=O)c1ccccc1 1816722099 CPNAFBLQWMOEJX-ZDUSSCGKSA-N 438.465 2.058 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844071 ONMAUTNIYNNXBE-CZUORRHYSA-N 439.476 2.055 10 20 IECD Cc1nc(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)o1 1817846216 KYYCOOMBZWOWOP-AWEZNQCLSA-N 426.433 2.440 10 20 IECD O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)N[C@@H]1CCS(=O)(=O)C1 11643482 JFSLAOAIZXSVCC-SJORKVTESA-N 435.571 2.125 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)COc3ccccc3[N+](=O)[O-])CC2)cc1 24088664 CLCMVOBWOXSIFJ-UHFFFAOYSA-N 428.489 2.311 10 20 IECD CCS(=O)(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 109637485 VMRFXNHVTVVBSK-UHFFFAOYSA-N 447.557 2.015 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CS4)CC2)cc1 726726960 YCLHFDRXZMXJAT-UHFFFAOYSA-N 440.525 2.463 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)N(CC)CC)CC3)cc2F)CC1 730133466 UNDNBWGXLMBVMD-UHFFFAOYSA-N 448.587 2.257 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3nnc4ccccn34)CC2)cc1 734264152 AAGURUXOKFCZEB-UHFFFAOYSA-N 437.548 2.092 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1 737208991 MMASKABLHZQKTL-UHFFFAOYSA-N 425.533 2.206 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@]1(O)CCN(Cc2ccccc2)C1 741402678 CDUSXKDFHMSRCK-XMMPIXPASA-N 442.535 2.099 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(CN4CCCC4=O)cc3)CC2)cc1 742927690 XDPUNRSPRQEUEQ-UHFFFAOYSA-N 436.556 2.370 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H](c1ccccc1F)N1CCOCC1 745501784 XKTOKEFEXBNTFS-QHCPKHFHSA-N 443.519 2.467 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@@H](CO)C3)c2C)c1 746462925 SHLRFHOVRNRPNP-MRXNPFEDSA-N 428.485 2.164 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NCc2ccc(N(C)C)cc2)c1 751998679 DWRQQRJGJMBNOT-UHFFFAOYSA-N 425.493 2.087 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(Cn4cccn4)c3)CC2)cc1F 754213216 PUGCTNGWYJOFIC-UHFFFAOYSA-N 437.475 2.366 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)C[C@@H](O)c1ccccc1 754569799 LZBKPGFUXAQFMU-PGRDOPGGSA-N 431.508 2.071 10 20 IECD COCCOc1ccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 758063915 YEAPEIOOUORUMS-UHFFFAOYSA-N 425.529 2.239 10 20 IECD NC(=O)[C@H](Cc1ccccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 758145221 YNTKDFGYFNTYRG-NRFANRHFSA-N 434.519 2.129 10 20 IECD NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1c(O)ccc2c1CCCC2 760169490 FEEBHCTVHJKTRK-FQEVSTJZSA-N 439.512 2.448 10 20 IECD COc1ccc(N2CCN(CCCN3C(=O)NC4(Cc5ccccc5C4)C3=O)CC2)cc1 760950836 MQTLXHPRJZAARC-UHFFFAOYSA-N 434.540 2.297 10 20 IECD CS(=O)(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 761770946 MLQGMGVAYSIGEG-CQSZACIVSA-N 431.505 2.475 10 20 IECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2cccc(Br)c2O)C1=O 765727932 RHJLCIHYYULVPK-LJQANCHMSA-N 432.274 2.238 10 20 IECD C[C@@H](CC(=O)NCCc1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980815 RRJAVYHGOQGTTH-IBGZPJMESA-N 429.586 2.149 10 20 IECD C[C@@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789798102 BNLQLFFOCUAYNX-XMMPIXPASA-N 425.504 2.469 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H]1C 789826377 PUVKZRWOBIYVJD-GNBUJSLZSA-N 448.583 2.387 10 20 IECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949756 KMIYKNMUBCFZPD-GDBMZVCRSA-N 443.466 2.184 10 20 IECD O=C(N[C@@H]1CCCN(c2ncccn2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 790255014 PAPXRWDRNVFFKK-GOSISDBHSA-N 435.484 2.089 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCN(C)c1ccccc1F 793824929 FCSBEFPILCQJRL-UHFFFAOYSA-N 442.535 2.263 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](O)c1cccc(C(F)(F)F)c1 795366294 IWAYBPKQPAJZSX-GOSISDBHSA-N 442.459 2.290 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 801979313 ZAUWEWFQUWNJSX-UHFFFAOYSA-N 438.528 2.476 10 20 IECD COC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 803297682 CWENCRVGCGJJBK-VFNWGFHPSA-N 447.482 2.483 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1F 803664201 GMEMVZSETXNBAY-LJQANCHMSA-N 440.519 2.319 10 20 IECD CCCCn1cc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(C)n1 804315607 NBZQQAIJFHPWBH-UHFFFAOYSA-N 427.549 2.402 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 806457234 HBOUULIUBDWXSC-GDBMZVCRSA-N 433.446 2.489 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)C1 806493869 GTFGBMXZBGBQKK-UXADLVQTSA-N 426.561 2.271 10 20 IECD COCc1csc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 806956796 KAJDQPYTMZDIMA-UHFFFAOYSA-N 443.573 2.076 10 20 IECD CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 807023643 CDWVXGZQLPOBPS-LLVKDONJSA-N 435.502 2.081 10 20 IECD COc1cc(OC)cc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)c1 807671972 VRSWMLXAGGLNFX-WMZOPIPTSA-N 440.544 2.342 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(CCO)Cc1ccccc1 807770149 YWOKERIPTIGJOT-GOSISDBHSA-N 447.482 2.394 10 20 IECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807952536 NKQIQGHEIIVUGL-CABCVRRESA-N 443.997 2.084 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1nc2ccccc2n1C1CC1 808930034 SQRWXMWSIPRNEA-UHFFFAOYSA-N 447.539 2.483 10 20 IECD O=C(NC[C@@H]1COC2(CCCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809673307 PNZDYLFANIKUQG-VQTJNVASSA-N 446.544 2.482 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C4CC4)n3)cc2F)CC1 815475930 DIIOCHBHDJNRDP-UHFFFAOYSA-N 425.508 2.495 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1S(C)(=O)=O 917835557 BLFNAARVVUHSLU-SFHVURJKSA-N 429.542 2.030 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)cc1OC 920418929 XHOUUHGAOZXZCZ-HSZRJFAPSA-N 440.500 2.115 10 20 IECD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782005197 YWHFKHRKVWJOIL-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1ccc(C2(NC(=O)Cn3ccnn3)CCC2)cc1 1792301067 AZHQVECLYLUDPH-YCRREMRBSA-N 449.467 2.242 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1Cc2ccccc2N1 1804289826 WFXREAOHJVQYOJ-WHVLKBAJSA-N 449.507 2.492 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C3CCC(CO)CC3)CC2)C1 1810547311 KEIJULVUFODRRE-UHFFFAOYSA-N 431.533 2.136 10 20 IECD COc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816431298 SXZLPKDUFCLVCI-HNNXBMFYSA-N 438.444 2.239 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)[nH]n1)c1cc(O)nc(O)c1 1817848279 BUCYGNMYDZMDQI-PXCJXSSVSA-N 429.477 2.073 10 20 IECD CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n(C)n1 1819831018 OQZPHZQGUORQAI-HNNXBMFYSA-N 439.476 2.132 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1 1828379095 FJTQTVUEXYCZCS-ZIAGYGMSSA-N 445.557 2.122 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2nccn2)CC1 1830432166 RXWRZBSANNDLOZ-QGZVFWFLSA-N 447.923 2.276 10 20 IECD Cc1ccsc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988345 YPAPZUFSDYLACK-UHFFFAOYSA-N 444.557 2.362 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(N3CCN(C(C)=O)CC3)c([N+](=O)[O-])c2)c1 728985090 WBRTXOAHLQPKQK-CQSZACIVSA-N 442.472 2.469 10 20 IECD Cc1nnc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)o1 743889278 KYAOEGXVWNMRIN-UHFFFAOYSA-N 435.484 2.479 10 20 IECD CN(C)c1ccc(CNC(=O)c2sccc2S(=O)(=O)N2CCC(CO)CC2)cc1 745484727 BUMKLBROZBPVDX-UHFFFAOYSA-N 437.587 2.137 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1 747308140 MHIAXKLELYTSCI-KRWDZBQOSA-N 443.514 2.143 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](C)Cn3ccnc3C)CC2)cc1 749195480 BTIVAVBPPCTPFZ-LJQANCHMSA-N 428.581 2.348 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CSCCS1 750993220 IUHZQWGOMQNNLC-GOSISDBHSA-N 433.578 2.407 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3C[C@H](O)c3cccs3)CC2)cc1 753865945 ILLCGPIGNVALFF-FPOVZHCZSA-N 445.585 2.230 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cc(C(N)=O)ccc3CN(C)C)CC2)cc1F 753893598 BIJZZFHXWMEEDX-UHFFFAOYSA-N 429.496 2.349 10 20 IECD O=C(Cc1ccc(O)cc1)NCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765549990 ASQLKXXPDLLAFL-MRXNPFEDSA-N 433.455 2.438 10 20 IECD Cc1cc(C(=O)CN2CCS[C@H]3COCC[C@@H]32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767909992 DHCXTEBSCINKOD-FPOVZHCZSA-N 449.598 2.131 10 20 IECD CN1CCC2(CCN(CC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CC2)C1=O 773920203 HGBMAQIVFLIPOU-UHFFFAOYSA-N 431.492 2.345 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H](c1ccco1)N1CCCCC1 774823329 GHNVBJPGYMDUFV-OAQYLSRUSA-N 440.544 2.076 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(N2CCOCC2)CCCCC1 774839174 BMOLXBNTCJYVGI-UHFFFAOYSA-N 430.593 2.252 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1 774862226 WWRJUYUJQAACBL-JOCHJYFZSA-N 442.535 2.040 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1cccs1 774863236 YQOXLUAVHMWVPO-SFHVURJKSA-N 432.615 2.337 10 20 IECD CN(C)c1ccc(N(Cc2ccccn2)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 776387975 NVXRZVFDKRHDJJ-UHFFFAOYSA-N 437.525 2.178 10 20 IECD CC(C)C[C@H]1C(=O)NCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 782856986 JDTZFXUSLWCQST-KRWDZBQOSA-N 435.436 2.357 10 20 IECD COc1cc(OC)cc(C(=O)N2CCC(C(=O)OCC(=O)c3ccc(O)c(O)c3)CC2)c1 782897332 HSWQKWYFDWDCQJ-UHFFFAOYSA-N 443.452 2.393 10 20 IECD C[C@@H](c1ccccc1)N(C(=O)C(=O)Nc1ccn(CC(=O)N(C)C)n1)c1ccc(N)cc1 783483011 MAIUGIGWQPFOQJ-INIZCTEOSA-N 434.500 2.286 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2OC)cc1C 785489914 VJMDTHJYWIUOCR-UHFFFAOYSA-N 442.515 2.353 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC3CCC(C)(C)CC3)CC2)cc1 785529029 UNGLHCDZXKSTDC-UHFFFAOYSA-N 430.593 2.409 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3ccc(F)cc3)N(C)C)CC2)cc1 787643176 XQCRFBUWBMTOAO-JOCHJYFZSA-N 442.535 2.338 10 20 IECD CN1CCN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2Br)CC1 787881499 ISNBGURXIPJLER-UHFFFAOYSA-N 447.333 2.161 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 789369667 ACCNWOBPXYFVQM-LPHOPBHVSA-N 428.489 2.124 10 20 IECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789816311 CVLSROCPOMWWNG-CALCHBBNSA-N 435.540 2.379 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@@H](c2cccs2)C1 789833165 DKAXYFLEOIQPMX-LJQANCHMSA-N 447.532 2.065 10 20 IECD CC[C@@H]1CO[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949761 KMIYKNMUBCFZPD-GOEBONIOSA-N 443.466 2.184 10 20 IECD C[C@@H]1CCc2ccccc2[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735910 ZPJRCAWSPIQKGY-LLBVYWAGSA-N 448.567 2.444 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)c2ccccc2OC(F)(F)F)c1 794259062 GJSFYHCFKAHXTO-CYBMUJFWSA-N 434.392 2.126 10 20 IECD CN(C)c1ccc(CNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cc1F 798098356 ZIQLAVYVSBCNBA-UHFFFAOYSA-N 426.489 2.151 10 20 IECD CO[C@@H](C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771393 LNPFAZBULXYCNI-MCMMXHMISA-N 447.447 2.453 10 20 IECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2 803299658 MCASJGNOAICLFQ-RQIDZSJNSA-N 429.561 2.364 10 20 IECD C[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306357 SQBUNVSIBVWVEP-RTBURBONSA-N 425.529 2.110 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 803450065 CIUABNUDLNGTSC-GUDVDZBRSA-N 449.498 2.447 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 804318965 WGDODSPQEFEDAQ-INIZCTEOSA-N 448.564 2.152 10 20 IECD O=C(NC[C@@H]1CSCCS1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806468021 RCGMYHYBJNMSON-CZUORRHYSA-N 445.557 2.338 10 20 IECD CS[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807759825 MJCGOUGZHXSMQH-PZJWPPBQSA-N 430.618 2.235 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C(=O)c2ccc(F)cc2)CC1 919792057 RPEDCBFNZHZYCY-UHFFFAOYSA-N 426.492 2.330 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(S(=O)(=O)NC2CC2)cc1 919969489 NPWRWUIGVPJFBA-UHFFFAOYSA-N 447.532 2.158 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1778346890 JKOKSMDDHWCLBZ-WJMBTVPJSA-N 430.501 2.083 10 20 IECD CC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1785865626 NXAXUCXVPXLWLB-QGZVFWFLSA-N 426.473 2.155 10 20 IECD C[C@]1(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)CCCN1 1790463249 LKTWQOCWUJPRFD-HXUWFJFHSA-N 446.598 2.123 10 20 IECD CC(=O)NCC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712398 KDTCDEZUFBEMMN-QDMKHBRRSA-N 437.924 2.165 10 20 IECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nc1 1807990117 DZMVIVOSCNMWEU-HRAATJIYSA-N 433.468 2.225 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1 109701879 KUTJEGJKXWEQIY-FYYLOGMGSA-N 449.555 2.380 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(CCNS(C)(=O)=O)cc3)CC2)cc1 726560804 PNFAJHMJBFBHAA-UHFFFAOYSA-N 431.558 2.186 10 20 IECD O=C(NCCCSc1nccs1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 733880930 SEVWERRRYUNZAH-UHFFFAOYSA-N 432.618 2.121 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NCCCSc2nccs2)cc1 734358779 NTWLGSQQQDEGJW-UHFFFAOYSA-N 427.573 2.313 10 20 IECD CC(=O)c1cccc(O[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 745109379 RLAYKUPUFGJPOE-QGZVFWFLSA-N 430.526 2.208 10 20 IECD C[C@@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749848624 WCDQGVBJILJQEG-XLIONFOSSA-N 428.577 2.480 10 20 IECD Cn1cc(N2CCN(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2=O)cn1 750650621 INPHOHHYQUVQOZ-OAHLLOKOSA-N 448.474 2.049 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(Cc4ccsc4)CC3)CC2)cc1F 753858561 WHTJQLUONYFSEC-UHFFFAOYSA-N 432.565 2.362 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3=Cc4cc(OC)ccc4OC3)nc12 756466597 OHINOWVKVIGOPF-UHFFFAOYSA-N 425.397 2.139 10 20 IECD COc1ccccc1N1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 756924734 NOWDINJPYQYBNE-SFHVURJKSA-N 442.491 2.276 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nc4sccc4c(=O)n3C)CC2)cc1 758196864 KWMBPJPKEVKURD-INIZCTEOSA-N 446.598 2.279 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)c3O)cc2F)C[C@@H](C)O1 758559383 HUKJEVNWDKFXNI-ZIAGYGMSSA-N 432.448 2.324 10 20 IECD CCOC(=O)C1(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 763659125 QDJRZLVUUIZNJU-UHFFFAOYSA-N 435.540 2.476 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)(F)C1(O)CCC1 763983209 MCWMRWRFTCVKKH-UHFFFAOYSA-N 435.450 2.109 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(OC)c1OC 765928576 ZPXBMUXZQCHFFZ-UHFFFAOYSA-N 439.262 2.435 10 20 IECD Oc1ccc(Cl)cc1CN1CCC[C@@H](NC2CCN(CCN3CCOCC3)CC2)C1 765993795 MXQKYHIPHQYGHA-JOCHJYFZSA-N 437.028 2.396 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCSC4(CCOCC4)C3)cc2)C1 771300275 LRYQGYYJIVYDAN-GOSISDBHSA-N 432.590 2.196 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCCCS2(=O)=O)NC(=O)OC(C)(C)C)cc1 773194321 WBPMVOIIOPKAGR-ZWKOTPCHSA-N 439.578 2.402 10 20 IECD CCC(=O)N1CC[C@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 773221719 ASJBHUYKVUQXLZ-AWEZNQCLSA-N 434.448 2.202 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773307978 HKLLGWUCWMHERR-MRXNPFEDSA-N 434.562 2.238 10 20 IECD CN1[C@H]2CC[C@H]1CN(C(=O)C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 774230431 RPDZBLFKMRUEGN-BQFCYCMXSA-N 436.503 2.068 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 774865139 HCVRFYIIMOGIAB-FQEVSTJZSA-N 442.585 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nc4ccccc4o3)CC2)cc1 778295637 VEHLPHCXKVXTEZ-ZHACJKMWSA-N 434.496 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nc(C)c(C)s3)CC2)cc1 778367507 HELOPRBBBXELGC-HJWRWDBZSA-N 428.558 2.332 10 20 IECD CCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819203 MLYFSMNSZLJSMP-SCTDSRPQSA-N 434.556 2.046 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCc3ccccc3[N+](=O)[O-])CC2)cc1 796115294 OWRVVJPMDGSPKV-NRFANRHFSA-N 428.533 2.261 10 20 IECD CC(C)N1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803451841 YIVXOELZVQRBLP-UHFFFAOYSA-N 438.519 2.316 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCCN(C(=O)c4ccsc4)CC3)ccc21 803686265 FRHKDTXRNAJPIO-UHFFFAOYSA-N 440.569 2.121 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cccc(F)c4C3)cc2F)CC1 805007813 QNAKZRSVCNEQIY-UHFFFAOYSA-N 442.510 2.308 10 20 IECD COc1ccc(N2CCN(C(=O)NCCn3cc(Br)cn3)CC2)cc1F 805840598 TUMZTKSSOWZDFU-UHFFFAOYSA-N 426.290 2.325 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCCN(C(=O)c2ccsc2)CC1 806279093 DUDPRYHGUVLAIC-UHFFFAOYSA-N 438.600 2.178 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)Oc3cccc(F)c3)CC2)cc1 807633459 AVZMJMZZQHGQMI-QGZVFWFLSA-N 429.492 2.457 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CCCN(C)CCN(C)C)cc2F)C[C@@H](C)O1 812009019 LJVVGGYGEKOUND-KDURUIRLSA-N 437.604 2.464 10 20 IECD C[C@H](c1ccccc1)[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(N)=O 813590572 NYJZHBZRRDXWIH-VFNWGFHPSA-N 428.508 2.244 10 20 IECD O=C(O)c1cc2c(c(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)c1)CCC2 917918207 MMCUXSYSWOMSJU-UHFFFAOYSA-N 434.489 2.328 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 917918490 ROTKGJRSUYXCAO-UHFFFAOYSA-N 425.457 2.238 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 918289574 YKPGPQYKDJPWKS-HUUCEWRRSA-N 442.491 2.054 10 20 IECD COc1cc(CNCc2ccc(N3CCN(C)CC3)c(F)c2)ccc1OCC(=O)N(C)C 1321652824 FQANWNFYNLLFPF-UHFFFAOYSA-N 444.551 2.343 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)cc1F 1353486300 KFJDTSWVWNBCFD-OAHLLOKOSA-N 437.537 2.261 10 20 IECD C[C@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782599213 XQRJMVUIISLDGL-OMXJDXKCSA-N 443.500 2.092 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC=CO3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790244962 HJJKDLKYRINLMR-ZUXXIDCJSA-N 436.892 2.037 10 20 IECD CC(C)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1791867238 NQYJVADDMHQSPC-ACZARTGJSA-N 430.501 2.009 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)c1ncon1 1811182943 HAVSKLJQWWPEKN-WBMJQRKESA-N 443.847 2.163 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CC1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362206 QSDMVLZHGMDHHI-GFCCVEGCSA-N 441.488 2.350 10 20 IECD CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)nn1C 1819989080 ZLVFATNWGNQFCY-MRXNPFEDSA-N 439.476 2.132 10 20 IECD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)on1 1827423946 LAGCJHLORSJNST-SFHVURJKSA-N 428.489 2.265 10 20 IECD O=C1CC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1832882497 JNVWGFLLASQNCJ-XZXOBPBMSA-N 442.512 2.415 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)C(F)(F)C(F)F)CC2)CC1 1837021712 KMZGZSHMTZRZQC-UHFFFAOYSA-N 449.401 2.005 10 20 IECD CCC(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837649864 QRUAKMCDXHBHFO-UHFFFAOYSA-N 426.517 2.188 10 20 IECD CCOc1ncc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250022 BUJKDUYECHUFRJ-UHFFFAOYSA-N 432.864 2.071 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H](O)Cc2ccccc2)C1 1846066935 NOHBBHNLPHLZGB-SFHVURJKSA-N 430.888 2.172 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 734406098 MMIMVUKSCUHQAN-NSDWXSQCSA-N 434.540 2.481 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Cc3nnn(-c4ccccc4)c3C)CC2)cc1 742917202 SYRYYZRWBKXYKC-UHFFFAOYSA-N 434.544 2.065 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCn2ccnc2C1 749209151 XCFFXKVPRNKXOD-GOSISDBHSA-N 435.507 2.018 10 20 IECD O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)OCC(=O)c1ccc(O)c(O)c1 753603835 PWSVDRVNNICDDO-UHFFFAOYSA-N 433.482 2.241 10 20 IECD COc1ccc(N2CCN(CN3C(=O)N[C@]4(CCc5ccccc5C4)C3=O)CC2)cc1F 754015041 VOGGALWTMDUCAJ-DEOSSOPVSA-N 438.503 2.393 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 754072490 ZTNSSWNMUCTRHF-JHMXWDHMSA-N 428.621 2.127 10 20 IECD Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)CN(C)c2ccc3c(c2)OCO3)CC1 756647300 ZXKOFXXZJYLHCH-UHFFFAOYSA-N 438.528 2.251 10 20 IECD COc1cc(N2CCN(C(=O)c3cn(Cc4ccccc4)nn3)CC2)cc(OC)c1OC 759225641 SGXNHXUQANXHST-UHFFFAOYSA-N 437.500 2.315 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765930095 HWYJQHZCYITRJL-UHFFFAOYSA-N 434.290 2.420 10 20 IECD O=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912852 RYIZIFMOPSXDKJ-SFHVURJKSA-N 426.908 2.345 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1F 770291314 HWVONZZOEDFRIL-UHFFFAOYSA-N 426.441 2.271 10 20 IECD CNC(=O)COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 772057052 IYUSCWIHVSTYIY-IRXDYDNUSA-N 443.519 2.423 10 20 IECD C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)c2)C[C@H](C)O1 774362997 PRPVGCSAEIZHTN-HOTGVXAUSA-N 427.501 2.004 10 20 IECD COc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)cc1 774812177 PLLHRFWTJOMUNR-QFIPXVFZSA-N 442.535 2.470 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N(C)C)c1ccc(N2CCOCC2)cc1 774853074 GMDIZGVBDOXAHV-LPHOPBHVSA-N 430.574 2.181 10 20 IECD CNS(=O)(=O)[C@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 775697138 VGTVDADZWDSDEN-NSHDSACASA-N 442.173 2.431 10 20 IECD COCC(=O)N1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)ccc21 778524266 GLCLGPTWTATBBC-UHFFFAOYSA-N 436.512 2.077 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 781444403 ZGLUUBDKBDATJN-QGZVFWFLSA-N 442.468 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3CCN(C)C)CC2)cc1F 782654433 OYPXUWQMOXSYIM-UHFFFAOYSA-N 428.508 2.226 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1 785294514 MXSXOMQGEDELQZ-CQSZACIVSA-N 446.935 2.189 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N2CCOCC2)cc1 785397178 LAQQIVXSKLKGQK-ROUUACIJSA-N 448.527 2.159 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(COC3CCOCC3)c2)cc1 785427272 BYYKOBXJVVTEIM-UHFFFAOYSA-N 425.529 2.381 10 20 IECD COc1ccc(OCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 785560090 MZTQIHNTGJVKCZ-UHFFFAOYSA-N 429.542 2.060 10 20 IECD COC(=O)c1cc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c([N+](=O)[O-])c1 792736271 HPOHTRAUBIRZFZ-UHFFFAOYSA-N 442.472 2.459 10 20 IECD CC[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734336 SCTQNNQCEHRVLY-PZJWPPBQSA-N 437.544 2.009 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccccc3S(=O)(=O)C(F)F)CC2)cc1 799505754 PQQUMHSIPTYTOJ-UHFFFAOYSA-N 439.484 2.452 10 20 IECD COCCN(C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2 803299602 MCASJGNOAICLFQ-JEEBJRHZSA-N 429.561 2.364 10 20 IECD COc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687866 IVXDWMGTVWDDTN-UHFFFAOYSA-N 436.556 2.038 10 20 IECD COC(=O)c1cn(CCNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)nn1 807251535 WEZNZBHUGRFYPY-UHFFFAOYSA-N 426.477 2.136 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(CCCCO)C1CC1 807768186 DWXITPBNCXPEJO-HNNXBMFYSA-N 425.476 2.137 10 20 IECD CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2cc(Cl)cc(Cl)c2O)C(=O)C1 807838243 NLMVWPTXWUJEOX-UHFFFAOYSA-N 432.304 2.395 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4c(c3)CCCC4=O)CC2)cc1 814384044 ZKLHQKMUYWQEQZ-UHFFFAOYSA-N 443.569 2.315 10 20 IECD Cn1cnc(NC(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)n1 817153546 RBROAXRXZQQUCC-IZZDOVSWSA-N 438.332 2.418 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(N2CCNC2=O)CC1 917162092 WGWNVWHHEVXKQN-OAHLLOKOSA-N 446.507 2.279 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2ccsc2)CC1 918080255 BDACRILGMNYECW-UHFFFAOYSA-N 432.521 2.391 10 20 IECD O=C(Nc1ccc(Cn2cncn2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294043 BWOMKYURXOYNJE-HXUWFJFHSA-N 435.484 2.178 10 20 IECD O=C(CNC(=O)c1ccc(Br)cc1)NCc1ccc(N2CCOCC2)cc1 920211674 IWVOUHYDOPQJSX-UHFFFAOYSA-N 432.318 2.332 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 920495869 KJAYDOMNKDPRMJ-IBGZPJMESA-N 446.525 2.081 10 20 IECD COCCOCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 920710786 PKWYARYPTGASLE-CQSZACIVSA-N 425.437 2.385 10 20 IECD CCOC(=O)c1c(CC(C)C)csc1N/C=C1/C(=O)NC(=S)N(CCOC)C1=O 920978559 JGQZQPPWVYZLRC-LCYFTJDESA-N 439.559 2.309 10 20 IECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 1254720911 CBXYZZJKQZPGGJ-ZWKOTPCHSA-N 430.574 2.386 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2ccccc2)cc1OC 1321366467 MHQYPCZXNVZLBF-INIZCTEOSA-N 425.441 2.196 10 20 IECD CC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425459 RDGCMVKSAIRNNY-KRWDZBQOSA-N 426.473 2.155 10 20 IECD Cc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932467 AYNSUYMJKZOIAF-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccnc2c1OCO2 1800716336 CNIHXELRBPJAFD-CLLJXQQHSA-N 445.859 2.441 10 20 IECD CC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803007167 VARXVLIPWLAZEV-RPVQJOFSSA-N 433.892 2.237 10 20 IECD O=C(Cn1cncn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817609729 KVMGETLDIWPNJH-CQSZACIVSA-N 445.867 2.072 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCC4=O)C3)cc2F)CC1 732464127 ZOHQNROQQUIRQT-LJQANCHMSA-N 431.556 2.264 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccc(S(=O)(=O)NCC4CC4)cn3)cc2)C1 742396048 GRUBNHBMVWIYON-GOSISDBHSA-N 443.573 2.084 10 20 IECD O=C(NCc1ccccc1O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1 748439291 ZUUTYOCFPHSFIE-UHFFFAOYSA-N 425.894 2.388 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)c(C)c2)cc1 748691794 SNNFPBUNKMVEDO-UHFFFAOYSA-N 428.488 2.021 10 20 IECD C[C@@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc2N1C 749917994 ITRTWHDSMWUASS-CRAIPNDOSA-N 435.528 2.095 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3N(C)C(C)=O)CC2)cc1F 754211289 FVOSUXJURZGOLY-UHFFFAOYSA-N 428.464 2.104 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(O)n1 755191335 GPGHDUVLXYOZQM-UHFFFAOYSA-N 438.406 2.206 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(C(=O)NC4CC4)c3)CC2)cc1 758225818 VPBTTYQMSQCGLL-OAQYLSRUSA-N 425.529 2.149 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2sccc2Br)SC1=S 764886386 QPPXEHIDJOPVBJ-RMKNXTFCSA-N 427.392 2.261 10 20 IECD COC(=O)[C@@H](COC(C)C)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767115610 LZEPTUFBWSZUST-LJQANCHMSA-N 438.480 2.299 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c1 767153883 CLBCMCOGAVDUQI-LLVKDONJSA-N 441.868 2.092 10 20 IECD CCOc1ccc(O)c(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1 768206813 IODPHZVRNRUREJ-UHFFFAOYSA-N 433.530 2.289 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1 771203036 CACXSNYPLQIQBZ-HXUWFJFHSA-N 448.523 2.493 10 20 IECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 772776207 OVJIRGXFWFASRE-NXSJDDFASA-N 438.358 2.215 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 773242322 HDLSTKBINRXQCO-INIZCTEOSA-N 442.491 2.099 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CCCOCC1 776321157 GTBIHGNSMNPILS-SFHVURJKSA-N 428.512 2.311 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)ccc21 778603927 HGWOCCJDEXNORT-CQSZACIVSA-N 441.484 2.142 10 20 IECD COCCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 780306785 OWJVEJBNROMYJZ-QGZVFWFLSA-N 431.455 2.489 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@H]2c2ccccc2F)c1 784037770 ZUDTYFCZCJMAMT-JOCHJYFZSA-N 441.503 2.239 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1 785298583 WKZKEMOUAOACPL-SNVBAGLBSA-N 445.369 2.458 10 20 IECD COc1cccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1OC 787927607 YUIYKVDZOZGEGN-IBGZPJMESA-N 442.512 2.276 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 787977054 VMAJWXFUAXEQTE-QHCPKHFHSA-N 436.556 2.093 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@H](O)C[C@@H]3C)c2C)c1 788274733 AFWYZJAWTHQFNX-ORAYPTAESA-N 428.485 2.305 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](c2ccc(F)cc2)O1 788324875 ZBSICTFNZLUCPL-VGOFRKELSA-N 441.503 2.267 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCCC1 790191933 XXQLOHAQSXFCEI-DLBZAZTESA-N 438.519 2.221 10 20 IECD CCc1nn(C)c(CC)c1CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 790888614 KPDXASNLXMJCIP-UHFFFAOYSA-N 430.549 2.462 10 20 IECD CC(C)NC(=O)NC1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCCC1 792074141 IBHRAPKLPDOFJM-IBGZPJMESA-N 443.592 2.415 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 803874045 HNAPSFKQATUJMH-MRXNPFEDSA-N 435.521 2.048 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1F 804851877 RDYHCYZNIVMTQL-MRXNPFEDSA-N 431.487 2.217 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cccc2c1CNC2=O 807022786 QONXZQOWXFJOJT-UHFFFAOYSA-N 432.274 2.385 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N=c3ccnc4n(C)[nH]cc3-4)cc2Cl)C1 807072947 DBFAPYKBVRQBLF-CQSZACIVSA-N 440.935 2.486 10 20 IECD Cc1cc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)nc(C(C)C)n1 807291858 IMRMCYPRGWAONN-UHFFFAOYSA-N 448.571 2.250 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)S(=O)(=O)[C@H](C)c3ccccc3)CC2)cc1 810020962 JEXYOHFVAWOZOM-GOSISDBHSA-N 431.558 2.367 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)SCC(=O)N4)nc12 811297425 YKHYVCUSQDPSGA-UHFFFAOYSA-N 428.426 2.013 10 20 IECD CS(=O)(=O)C[C@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 813621863 IFKQMZQNQPLREP-AWEZNQCLSA-N 431.505 2.333 10 20 IECD O=C(CSc1nc2ccccc2o1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676388 KNUFSIQHVSXDRR-UHFFFAOYSA-N 431.539 2.471 10 20 IECD CCCN(C(=O)[C@@H](C)N1CCCN(c2ccc(OC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 917087815 IMRLODGOZSJMPZ-QUCCMNQESA-N 437.606 2.022 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@H](O)COc1ccc2c(c1)OCO2 920237876 KOLSDLQYZMAYIC-SFHVURJKSA-N 445.541 2.208 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](CO)C3CCCCC3)CC2)cc1 1117735370 XRIHZPBXEQTJRW-ZCPJJFRWSA-N 429.561 2.205 10 20 IECD CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1 1786358829 CWXGHLKFPZZUDN-LEAZDLGRSA-N 439.512 2.280 10 20 IECD CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)on1 1799769262 WZCZITFZASLJFR-IVWMJMPLSA-N 449.891 2.380 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831906300 QJBRHFJGRNKQGU-DYESRHJHSA-N 440.544 2.434 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1 1832002885 SYXRYNDTMQEBSF-NKELODKYSA-N 431.533 2.277 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3c(C)nc4ccccc4c3=O)cc2F)CC1 730192709 LYIPYKSZTROTGQ-UHFFFAOYSA-N 437.519 2.302 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccnc2N2CCOCC2)cc1F 731408555 QBNURKLQUJHSAW-UHFFFAOYSA-N 429.496 2.158 10 20 IECD COc1c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(C)nn1C 732851928 NEVCLGTYZHJEKJ-UHFFFAOYSA-N 433.420 2.308 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)cc2F)C[C@@H](C)O1 733851011 VOPJEMZUUPUHIC-ZIAGYGMSSA-N 440.475 2.189 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2 734468086 JXBGAUOZMSJBSV-UHFFFAOYSA-N 447.557 2.207 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)N3CCc4ccccc4C3)CC2)cc1 735958297 WXTRGOSELIDBIM-LJQANCHMSA-N 437.540 2.334 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 737220487 VVRUBTHENRUGQR-UHFFFAOYSA-N 428.445 2.385 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)n1cccn1 742800801 SZEBEJIBBLJNTN-HOTGVXAUSA-N 435.475 2.289 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 744690382 CBKWVKSXABFDGE-UHFFFAOYSA-N 425.445 2.195 10 20 IECD CS(=O)(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 751138064 YFFXTYWEEDZWMS-OAHLLOKOSA-N 443.518 2.305 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@H](c4ccccc4F)C3)CC2)cc1 754030177 LWXHEQSGJHHVDV-HYBUGGRVSA-N 429.536 2.391 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCc4c(Cl)cccc43)cc2)C1 757264515 YLXDGBFSZHIIQP-INIZCTEOSA-N 440.931 2.247 10 20 IECD COc1c(F)cc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 761042922 PHZVLZVBMGDUTM-UHFFFAOYSA-N 433.455 2.437 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CNS(=O)(=O)c2ccc(Br)s2)c1 761974732 XBPFAYIZNUXUGL-SECBINFHSA-N 449.348 2.381 10 20 IECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1 762000892 QNZVSWTUKKBBMW-ZDUSSCGKSA-N 434.470 2.418 10 20 IECD C[C@H](NC(=O)NCc1ccnc(OCCN(C)C)c1)c1ccc(N2CCOCC2)cc1 762562654 XNRVXFRALAZYMI-SFHVURJKSA-N 427.549 2.419 10 20 IECD C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCS(=O)(=O)C1 764369110 SCMOHPGNVLAIQJ-AWEZNQCLSA-N 431.505 2.333 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(=O)n(-c4ccccc4F)n3)cc2)C1 765648360 HLIMWZCTQDHKAX-KRWDZBQOSA-N 449.486 2.003 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1C 773249536 QLGHTQCYRNNFAM-UHFFFAOYSA-N 430.479 2.483 10 20 IECD Cn1cc([C@H](CO)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 778401652 DKAPGLUIKRYRBF-GFKDLEGOSA-N 436.584 2.313 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@](C)(O)c3ccccc3)CC2)cc1 779346584 PAFBNCDLEKYJSL-PTGWMXDISA-N 437.540 2.314 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3ccsc3)N(C)C)CC2)cc1 787652292 IJQCWDCIGDUPAF-FQEVSTJZSA-N 430.574 2.261 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](CN3CCCC3=O)c3ccccc3)ccc21 787736534 KVSLPBKXOAEVEX-OAQYLSRUSA-N 434.540 2.165 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1 788979126 SXGOHHWEPURHNI-HXUWFJFHSA-N 427.549 2.099 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]2CCCC[C@H]12 793735886 ZGXOGQBNHSNBFN-PLWAMTLXSA-N 426.561 2.042 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1c[nH]c2ncccc12 795394594 AJMJPUIJUHKACH-UHFFFAOYSA-N 429.546 2.344 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCCC34CCOCC4)CC2)cc1 800607802 ZIKHIMMOVDDHMA-GEPASTNRSA-N 427.545 2.366 10 20 IECD C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677020 CUHSCUNTMLLZLI-DLBZAZTESA-N 437.606 2.352 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806279082 DJYOCNFMEWDVIZ-UHFFFAOYSA-N 446.598 2.471 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cccc4c3CNC4=O)CC2)cc(OC)c1OC 806753112 HRNPZAZPZOXOSA-UHFFFAOYSA-N 426.473 2.310 10 20 IECD C[C@]1(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCCS1 807775896 QQZPVFOXGKZGJV-HSZRJFAPSA-N 430.618 2.237 10 20 IECD COCCN(C)CCN1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1=O 808270041 QVRGNPJNIKXNDX-IBGZPJMESA-N 442.560 2.012 10 20 IECD N=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCN(c2ncccn2)CC1 849069837 YFQWPHAVFHMZLV-UHFFFAOYSA-N 449.481 2.179 10 20 IECD Cc1cc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1-n1cnnn1 916677651 CBQRKNOPDDHFKF-UHFFFAOYSA-N 425.468 2.393 10 20 IECD CN(Cc1nc(O)c2ccccc2n1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918118275 XSVQGAQGJSNOGI-KRWDZBQOSA-N 448.527 2.379 10 20 IECD C[C@@H](NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F)c1ccc(N2CCOCC2)cc1 920890040 IHWWJPLGFJUYII-AUUYWEPGSA-N 426.439 2.274 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCc1ccc2c(c1)CC(=O)N2 1116591715 HKLKYJRKLXWSKI-SFHVURJKSA-N 426.469 2.206 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CN(C(C)=O)C4)CC2)cc1 1319887355 FRPZTUSDEOKIOU-MDZDMXLPSA-N 448.523 2.401 10 20 IECD CN(C)CCNS(=O)(=O)c1cccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)c1 1347180710 VQUJDOSWKZDGQG-UHFFFAOYSA-N 449.596 2.030 10 20 IECD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1780456465 MEWCCAZDGYPXCD-WZONZLPQSA-N 425.485 2.243 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1sccc1F)CCO2 1785504057 VXLAAWHTOXYSDW-ZZNNXKBLSA-N 448.472 2.161 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)C3CCSCC3)C2)C1 1785636350 DPBIAMIZIHCNSV-HXUWFJFHSA-N 440.949 2.338 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(F)(F)F)C2)c1cc(O)c(O)c(Cl)c1 1799770890 SQIVCVWAHPYXFP-QHBPRCKVSA-N 436.814 2.297 10 20 IECD Cc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)c1 1802080454 NYHHAMCZNGMUAM-SQKXBHHXSA-N 438.480 2.028 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnc2[nH]ncc2c1 1804285782 JQWLTJBEJDXHIJ-KYXSFPASSA-N 449.467 2.040 10 20 IECD Cc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1807994804 BVLUBAICMZCJNO-KUHUBIRLSA-N 439.497 2.286 10 20 IECD Cc1onc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1C 1816720408 QSSBVHPZUWLQPW-LLVKDONJSA-N 429.458 2.094 10 20 IECD COCc1c[nH]c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817846309 QCBUNSPDQUSBNL-MRXNPFEDSA-N 440.460 2.310 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(C2)C3)n[nH]1 1823048215 RHEVQKGLUHMPRS-AGPLRWBTSA-N 433.559 2.062 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)/C=C/c2cccnc2)C1 1842083591 JNWUCRPQXRVBDD-MDZDMXLPSA-N 429.480 2.091 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCOCC4)c(F)c3)ccc21 728141772 HRQINZNAVJNHLH-UHFFFAOYSA-N 426.492 2.300 10 20 IECD CC1(C)COCCN1CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 728396349 FKFUDLKOZIEPLI-UHFFFAOYSA-N 444.498 2.452 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(NC(=O)C4CC4)CC3)cc2F)CC1 730133333 OPBMRYNIUSNTLA-UHFFFAOYSA-N 431.556 2.168 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 735390773 XRIPNMPCVZCLIQ-LJQANCHMSA-N 441.484 2.395 10 20 IECD CSCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 737245305 HLINCTLYVZJOJD-UHFFFAOYSA-N 447.582 2.039 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 752651967 BKOJCIBJXIETQA-UHFFFAOYSA-N 431.558 2.436 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](CC(C)C)N3CCCCC3=O)CC2)cc1 755249382 PGLJRWLPOMRBMU-JOCHJYFZSA-N 430.593 2.361 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@H](c3ccco3)N(C)C)CC2)cc(OC)c1OC 760088390 ICRAGHAPCOSRKQ-QGZVFWFLSA-N 432.521 2.440 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@@H]3CSCCS3)CC2)cc(OC)c1OC 760126720 HXUMKMUWFFSQOD-OAHLLOKOSA-N 427.592 2.393 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](NC(=O)NC3CC3)C2)c([N+](=O)[O-])c1Br 760603021 SVFRQOOWEKZJBE-SECBINFHSA-N 444.242 2.314 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC4CC4)c3)cc2F)C[C@@H](C)O1 762413520 CXHVVSZNCHCCFS-GASCZTMLSA-N 429.496 2.301 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccc2c(c1)S(=O)(=O)CC2 764232974 GLPWCKRRCPMDEJ-UHFFFAOYSA-N 433.505 2.438 10 20 IECD CC(=O)c1ccc(N2CCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)c(F)c1 772773380 CHEFCWNKODDKQE-CLTKARDFSA-N 442.443 2.345 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CC[C@H](C(=O)N(C)C)O1 775456001 ZWHVHNIPYFWOAM-GOEBONIOSA-N 428.327 2.322 10 20 IECD O=C(C1CCCC1)N1CCC[C@@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 781523955 ONXPRQGXKNFSBA-OAQYLSRUSA-N 435.590 2.124 10 20 IECD COc1cc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccc1F 782120426 DHBKIIQELGEWOY-UHFFFAOYSA-N 447.463 2.147 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 782533992 AZTTZLWXGPSAJQ-UHFFFAOYSA-N 446.573 2.367 10 20 IECD Cn1cc(COC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)cn1 785395290 ADEIKDWLTVNDGL-UHFFFAOYSA-N 432.414 2.192 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 786733525 AFBAHAYVURJYBP-KRWDZBQOSA-N 449.577 2.346 10 20 IECD C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786994673 ASPBZLLMLLYPPH-QGZVFWFLSA-N 434.556 2.182 10 20 IECD CCOC(=O)C1CCC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789859610 BOGKHJBJXHTIKQ-UHFFFAOYSA-N 433.574 2.094 10 20 IECD CC(C)C[C@H](CO)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789953344 CFQWALMHPMUXPJ-QGZVFWFLSA-N 445.482 2.024 10 20 IECD C[C@@H]1OCC[C@]1(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 790261389 WVCWOZXBLMSBQJ-BJZQEMJWSA-N 426.585 2.386 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3COc4c(C)cccc4C3)CC2)cc1 794167456 IQYNYPOXPHIXEM-CTDFXDFQSA-N 435.524 2.328 10 20 IECD CCOc1cc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)ccc1[N+](=O)[O-] 796466541 RCVNNPLLBIPXHF-UHFFFAOYSA-N 441.532 2.498 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Br)sc2C)cc1 797431670 VHKZAPVKVXINDA-UHFFFAOYSA-N 440.366 2.496 10 20 IECD COc1ccc(CNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c(O)c1 797636158 UJAHJKVFRFCSEB-UHFFFAOYSA-N 434.880 2.194 10 20 IECD CN(C)c1ccc([C@@H](CNC2CCC3(CC2)NC(=O)NC3=O)NC(=O)OC(C)(C)C)cc1 798270319 NBQJAXUSIHFRJS-BISSLNBESA-N 445.564 2.429 10 20 IECD CNS(=O)(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 799995486 LQYNGRJCGYBWEV-ZBFHGGJFSA-N 428.986 2.409 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 803557197 KLXPSJUGIVIXCQ-NRFANRHFSA-N 439.512 2.217 10 20 IECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NCc1cccc(Br)c1O)C2 807514725 NLLMRIKHORDMDI-GJZGRUSLSA-N 439.354 2.038 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 807671493 PUHWEVPZZGLQPY-DNVCBOLYSA-N 426.492 2.381 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCn2c(Cc3ccccc3)nnc2C1)c1ccc(N(C)C)cc1 807673341 RARMEXZDIWASKW-QGZVFWFLSA-N 432.528 2.155 10 20 IECD CCCN1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770374 LFQMGRFAVJJROH-DLBZAZTESA-N 438.519 2.221 10 20 IECD O=C(CN1CCCN2c3ccccc3C[C@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 810051343 ZUWNRNBDVASUJY-NRFANRHFSA-N 438.547 2.416 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCc3nnn(C)c3C2)NC(=O)OC(C)(C)C)cc1 810448209 WJHCIFLOVCCNID-VQIMIIECSA-N 442.564 2.368 10 20 IECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918138312 JYKREEJLKPWELD-UHFFFAOYSA-N 441.912 2.154 10 20 IECD CCCS(=O)(=O)CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920630438 BKSCVYQVJBKHTP-CYBMUJFWSA-N 443.477 2.157 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCC(NC(=O)C(C)(C)C)CC1 1116844067 RYYIKBFHTGFNLJ-JCYILVPMSA-N 434.533 2.409 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)nc1 1344419273 OKQCTSHGQMUXNI-UHFFFAOYSA-N 445.589 2.393 10 20 IECD CC1=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)CCO1 1790243355 MIWULKTZFSHORV-QITLCBANSA-N 436.892 2.039 10 20 IECD C[C@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)CC1(F)F 1792156855 DWAWKLFBPILXLB-AVGHVZBRSA-N 444.862 2.390 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccncn2)cc1 1796521893 CAIDJMYFCFUSLM-JHDGKUDLSA-N 445.523 2.401 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1C[C@@H]2CC[C@H]1C2 1801733504 PEFVRPLMXSGVEE-DYSFYUKASA-N 435.615 2.311 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(O)cn1)c1cc(O)c(O)c(Cl)c1 1803134899 SQEBSDZIRXVKMW-QDMKHBRRSA-N 431.876 2.346 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1F)CC2)c1cc(O)nc(O)c1 1816729627 WNXIUBMRMFUBOC-JTQLQIEISA-N 444.444 2.334 10 20 IECD CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)COC1 1823706829 VJDHUZVPOJALIU-SNVBAGLBSA-N 437.905 2.470 10 20 IECD CCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426746 DTSYOHGMNKQIQK-QGZVFWFLSA-N 427.505 2.256 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)n(C)c2ccccc12 550171132 FSMVTTDZPBLPFD-OAQYLSRUSA-N 434.540 2.293 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](S(N)(=O)=O)C2)c(C)n1-c1cccc(Br)c1 732663863 CZOXVVJTXRFZTG-OAHLLOKOSA-N 426.336 2.360 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCc3ccccc3C2)cc1OC 732746734 FJOVNHIUBUKPBU-UHFFFAOYSA-N 425.532 2.172 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[S@](=O)Cc3ccccc3)cc2)C1 735108501 UXRDSKXSMBCIQO-QJWGWKRISA-N 442.585 2.136 10 20 IECD C[C@H](c1cccnc1)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 741789341 ZOORJBHXSGLTCL-LJQANCHMSA-N 441.551 2.052 10 20 IECD COc1ccccc1-c1nnc(SCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1N 748357224 AJSDMTUMCUGVOF-UHFFFAOYSA-N 426.546 2.484 10 20 IECD COc1ccc2c(c1)CCN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 760930303 YVWUKFFWWHRFRF-UHFFFAOYSA-N 427.520 2.388 10 20 IECD COc1cc(NC(=O)NCCc2ccc(O)c(O)c2)ccc1S(=O)(=O)N1CCCC1 761650959 VJZPGMWAFIJUTP-UHFFFAOYSA-N 435.502 2.255 10 20 IECD COC(=O)Cc1c(C(=O)OC)sc2nc(/C(Cl)=C/C3=S=CN=C3)nc(O)c12 767722398 QEKDQNIAHSWBQZ-OQFOIZHKSA-N 425.875 2.228 10 20 IECD Cn1cnnc1[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770165451 SOOKNSVBXWTDEZ-CQSZACIVSA-N 433.515 2.360 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1NS(C)(=O)=O 774100098 BLZJEDQUDUQGQY-UHFFFAOYSA-N 430.530 2.222 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781457053 JYWLXPSHPZMOHH-CQSZACIVSA-N 429.448 2.265 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 781535977 NPORAXXXTKUSQS-UHFFFAOYSA-N 429.448 2.217 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] 782778884 UNYZNPPMBXKKNU-UHFFFAOYSA-N 442.472 2.067 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2cn(-c3ccc(F)c(Cl)c3)nn2)c1 783153655 XCJULHJCIGDORO-UHFFFAOYSA-N 440.840 2.494 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C(C)(C)S(C)(=O)=O)c2C)cc1 785994270 VPRTVJSSJDMHBE-UHFFFAOYSA-N 435.498 2.430 10 20 IECD COC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H]1CCCO1 790281212 PAFFHFMTBIAHBN-HOCLYGCPSA-N 426.516 2.178 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCN2CCCC[C@@H]12 790293086 SVCNVBMDBRJUGA-MOPGFXCFSA-N 436.503 2.116 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2c1=O 792960108 SHYWITYYAQZOGJ-LJQANCHMSA-N 435.480 2.390 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](CS(C)(=O)=O)C1 795085452 JIXYBZOXTGUMFU-GJZGRUSLSA-N 440.521 2.156 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(N2CCOCC2)cc1 803299126 ZIQCYAKDPYUERK-GREBRCKQSA-N 440.588 2.176 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(OCC4CC4)nc3)CC2)cc1 803567766 MJRGGVQRHIZXMP-UHFFFAOYSA-N 438.528 2.234 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)n1 803659906 WTBJXLBVIAYJRX-KRWDZBQOSA-N 441.507 2.089 10 20 IECD CCOC(=O)c1sc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)nc1C 807098909 FOJAKVCJLSLQQC-CQSZACIVSA-N 432.546 2.496 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)CS(=O)(=O)c1ccc(C)cc1 807372978 OGHFYINNZUPDKQ-QGZVFWFLSA-N 432.542 2.418 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)c1 817044655 JDZGEESUPDBLQJ-AWEZNQCLSA-N 447.282 2.129 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc1OC 917758246 MWVJNJDJRZAWJW-UHFFFAOYSA-N 433.439 2.305 10 20 IECD CN(C)c1ccc(CNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)cc1 921276148 KMVLWIFROVEDOM-UHFFFAOYSA-N 425.601 2.482 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1c2ccccc2CCN1C(C)=O 1320394076 NMXASWMJKBEFQW-PMACEKPBSA-N 440.496 2.224 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H]2[C@H]4COC[C@H]42)CCO3)cc1 1781755685 OZRLGFPPEFCNHK-QTZVNIFKSA-N 449.551 2.430 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787293894 UTCVRKZSONJKLZ-FEDSJOOMSA-N 441.484 2.091 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1797258133 VWLREXMFLRZDQR-FAMUGIINSA-N 443.544 2.303 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ncccn2)C3)cc1 1799619988 FSLPEGFQCZXZGO-VTYHHJSWSA-N 445.523 2.401 10 20 IECD CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)no1 1799770727 ARFBSWGWXRIUJP-IVWMJMPLSA-N 449.891 2.380 10 20 IECD Cc1cc(CCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1841946482 SSOGOXFLNWCJHO-VMPITWQZSA-N 437.496 2.356 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2)C1 1842714622 GJLWVNQMHBXMDC-UHFFFAOYSA-N 434.471 2.365 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2nccc3[nH]ccc23)C1 1843278076 OEVLXCQUVNAPCP-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CCc1ncsc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442717 WBNWOBQTXGIBDM-UHFFFAOYSA-N 437.525 2.315 10 20 IECD Cc1c(CNC(=O)C(=O)NCCc2ccc(OCCN(C)C)cc2)n(C)c2ccccc12 553194482 BFIXGCPVMDVFQP-UHFFFAOYSA-N 436.556 2.402 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)CC2)cc1 726561461 YVRBEKJZBKRZJK-UHFFFAOYSA-N 435.521 2.483 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)s3)cc2F)C[C@H](C)O1 729324896 KTEHDTHDPLCTDC-RYUDHWBXSA-N 427.523 2.078 10 20 IECD C[C@@H](OC(=O)C1(C(=O)NC2CC2)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729714023 ZGPYOKLWQJGJGE-CYBMUJFWSA-N 446.459 2.391 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NCCCSc2nccs2)C1 733973808 XJBZFXFYMAYFDI-AWEZNQCLSA-N 443.620 2.182 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)CC2)cc1 742917552 ZQGHBPXFAXPFIX-QFIPXVFZSA-N 440.519 2.126 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1 746497410 NFXYRFBJXKLNNV-UHFFFAOYSA-N 447.557 2.051 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(CCO)[C@H]3CCc4ccccc43)CC2)cc1 754049309 CRUKFCSLBWFPET-DHLKQENFSA-N 425.573 2.160 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1C 754641361 BIXGJLCYADXADR-FQEVSTJZSA-N 429.586 2.390 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNCc3cc(Cl)c4c(c3)OCCO4)CC2)cc1 758209709 KEDRVXNICLTICT-IBGZPJMESA-N 447.963 2.393 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1 758296595 BKQFQKGMOXKOSF-SFHVURJKSA-N 430.486 2.387 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(OCCF)c1 760092135 LGQJQBLCTQVOEC-UHFFFAOYSA-N 433.455 2.390 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)CC3CC3)cc2F)C[C@H](C)O1 765680745 ZCQCMMBFKIGTFQ-GJZGRUSLSA-N 427.542 2.063 10 20 IECD COc1cc(Br)cc(CN2CCN([C@H](C)C(=O)N3CCCC3)CC2)c1O 769542336 GLHUFSPXTCAIRY-CQSZACIVSA-N 426.355 2.292 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(S(C)(=O)=O)c(F)c3)c2)CC1 769849560 VQNLOFAIWMXTGA-UHFFFAOYSA-N 441.550 2.172 10 20 IECD Cc1nnc(-c2cccc(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)n1C 772904641 NTXYRCMZRFMKHZ-UHFFFAOYSA-N 438.507 2.495 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2nccn2c1 774357045 SMIWOEWSUHTPPV-UHFFFAOYSA-N 432.528 2.121 10 20 IECD O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)N(Cc1ccco1)Cc1ccccc1O 776072634 AIRYQNCDPDIJRV-UWJYYQICSA-N 434.514 2.433 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779221551 JTWSGPOEUWEKFG-XJUOHMSHSA-N 446.636 2.195 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](O)[C@@H]3C(=O)OC)c2C)cc1 781956826 BAYDMNFWVCJMHZ-PZJWPPBQSA-N 428.485 2.062 10 20 IECD CC(C)(CO)CCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 787040405 NVXVGZDLVNGMLU-UHFFFAOYSA-N 427.492 2.288 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3nnn(CC4CCCC4)c3C)CC2)cc1 789180700 BKQQGEJMTNYMFQ-UHFFFAOYSA-N 441.532 2.291 10 20 IECD CC(C)(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789840821 NRXJQCOQOJXHKP-UHFFFAOYSA-N 448.564 2.473 10 20 IECD CCC[C@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842230 CBWLTQKFEUHIGW-HSZRJFAPSA-N 435.540 2.211 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c(O)c1 797390283 SUJGMOUKVKARDN-UHFFFAOYSA-N 438.528 2.188 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(F)c2I)c(O)c1 797390544 IVWKHEAQSSCEQR-UHFFFAOYSA-N 444.200 2.399 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2O[C@@H](C)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 800302771 BMXVHBSHCRSHDJ-TVSHIAKJSA-N 434.514 2.281 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 804008570 MNUAZIJJPAMNIJ-QFIPXVFZSA-N 436.556 2.409 10 20 IECD COCCN(CCOC)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 804990604 ZFYTWOJZMUJCOY-FQEVSTJZSA-N 448.608 2.353 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1 811866390 KYRYDEVCFQSJIJ-INIZCTEOSA-N 428.455 2.123 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)sc1C(C)=O 815527254 WOXKOTHXTHELTI-UHFFFAOYSA-N 445.497 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)NC(C)C)ccc3F)CC2)cc1 914711161 REELSOMMZKFLIJ-UHFFFAOYSA-N 435.521 2.483 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 918310541 MDJQMLKZANNDTA-UHFFFAOYSA-N 433.411 2.442 10 20 IECD CC(C)c1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n[nH]1 1780295977 CMGATYTURJXHFW-OAQYLSRUSA-N 448.907 2.355 10 20 IECD CC(C)C1(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CCC1 1784864038 GOZAWBUKARWINH-BVBLWJPBSA-N 444.528 2.473 10 20 IECD CCc1[nH]nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1F 1804284027 YHLHHEKHALPLEU-IRRWCRNKSA-N 444.463 2.193 10 20 IECD CC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811797953 XNWHCMSWQFTGTD-QANKJYHBSA-N 433.892 2.237 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1 1814166647 RVYFWEOHGZGWOZ-DAONXPHYSA-N 441.459 2.276 10 20 IECD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)ccc1F 1816720928 CPERCAXRHFUOCH-NSHDSACASA-N 443.460 2.331 10 20 IECD O=C(CCc1ccco1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721259 IGPHKYSUZKOMCD-LBPRGKRZSA-N 428.470 2.401 10 20 IECD O=C1Cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)c(O)c(Cl)c4)C3)c2N1 1845502081 MHGSGFLTLOWISC-UHFFFAOYSA-N 441.871 2.377 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846640345 WYXOWKORHGOYQL-QGZVFWFLSA-N 434.496 2.455 10 20 IECD CC[C@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)N(CC)CC 1847034857 PLVODZIKYPKMLP-QXLXQBSBSA-N 431.533 2.140 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCCC12CN(C(=O)C(Cl)(Cl)Cl)C2 1847039333 HLZROVLKBYHXDM-HWKANZROSA-N 435.691 2.390 10 20 IECD O=C(Cc1ccc(Cl)s1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056917 UQCDHSLTRQXPMD-UHFFFAOYSA-N 444.003 2.008 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCNS(=O)(=O)/C=C/c1ccccc1 16134584 RGGSXSQYCJQFOU-LDADJPATSA-N 443.569 2.462 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(Br)s2)SC1=S 727177626 MITRXWSWQIYYCV-VURMDHGXSA-N 427.392 2.261 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3csc(-c4cnccn4)n3)CC2)cc1 728383775 BDYJCFXHCKXGIK-UHFFFAOYSA-N 439.497 2.114 10 20 IECD Cc1cccc(NC(=O)N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 728606023 MNAMNQZQBAIRCC-UHFFFAOYSA-N 432.502 2.062 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(N4CCCC4=O)CC3)cc2F)C[C@@H](C)O1 729481904 ILUVEQWRWRLVPO-QZTJIDSGSA-N 446.567 2.142 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)cc1 737078944 JKYXIXOLGQUMMV-FQEVSTJZSA-N 439.516 2.308 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl 743050233 YQLBGBBBQRTSIO-UHFFFAOYSA-N 430.935 2.397 10 20 IECD Cc1cc(C(=O)CN2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 750058332 YCYNOKHEKWJGDU-UHFFFAOYSA-N 449.511 2.130 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1[N+](=O)[O-] 751227030 AJKORGDGGNZJAV-UHFFFAOYSA-N 439.465 2.182 10 20 IECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 753457002 KSPLEYZFJPDNJL-JCOAXYOVSA-N 445.589 2.396 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccccc3S(C)(=O)=O)CC2)cc1F 753856633 DHQPLRNAZWQYCJ-HNNXBMFYSA-N 435.521 2.387 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3ccc(N4CCCC4=O)cc3)CC2)cc1F 753861798 VKVIVUFXTRRCED-UHFFFAOYSA-N 440.519 2.400 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](c3nc(C4CC4)no3)C(C)C)CC2)cc1 754181625 DXGFRBJVRUQKJN-PZJWPPBQSA-N 429.565 2.425 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](C)NC(=O)OC(C)(C)C 756812796 ODJOPAGDMQFAER-JKSUJKDBSA-N 439.578 2.087 10 20 IECD COc1cc(N2CCN(C(=O)c3nc(-c4cnn(C)c4)oc3C)CC2)cc(OC)c1OC 759241928 KDHUZFXZVNVFQM-UHFFFAOYSA-N 441.488 2.372 10 20 IECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 761065705 PMSLTQNWUHHXJR-UHFFFAOYSA-N 434.489 2.459 10 20 IECD C[C@@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763902010 SHSXJVQLJQKQSV-HUUCEWRRSA-N 440.521 2.156 10 20 IECD C[C@]1(c2ccc(CNC(=O)NCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 765483865 XXHXHMQQSLHANS-LJQANCHMSA-N 447.289 2.209 10 20 IECD CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)cc1)C2=O 768561767 FYNNPFWAVPZYRZ-HSZRJFAPSA-N 428.533 2.030 10 20 IECD Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cccc1C(=O)N1CCOCC1 773860061 YIEAIFDBINLJIQ-QGZVFWFLSA-N 438.528 2.349 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)c1O 774889896 WILPLVLTGDIKCE-LJQANCHMSA-N 426.473 2.232 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCc2nnc(O)cc2C1 775778105 VPJOTTILRCJAAF-ZDUSSCGKSA-N 428.448 2.343 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1 783317686 YSAOVBNIKVANGP-UHFFFAOYSA-N 436.516 2.013 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](C4(C)OCCO4)C3)CC2)cc1 784252764 WDROBVNPTGRIKB-IBGZPJMESA-N 432.565 2.002 10 20 IECD CN(C)CCc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 786223144 AZYMQMUJMKFXPL-QFIPXVFZSA-N 437.588 2.492 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC([C@@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 789824551 IUPSUGPYDAUNEL-YVHKJVDXSA-N 447.551 2.473 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC[C@@H]1c1ccccc1 789845745 LGMFRGLTVNSKES-OAQYLSRUSA-N 425.554 2.456 10 20 IECD C[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860575 LYZZQSULZIRHOC-SFHVURJKSA-N 427.570 2.266 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 789948470 BCNUWDYDOOZPRW-PBHICJAKSA-N 443.466 2.184 10 20 IECD CC[C@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716669 DSRSZTJJLLHTMH-VXKWHMMOSA-N 448.567 2.368 10 20 IECD CO[C@H](C)c1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 803305738 OKEZMCDFCZVQPF-LSDHHAIUSA-N 432.546 2.181 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)cc1F 804851430 BXDCQDFGYFFDTK-GHTZIAJQSA-N 445.539 2.136 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCC[C@H]3CCCCO3)cc2F)CC1 805007409 LCSPTQJWDAFMJA-LJQANCHMSA-N 434.556 2.049 10 20 IECD CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806282917 YJSQJTOBGPQPOC-CYBMUJFWSA-N 428.580 2.115 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 808346715 LOBSSDCGMOFBIV-IRLDBZIGSA-N 431.577 2.405 10 20 IECD O=C(CN1CCOCC1)N1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809543731 WCWJGCJYUVZYLY-UHFFFAOYSA-N 434.584 2.226 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(OC)c(C)c(OC)c3)CC2)cc1F 815539922 DNTULBQLVQTOQW-UHFFFAOYSA-N 431.464 2.447 10 20 IECD CS(=O)(=O)NC1(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCCCC1 916253734 JAPHDKGDYFNZEC-GOSISDBHSA-N 439.578 2.335 10 20 IECD COCC(=O)NC1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 917119921 KPYCAJJQTGXFAL-OAHLLOKOSA-N 449.507 2.016 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 917207604 CRRAKGLBZHWTNW-UHFFFAOYSA-N 446.573 2.110 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CSCC(=O)N2CCOCC2)cc1 918710337 ZNPGPLRLQNJWQA-UHFFFAOYSA-N 431.558 2.466 10 20 IECD O=C1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2N1 1319408469 GMSADGMCBOZQLD-UHFFFAOYSA-N 433.505 2.150 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2)CC1 1320667864 YTOVKZZMBOBCNN-HXUWFJFHSA-N 449.555 2.309 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)Cn4ccnc4)CCO3)C2)cc1 1781750332 BPTDDMSCKNJVNH-VWLOTQADSA-N 447.539 2.434 10 20 IECD Cc1occc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1786018316 FMBCDQUVTMYYNM-CASRODDKSA-N 442.468 2.012 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cnccn3)CCC2)cc1 1792313856 BZFGODQSJAMZHV-UHFFFAOYSA-N 441.538 2.085 10 20 IECD CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c2ccccc21 1796482112 PZUUFKOLGWZYBU-MUJYYYPQSA-N 435.484 2.428 10 20 IECD O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601034 WDSJEGVZGZJJCZ-REPLKXPHSA-N 437.496 2.312 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)ccn1 1796934851 VDMCSHUBMJSIRE-FNLKRUPLSA-N 431.496 2.435 10 20 IECD COc1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1800715339 LOYKBEJTJXRNNQ-CLLJXQQHSA-N 432.864 2.115 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1CCC(CO)CC1 1804284022 XXMHPEDFBZQYQA-DSHMIGQCSA-N 444.528 2.254 10 20 IECD Cc1ccn(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804288846 LROWGNDRPKEYJE-BJKLQHCMSA-N 425.485 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H](F)c1ccccc1 1804330610 AHAUOIBDVXBUBD-KRXQYRFLSA-N 435.546 2.196 10 20 IECD O=C1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)N1 1821293467 LWWSHJXJWHIJHW-TZMCWYRMSA-N 447.879 2.059 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823479291 FWKJVOSYXZGGLB-PSZCTONISA-N 430.461 2.267 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C1=S=C(NC(=O)c2ccco2)C=C1C 505146503 UJKQXYKWEHMSCR-OAHLLOKOSA-N 446.550 2.374 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nncn3-c3ccc(OC)nc3)CC2)cc1 728788576 QFEZCUGDGKBWAH-UHFFFAOYSA-N 440.529 2.120 10 20 IECD CCN(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 729233751 PTCJCRQUMOEXDE-SFHVURJKSA-N 447.580 2.445 10 20 IECD CCN(CC)c1ccc(CNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1F 731347323 SQVPTHXXEGRDNN-UHFFFAOYSA-N 428.420 2.493 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)c3cnn(-c4ccccc4)c3)cc2)C1 733758656 NZEHLTRZPYXDKE-GOSISDBHSA-N 431.496 2.073 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1 734017456 IVIIIOAMQVXMOE-GASCZTMLSA-N 434.514 2.129 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)CCC(=O)N2CCOCC2)NC(=O)OC(C)(C)C)cc1 742748990 CCFXZMIBCGJTTA-IBGZPJMESA-N 448.564 2.074 10 20 IECD O=C(Cn1nnc2ccccc2c1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742802346 XFEXAIGJIAXPKC-AWEZNQCLSA-N 429.427 2.178 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(Cl)c(C(N)=O)c3)CC2)cc1 742928365 PCFYKDDPYHXCFC-UHFFFAOYSA-N 431.924 2.391 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1 746330059 MNDUFWLTRLUEHO-UHFFFAOYSA-N 446.460 2.288 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3c(C)nc(C(C)(C)C)nc3O)CC2)cc1 747370949 UCJMDJWEYRQJTN-UHFFFAOYSA-N 427.549 2.349 10 20 IECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2O)CC1 748355186 VDSMKGMKQPPAEX-UHFFFAOYSA-N 433.486 2.326 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3=NN(c4ccccc4)[C@H](C(C)=O)C3)CC2)cc1 751386979 YDTOKKOITDSEJN-DEOSSOPVSA-N 449.555 2.157 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(CNS(C)(=O)=O)o2)cc1 753597827 CQEBISYJKJZVJA-IBGZPJMESA-N 435.546 2.216 10 20 IECD COCCCn1c(S)nc2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc2c1=O 753642361 BWVVSHOZIJQDPK-CYBMUJFWSA-N 443.525 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)N3C[C@H]4CCCN4c4ccccc43)CC2)cc1F 754215897 QJPSBKVKPGDJSI-GOSISDBHSA-N 438.503 2.499 10 20 IECD CNC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 754336680 BQRYPFAKEPLCPI-WYMLVPIESA-N 438.600 2.213 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H](C)C(=O)N3CCCC[C@H]3C)CC2)cc(OC)c1OC 759258083 LVTAVYVJRJCBDC-IAGOWNOFSA-N 448.564 2.334 10 20 IECD COCCNS(=O)(=O)c1c[nH]c(C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 764324633 VFDKORJFGXPKOO-UHFFFAOYSA-N 433.486 2.081 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 768522396 MTJQKKWRLRLBFH-GCJKJVERSA-N 434.606 2.171 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc5n[nH]c(C)c5c4)n3)CC2)cc1 771056378 MJWCULDWQFDQJU-UHFFFAOYSA-N 433.472 2.216 10 20 IECD C[C@@H](NCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc(N2CCOCC2)cc1 775258539 DGXOTDKYFGJBLE-XMSQKQJNSA-N 449.617 2.132 10 20 IECD COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778417918 CQWVAVONNWBNGM-BHCKVDLLSA-N 443.544 2.138 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccccc1S(=O)(=O)N(C)C 780689759 SLMVAUFCCJPYIW-UHFFFAOYSA-N 425.576 2.214 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1-n1nnnc1C(C)C 785293619 HDRXRMJHMLXPFH-CQSZACIVSA-N 438.488 2.191 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)cc1 785443183 NDEOZAVPZSOXRV-UHFFFAOYSA-N 430.593 2.299 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCOCC2)c1 787613495 OUQUGJZBSZHJBY-QFIPXVFZSA-N 442.535 2.006 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1cn2c(n1)CCCC2 788853097 HEGGUEPLXJIWCM-UHFFFAOYSA-N 449.349 2.395 10 20 IECD CCOC(=O)c1sc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)nc1C 788940578 XQLZPWQPRQEUKX-UHFFFAOYSA-N 430.530 2.161 10 20 IECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799656 OCDIZHAYYKXDDF-LJQANCHMSA-N 434.556 2.049 10 20 IECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H]1n1ccnc1 789855920 LMVSBCJAAIWBDZ-XLIONFOSSA-N 427.574 2.162 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC[C@H]1CCSC1 789954723 LARVUTCZYGLNIM-CYBMUJFWSA-N 431.480 2.028 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(NC(C)=O)c3ccccc23)ccc1O 790405751 LYGMFPSVXMTIFF-UHFFFAOYSA-N 449.510 2.213 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCN(Cc4ccccc4)C3=O)cc2)CC1 804004463 LZGNPNPDMOIXLN-HSZRJFAPSA-N 448.567 2.456 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1F 806878043 GJFBPJWUKPHGGM-UHFFFAOYSA-N 436.434 2.261 10 20 IECD CN(C[C@@H]1CCCOC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769008 CUQFPJDNSVKISO-JKSUJKDBSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CC(F)(F)Br)CC2)cc1 813765939 ORLJRYDKVIJPQE-BQYQJAHWSA-N 446.292 2.346 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(=O)n(-c2ccc(F)cc2)n1 919969374 KHARYKMLJXBICT-UHFFFAOYSA-N 440.450 2.402 10 20 IECD CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1116450291 YRPYIDFMHHGXFQ-GOSISDBHSA-N 446.571 2.376 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1254279375 JFQBWZCYEWAWHY-DVQDXYAYSA-N 431.533 2.137 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1793827649 RLUMQDXXNJVLST-BEVBHUTCSA-N 446.500 2.187 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc[nH]c2c1 1797338084 TUKCDLLDSGAGPV-MUJYYYPQSA-N 442.566 2.280 10 20 IECD Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1805767243 VGYOFXYDMODGPT-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccncc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995594 GYKDENBOIWPWNC-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)N1 1817088317 BUCCZLJUJNVUCM-TZMCWYRMSA-N 447.879 2.059 10 20 IECD CO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717571 NHAYURQYPNCLLL-LAUBAEHRSA-N 440.544 2.434 10 20 IECD O=C(c1scnc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249626 FWVDEKAUKAQOGH-UHFFFAOYSA-N 428.392 2.099 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502039 HXNQYPUEMOPLAO-LLVKDONJSA-N 426.853 2.130 10 20 IECD C/C=C/C(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1845962231 USENUIMVCWAHLL-WSSFADSRSA-N 442.560 2.484 10 20 IECD O=C(c1cccc(F)c1Cl)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054253 ALXJLXKOIDITKQ-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CCCc1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056138 ULIYZFIMRWEGOB-UHFFFAOYSA-N 431.583 2.316 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 195641093 ACZOWYQLCKBBSK-GOSISDBHSA-N 432.540 2.331 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H]3C[C@@]3(C)NC(=O)NC3=O)ccc21 561238747 WNYPBKFTCAWMNB-GAJHUEQPSA-N 426.517 2.497 10 20 IECD COCCOc1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726726726 VQGJANHXRNEEQX-UHFFFAOYSA-N 427.501 2.444 10 20 IECD COc1ccc(C2(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCOCC2)cc1 731455744 NXZCKSFABZFEMK-UHFFFAOYSA-N 434.514 2.251 10 20 IECD CN(CC(=O)N1CCN(c2ccc(F)cc2)CC1)Cc1ccc(N2CCOCC2)cc1 741732905 AHHWRBHMSQOYCZ-UHFFFAOYSA-N 426.536 2.443 10 20 IECD Cc1cc(NC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)no1 742750033 LQCJOBNYOIZFGR-INIZCTEOSA-N 431.493 2.370 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(-n4cccn4)cc3)cs2)cn1 743047546 ZMQHEYWAXZLEMX-UHFFFAOYSA-N 444.498 2.166 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCCc4ccc(F)cc43)CC2)cc1 743432192 IIEYONGQULHKCM-UHFFFAOYSA-N 440.519 2.052 10 20 IECD Cc1ccc(CNC(=O)NCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 749408039 ZINLANJTRWHVJV-UHFFFAOYSA-N 428.508 2.211 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 749630053 ZJLKHAHXRSFWOJ-UHFFFAOYSA-N 444.557 2.230 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CNC(=O)OC(C)(C)C 749872921 XSRJRJLLEYCQOV-FUHWJXTLSA-N 447.580 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3COc4cc(F)cc(F)c43)CC2)cc1 753304798 WELUNBXHKAPDEI-RURPWVQCSA-N 443.450 2.428 10 20 IECD COc1ccc(N2CCN(C(=O)NCCS(=O)(=O)Cc3ccccc3)CC2)cc1F 753882540 DTNCICNFPAUBDX-UHFFFAOYSA-N 435.521 2.281 10 20 IECD C[C@H](NC(=O)NCc1ccc2c(c1)CCS2(=O)=O)c1ccc(N2CCOCC2)cc1 757652732 TUKUNGQTGQBECX-INIZCTEOSA-N 429.542 2.413 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765925614 JATSTWMENSESER-UHFFFAOYSA-N 436.262 2.266 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1 768145199 OESMWKLHGVYMPI-OAHLLOKOSA-N 442.516 2.415 10 20 IECD COc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC 774673862 ZMKLHZVJKVQLAL-GOSISDBHSA-N 428.485 2.233 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CC[C@H](C(=O)N(C)C)O1 775455999 ZWHVHNIPYFWOAM-GDBMZVCRSA-N 428.327 2.322 10 20 IECD CCCN(C)C[C@@H]1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295642 RTGYRLKPPVLNHU-QJRAZLAKSA-N 428.577 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H]3c3cn(C)nc3C)CC2)cc1 778326313 NGBRFNGIIWKPIE-YRBAHSOBSA-N 437.544 2.306 10 20 IECD CCN(CC)C(=O)c1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 787181564 BHKGZZMPHWAWCM-UHFFFAOYSA-N 436.556 2.484 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788931485 GZRRJAVYMCSMQI-IEBWSBKVSA-N 430.549 2.276 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@H](N(C)C)C3)cc2F)C[C@@H](C)O1 789823703 FDYBNLHZGKLTIV-JFRXWTBNSA-N 434.556 2.045 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOc2cccc(F)c2C1 789856262 RJXBYUZJTHXWJZ-UHFFFAOYSA-N 429.517 2.416 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(N(C)C)cc1 803136193 YYQXOPXJKVXZBH-IERDGZPVSA-N 438.528 2.364 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 804344328 GVBJANJUVDZZCV-UHFFFAOYSA-N 446.551 2.408 10 20 IECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 805135336 KAIMJMCAOLNXSY-UHFFFAOYSA-N 439.342 2.428 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CNS(=O)(=O)c1c(C)noc1C 810456265 KZMQIOSKEPGQRY-UHFFFAOYSA-N 446.323 2.087 10 20 IECD CC(C)COC[C@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916514696 ZIDJJVMUXQBIDT-QGZVFWFLSA-N 433.471 2.375 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4nccs4)CC3)cc2F)C[C@H](C)O1 917026897 RTGUGUYGEUXRNJ-IRXDYDNUSA-N 447.580 2.334 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 918309460 ZYQPNIOUKJAUII-UHFFFAOYSA-N 449.555 2.210 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc(C(C)=O)ccc3OC)nc12 918887520 SWILOIQCGYKJSO-UHFFFAOYSA-N 427.413 2.109 10 20 IECD COc1ccccc1NC(=O)C1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 919813111 WAIAERZGHZHFMV-UHFFFAOYSA-N 447.513 2.263 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c[nH]n2c1nc(=O)c1ccccc12 919970384 YSNWJTQWFNUAHM-UHFFFAOYSA-N 431.496 2.315 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2ccc(F)cc2C)cc1O 1325763016 LVXFTSZKBLOJSC-HNNXBMFYSA-N 443.431 2.341 10 20 IECD CC(C)n1nccc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779604273 CMHCFNYVDWFXMB-OAQYLSRUSA-N 448.907 2.286 10 20 IECD CCCNC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793465213 OWSGWZPRHFSVBB-QDMKHBRRSA-N 437.924 2.309 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ccc(Cl)cc2n1)c1cc(O)nc(O)c1 1797661883 UZAQQXSFYJJHEK-QDMKHBRRSA-N 441.875 2.360 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccnn2)cc1 1798057702 CEVRHFQIIGWALL-JHDGKUDLSA-N 445.523 2.401 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(C3CC3)on2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992160 LKDINFSSUWQLDJ-BTYIYWSLSA-N 449.467 2.387 10 20 IECD CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CCS(=O)(=O)C1 26657162 UCJCLAMIJOFTTQ-HNNXBMFYSA-N 440.521 2.300 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 727602866 VOOWTSAEFIURFW-KRWDZBQOSA-N 446.573 2.334 10 20 IECD NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741097373 PCMDLLVGLNVVJL-UHFFFAOYSA-N 447.539 2.019 10 20 IECD CN1CCCc2cc(CNC(=O)[C@H]3CN(Cc4nc(O)c5ccccc5n4)CCO3)ccc21 746182618 PWOXXEZZPVWBGU-JOCHJYFZSA-N 447.539 2.235 10 20 IECD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 748298193 SBSVBWKJXXJKRD-GAJHUEQPSA-N 448.539 2.354 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(NC(N)=O)cc1 749343750 HDFIAVKJBHTGPU-QAPCUYQASA-N 438.532 2.439 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)ccc1Br 751191236 VSOATNUBCPFFBZ-UHFFFAOYSA-N 430.232 2.440 10 20 IECD COC(=O)[C@@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 752301019 DSBVANVSUONHGK-QHCPKHFHSA-N 441.503 2.051 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(CS(C)(=O)=O)cc3)CC2)cc1F 753844192 BVOHKNVDZOJUCJ-UHFFFAOYSA-N 435.521 2.411 10 20 IECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C[C@@H]1C 754504745 AEXLZBVNOVXPIE-AWEZNQCLSA-N 448.501 2.267 10 20 IECD Cc1ccc(C(=O)OCC(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)c(O)c1O 761133165 WHEMZSBCKVAFBP-UHFFFAOYSA-N 427.392 2.194 10 20 IECD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NCCc3ccc(O)c(O)c3)cc(C3CC3)nc21 767779754 SDRQBPOYUJERRC-UHFFFAOYSA-N 438.484 2.414 10 20 IECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c1O 769499360 WWXONNSGGWXPHP-UHFFFAOYSA-N 446.525 2.321 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1 769938638 ZMANKNLRVGZCKV-QGZVFWFLSA-N 431.514 2.188 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnn(CC(F)F)c3)cc2F)C[C@@H](C)O1 777899443 YLDHFCFHBLBENJ-BETUJISGSA-N 432.468 2.379 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn([C@@H](C)C4CC4)c3)cc2F)CC1 778606423 MYJKDFMVFBUPEK-INIZCTEOSA-N 442.539 2.390 10 20 IECD O=C(NCCCN1CCc2ccccc21)C(=O)NCc1ccc(N2CCSCC2)cc1 787684541 BHDGVYPXBRJHGW-UHFFFAOYSA-N 438.597 2.425 10 20 IECD Cc1cccc(C)c1OC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797700 DASBYGJWPZJITK-SFHVURJKSA-N 443.519 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCOc3ccccc3OC)CC2)cc1 791052978 QMVJRZBNKHOIRC-UHFFFAOYSA-N 428.485 2.365 10 20 IECD CC[C@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 792210619 OOCDLHYVSDTTCR-YJBOKZPZSA-N 440.548 2.119 10 20 IECD CCCN(CCC)C(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793830761 RUVVQRSSCOISHW-UHFFFAOYSA-N 442.539 2.207 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c(cc2C)OCO3)cc1OC 794862689 CFIJXZCIRFHUJM-UHFFFAOYSA-N 428.488 2.295 10 20 IECD Cc1cc(-c2nnc(N3CCN(C(=O)C(=O)NC(C)C)CC3)n2C)c(C)n1-c1ccccc1 800766981 YHTZAQWPNYIPRY-UHFFFAOYSA-N 449.559 2.063 10 20 IECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)c1 807671970 VRSWMLXAGGLNFX-FUHWJXTLSA-N 440.544 2.342 10 20 IECD C[C@@H](c1ccccn1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854212 TTXMYIVRDMFFOY-IBGZPJMESA-N 435.572 2.449 10 20 IECD O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC(CO)CC2)cc1 918229658 MVBPHIXUKZZNKC-UHFFFAOYSA-N 431.558 2.168 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(S(C)(=O)=O)ccc3C)CC2)cc1 918461773 LGGQIECNLUSBMV-UHFFFAOYSA-N 445.541 2.085 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4cccs4)n3)cc2F)C[C@@H](C)O1 918700124 ZIJLNOKRVSFQAD-ZIAGYGMSSA-N 430.509 2.471 10 20 IECD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 918744806 PYRGIJWNMIZOMG-ZDUSSCGKSA-N 441.550 2.399 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 1319612051 TWPRPMBUTKJZBC-UHFFFAOYSA-N 446.573 2.110 10 20 IECD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1783237954 SFEISUVJDYKYEP-LSRZYVKLSA-N 439.512 2.424 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H]3CCCOC3)cc2)CCC1 1792300013 STLRXYHCKJSBFV-AWEZNQCLSA-N 447.582 2.407 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cnsn3)CCC2)cc1 1792314064 OORSDMSQJPDWLU-UHFFFAOYSA-N 447.567 2.146 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1807994298 GJYMPASCKKRXQB-ARKKOZOFSA-N 449.467 2.217 10 20 IECD CN1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1813605582 CNHROUWWAKXXHS-IFXJQAMLSA-N 444.919 2.027 10 20 IECD O=C(CC(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817105886 QPITZPBSBMFKEJ-SNVBAGLBSA-N 449.480 2.215 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3ccnc23)[nH]n1)c1cc(O)nc(O)c1 1817846258 OAZPKJMBONQVOI-INIZCTEOSA-N 447.455 2.483 10 20 IECD CCN(CC)C[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1824582071 RWVLWUJIVQHQSN-JSGCOSHPSA-N 447.561 2.153 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1)c1cc(O)c(O)c(Cl)c1 1827386140 FYUJYFHKZHCBAN-ZSYFIWHWSA-N 449.916 2.326 10 20 IECD O=C(COCc1ccccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442010 LVCVAUZATWZPOF-UHFFFAOYSA-N 446.507 2.200 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1F 1847034304 HMBIJISNKICDSZ-VMPITWQZSA-N 442.443 2.482 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 109883648 GJUFLADQECBOHN-UHFFFAOYSA-N 432.542 2.468 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)Cn4c(cc5ccccc54)C3=O)CC2)cc1 726562236 GTIMPCZMXVXBTI-UHFFFAOYSA-N 446.507 2.418 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1C 728015241 MZKFIVIMPJBLFJ-UHFFFAOYSA-N 428.488 2.264 10 20 IECD O=C(Cc1coc(-c2cccs2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 729967489 RJASORKZVBHWDO-UHFFFAOYSA-N 431.539 2.497 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4c(nc3O)CCCC4)CC2)cc1 731737467 JGMAYSXVUUAOKH-UHFFFAOYSA-N 425.485 2.180 10 20 IECD C[C@@H](NC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 748232437 WCIQJQAYSOWANE-MRXNPFEDSA-N 441.488 2.108 10 20 IECD C[C@H]1COCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 754512754 SBZYATCOPNHBMC-CYBMUJFWSA-N 435.458 2.210 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765132308 BWSLCWKYHOUQNX-NSHDSACASA-N 447.485 2.478 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCOC2(CCC2)C1 765664303 DSDYXORYIBGXTO-UHFFFAOYSA-N 440.523 2.407 10 20 IECD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 765719081 PLYWIZXIILJWDO-IBGZPJMESA-N 437.512 2.039 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(OCC(F)(F)F)nc1 777970823 GPPUNDCOMGNSBV-UHFFFAOYSA-N 449.426 2.477 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](O)C2CCCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782362185 NILGSKOOOYXGSV-OAQYLSRUSA-N 448.541 2.409 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(C(N)=O)ccc1F 785193283 WJIQYCYRKOSOGG-UHFFFAOYSA-N 438.253 2.380 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)CC3CCCCC3)cc2)CC1 787318052 BWFGPRZRYWCIAL-GOSISDBHSA-N 428.577 2.446 10 20 IECD COc1ccc(CCCN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788321542 XBAIPZPHXDBGFK-UHFFFAOYSA-N 425.529 2.239 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(Cc3cccs3)C3CC3)cc2)C1 793733082 KPVFPNYVTDSVQX-KRWDZBQOSA-N 440.569 2.257 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCc4c(O)cccc43)cc2F)CC1 804401331 UBYMFWYFCUVPRE-HXUWFJFHSA-N 440.519 2.093 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(N2CCCC2)CCOCC1 804737742 PFUHSTYEPNOGLU-UHFFFAOYSA-N 430.593 2.251 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCOC[C@@H]3CCOC3)cc2Cl)C1 804931904 VQCKCXRLTPDDSI-SJLPKXTDSA-N 437.968 2.362 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 808609934 JCPXUYCBRGQTQB-LJQANCHMSA-N 446.910 2.391 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(Cc4ccsc4)CC3)CC2)cc1 916233834 NWFWVWRFXSSHML-UHFFFAOYSA-N 443.617 2.406 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3cc(C)nn3[C@@H]3CCS(=O)(=O)C3)CC2)cc1 918029770 RWUNREYCUIFTDV-GOSISDBHSA-N 447.561 2.304 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCC1(N2CCOCC2)CCCCC1 918182713 VZLWJCOOZXHUJH-UHFFFAOYSA-N 434.556 2.497 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1NC(C)=O 918441325 ZGYQNBYPLBIZJJ-UHFFFAOYSA-N 442.541 2.462 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3ccoc3Cl)C2)C1 1780459404 KEIPMIDXBUJNIX-XAFBZQIESA-N 448.859 2.207 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H]2C=CCN2)CCO3)cc1 1781754035 QHYPPANHCAFKAF-DHLKQENFSA-N 434.540 2.066 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3)C[C@@H]21 1792218208 LYXSTIQRSJJCBC-RLTIEFLZSA-N 438.480 2.110 10 20 IECD Cc1nc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769230 UODWAGJLJXCRQZ-IVWMJMPLSA-N 449.866 2.111 10 20 IECD CC[S@@](=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800717977 DZYBPLIWPQTHEK-KTJAZULCSA-N 428.938 2.162 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](CNC(=O)C(O)O)[C@@H]2c2cccnc2)cc1 1802923179 OPKGCFWKSCPIBI-IRLDBZIGSA-N 448.523 2.119 10 20 IECD Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426696 AAHYLCHIZSFKDD-SFHVURJKSA-N 425.489 2.138 10 20 IECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)c[nH]1 1832901108 BTZZZWSUGODVAH-QGZVFWFLSA-N 448.614 2.417 10 20 IECD CC(C)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433060 JFSYYMCQTRACON-OAQYLSRUSA-N 440.924 2.257 10 20 IECD O=C(c1ccc2c[nH]nc2c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441557 HYUULOWTNBMJJT-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CC(C)(C)n1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1848340785 VPMIJODQJJMCQT-PMACEKPBSA-N 448.527 2.246 10 20 IECD CCN(CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 726237868 UQEFVSYQMOIXMN-UHFFFAOYSA-N 441.555 2.226 10 20 IECD Cn1nnc2cc(C(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)ccc21 729178386 KPLXVDPBIOEJMD-UHFFFAOYSA-N 446.490 2.154 10 20 IECD Cc1cc(C(=O)COC(=O)c2cn(C)c(=O)n(C)c2=O)c(C)n1-c1ccc2c(c1)CCC2 735151350 HXJNHQAAEMMOFO-UHFFFAOYSA-N 435.480 2.020 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(CCN(C)C)C[C@H]3CCCO3)cc2F)CC1 745809090 PREOVBXZOQSEEI-HXUWFJFHSA-N 435.588 2.220 10 20 IECD CCN(C)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 746054118 MTWGCDVJOSHRLQ-UHFFFAOYSA-N 441.531 2.257 10 20 IECD C[C@H](OC(=O)c1ccc(C(N)=O)o1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747173953 CRJVRRSNBGVHFW-NSHDSACASA-N 432.388 2.338 10 20 IECD COc1ccccc1N1C[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 748993932 HTPQXKZGDQVDIE-SFHVURJKSA-N 439.512 2.316 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnc2n1CCCC2 750701196 BMLZSVIBINPGEA-UHFFFAOYSA-N 435.507 2.405 10 20 IECD COC(=O)C[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CCO1 752335373 GCGVBEKPMSHEIY-SFHVURJKSA-N 428.485 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc4c(cnn4C(C)C)c3)CC2)cc1F 754214578 NBHRPTXYCWPINZ-UHFFFAOYSA-N 440.479 2.447 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](c3cccc(F)c3)N(C)C)CC2)cc1 758187987 WNAOKKPXDXNPKA-LADGPHEKSA-N 430.568 2.210 10 20 IECD COc1cc(N2CCN([C@@H]3CC(=O)N(c4ccccc4F)C3=O)CC2)cc(OC)c1OC 758820172 MXXSQOOQBADPLR-GOSISDBHSA-N 443.475 2.306 10 20 IECD COc1cc(N2CCN(C(=O)Cn3cc(Br)cn3)CC2)cc(OC)c1OC 759240191 IOANJGFSARZRFI-UHFFFAOYSA-N 439.310 2.020 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1 769293091 YJUJCXGDCLTOOF-INIZCTEOSA-N 440.319 2.233 10 20 IECD Oc1c(Br)cccc1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 769467026 QRKQJMACUZETJI-UHFFFAOYSA-N 434.338 2.104 10 20 IECD Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769749506 OHJGZPNJGDEKOH-MRXNPFEDSA-N 435.527 2.226 10 20 IECD COC(=O)c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(OC(F)F)c1 769815279 IAGVQTUJMIEEBY-UHFFFAOYSA-N 430.385 2.404 10 20 IECD CCOc1ccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 771019964 YLPOKFQLODEWCA-UHFFFAOYSA-N 432.458 2.394 10 20 IECD COCCn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc21 771191187 OGEHKDZEOMEUJY-UHFFFAOYSA-N 436.512 2.379 10 20 IECD O=S1(=O)CCN(c2ccc(CN[C@H]3CCS(=O)(=O)c4ccc(F)cc43)cc2)CC1 775508273 SVBWCUKHIMSUGP-IBGZPJMESA-N 438.546 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN(C)Cc3ccccc3)CC2)cc1 778244009 BKXJPNFPNFLJDZ-OUKQBFOZSA-N 436.556 2.148 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1 779709561 WLDYJPVAEOXXCM-FKVRIVCVSA-N 435.524 2.446 10 20 IECD Cc1cc(C(=O)NCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1[N+](=O)[O-] 782716159 NOSVEZIFZMFBFF-UHFFFAOYSA-N 444.463 2.050 10 20 IECD C[C@@H](CN1CCCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 787752496 VFXVPTKCADLHQO-OKZBNKHCSA-N 434.556 2.046 10 20 IECD CC(C)n1cc2c(n1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788312830 NAXURTOMDDRQCC-FQEVSTJZSA-N 425.533 2.111 10 20 IECD CO[C@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cccc21 790918019 LSIGUKTWUWJVLR-FQEVSTJZSA-N 425.485 2.248 10 20 IECD COc1ccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c(O)c1 792844692 XKSIRRGQEDABRK-IBGZPJMESA-N 443.500 2.074 10 20 IECD Cc1ccc(Br)c(S(=O)(=O)NCCNCc2cc([N+](=O)[O-])ccc2O)c1 796527881 DDJSTTQNGFLQMY-UHFFFAOYSA-N 444.307 2.439 10 20 IECD CC(C)[C@H]1CN(C)CCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449409 YVNYHQKYGAELEU-LJQANCHMSA-N 438.519 2.172 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCCC[C@@H]3C(C)C)CC2)cc1 803747859 VGYPOWZGVDYBQR-YADHBBJMSA-N 430.593 2.264 10 20 IECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292045 SXXXYJDGKQSGGR-IBGZPJMESA-N 433.556 2.416 10 20 IECD O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 808344214 QYENRWUGVDPPEV-RBBKRZOGSA-N 441.528 2.008 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCN1CCOCC1 914069851 FOPJNCRDGWUUOY-FYWRMAATSA-N 425.601 2.178 10 20 IECD Cc1nc(-c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 918284878 SRDLOIIGVLNOQF-UHFFFAOYSA-N 439.447 2.276 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3n[nH]c4c3CCC4)cc2F)C[C@@H](C)O1 919330529 HZEFHWDMFZBACK-ZIAGYGMSSA-N 430.480 2.124 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(CC)CC)cn3C)CC2)cc1 1319624181 CQGHWKXSZLKDMI-UHFFFAOYSA-N 448.589 2.417 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(OCC(=O)OC)cc3)CC2)cc1 1319699228 YTDRCDZOBAZRNM-UHFFFAOYSA-N 434.514 2.148 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccc(C)c(F)c2)C1 1320397088 DQENAMPLVDMSQX-YJBOKZPZSA-N 444.459 2.189 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccccn1 1785936795 HOIKLXZKCFMYBL-YEWDVWPNSA-N 431.876 2.053 10 20 IECD CCN(C)[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791020230 KCQMFRVXSHZHTD-AWEZNQCLSA-N 448.614 2.321 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ccno3)CCC2)cc1 1792313864 DPKPFGZIVKETTM-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCS1)C1=NN(c2ccccc2)C(=O)C1 1803321761 ZNJFNGOTMISJOX-NOCIGQNYSA-N 426.542 2.313 10 20 IECD CC(C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1805643638 XGTVGCOKXNYCOA-NRFANRHFSA-N 440.544 2.027 10 20 IECD CN1CCC(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1 1810549361 NPZWWOJYHJQOQS-UHFFFAOYSA-N 430.549 2.070 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817847560 KTTWHLLMHINHKA-ZDUSSCGKSA-N 441.404 2.072 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)C2(Br)CC2)C1 1845226415 PAQYCAGZWAXIBS-UHFFFAOYSA-N 429.698 2.496 10 20 IECD C[C@H](Oc1cccnc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502410 ULVXCOYUOGWJKY-ZDUSSCGKSA-N 431.876 2.431 10 20 IECD CCN(CCCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(C)(=O)=O 743559191 YTXWVNRRHKEZDK-HNNXBMFYSA-N 448.536 2.228 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cc21 743958431 WMXAOTJNHPEANI-UHFFFAOYSA-N 434.496 2.227 10 20 IECD C[C@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749848622 WCDQGVBJILJQEG-PXNSSMCTSA-N 428.577 2.480 10 20 IECD COCCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 751012299 SHJXNBNTFFZCEV-UHFFFAOYSA-N 427.501 2.193 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1C 753868487 XNKYANAZKOFKTN-UHFFFAOYSA-N 436.509 2.405 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3ccc([S@](C)=O)cc3)CC2)cc1 754163778 HSOUTMGJBLPVGH-GGPPTIHXSA-N 431.602 2.266 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(c4ncccc4F)C3)cc2)C1 755309183 UDXMGXAOABAACZ-ROUUACIJSA-N 440.523 2.001 10 20 IECD COC(=O)c1cccc(OC)c1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758226494 XHQVPCLTKRWSPD-GOSISDBHSA-N 430.501 2.052 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(=O)c4cc(C)cc(F)c43)CC2)cc(OC)c1OC 758963873 ITXQMLUUGZZZSC-UHFFFAOYSA-N 443.475 2.469 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1F 758989243 SHIFDZUKAKHYIC-UHFFFAOYSA-N 433.447 2.276 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1Br 762267747 PXRKCAUYPSAGHR-UHFFFAOYSA-N 443.319 2.083 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3C(=O)c3ccc(F)cc3)CC2)cc1 767367916 VUJDTGZYWDIRQA-NRFANRHFSA-N 438.503 2.445 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)cc(O)c3)cc2F)C[C@H](C)O1 768594597 MHIYPAUZCHEJLR-KBPBESRZSA-N 432.448 2.324 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCCCS2(=O)=O)NC(=O)OC(C)(C)C)cc1 773194317 WBPMVOIIOPKAGR-ROUUACIJSA-N 439.578 2.402 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc4cc[nH]c34)CC2)cc(OC)c1OC 773491900 LPDBTQJFJHSTIV-UHFFFAOYSA-N 438.484 2.481 10 20 IECD COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(C(=O)N(C)C)cc1OC 773847981 QPOUWHCHAOMPAZ-CQSZACIVSA-N 442.516 2.288 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NCc2ccc(O)c(O)c2)cc1 778925881 PONGKCDMHIRHLR-SFHVURJKSA-N 432.498 2.160 10 20 IECD CCN(Cc1ccc2c(c1)OCO2)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 779219899 PJZNTWXULFEKTI-NRFANRHFSA-N 427.545 2.429 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nnc4n3CCC4)cc2Cl)C1 785933365 OIYSBJBSAUSTBF-CQSZACIVSA-N 430.940 2.047 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc2)CC1 786256080 QVUKFURFYVFDFV-KRWDZBQOSA-N 432.565 2.474 10 20 IECD CO[C@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1(C)C 789816107 BUSJNEQVSIUJAP-YWUSGSKHSA-N 435.540 2.375 10 20 IECD CCc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789823755 FXVUEZCHQNXPOL-OKILXGFUSA-N 434.537 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@]3(CO)CC(C)C)CC2)cc1 789873723 NFAXFXQCNUYJMH-DHSLYTQISA-N 429.561 2.300 10 20 IECD CC1=C(C(=O)N2CCOCC2)[C@H](c2ccc(N(C)C)cc2C(F)(F)F)NC(=S)N1 794779310 FZQJLFPZVQGPPE-INIZCTEOSA-N 428.480 2.423 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 803135419 QKEZDPNRHLSMGD-MRXNPFEDSA-N 448.570 2.175 10 20 IECD CC(C)(C)OC(=O)N1CC(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 804752164 KZGIMCSBFHGPOK-UHFFFAOYSA-N 429.473 2.250 10 20 IECD Cc1nc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(Br)n1C 804940467 DRBQZLDFTLZTHS-UHFFFAOYSA-N 443.367 2.148 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H]1Cc1ccccc1 806493692 BBAYMVNUDVSTOT-LADGPHEKSA-N 449.599 2.457 10 20 IECD CN(C)c1ccc(CN(C(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)C2CC2)cc1 806565679 RQCPRJRIJFFVBK-INIZCTEOSA-N 436.500 2.249 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)N4CCCC4)C3)cc2F)CC1 806749594 CUCRGMPUSZKTSN-IBGZPJMESA-N 431.556 2.122 10 20 IECD O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809494013 XZIWXQPZGWIFDK-HMFYCAOWSA-N 434.558 2.071 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H](CO)C1CCCC1 811866929 OQVUMYUXXPVTMU-HXUWFJFHSA-N 442.539 2.293 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(CO)(c4ccccc4)CC3)CC2)cc1 814646135 BIGJKFQKJJRJAI-XMMPIXPASA-N 439.600 2.204 10 20 IECD C[C@@H](C(=O)NC[C@@H]1COc2ccccc2O1)N(C)Cc1ccc(N2CCOCC2)cc1 857758943 VLAMYBDNXOGIIL-GHTZIAJQSA-N 425.529 2.300 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1nc(O)c2ccccc2n1 917003498 BCYFOWSZGFDOTC-UHFFFAOYSA-N 439.491 2.059 10 20 IECD COC(=O)c1cn(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc12 917833390 QUMVNUGTZSDBOM-GOSISDBHSA-N 448.523 2.446 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918296240 ISICVTRKALQVKJ-OAQYLSRUSA-N 439.512 2.375 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1C 918438592 IFUDRAKHQJJSKB-UHFFFAOYSA-N 442.491 2.309 10 20 IECD Cc1cccc(OC[C@@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 920043055 FJOHMOYYOFCHJU-IBGZPJMESA-N 431.508 2.334 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CSc2nc[nH]n2)cc1 1342917176 UBBRNHVKIJQNSV-INIZCTEOSA-N 442.497 2.412 10 20 IECD O=C(/C=C/C1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1780742649 PKPVXYYDPVOZOK-LJBSYDGDSA-N 429.517 2.367 10 20 IECD O=C(CCc1ccc[nH]1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002576 UHKXKTLXLNJHBX-OAQYLSRUSA-N 433.892 2.156 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cocn3)cc2)CCC1 1787553175 RGPWOUQIHGETKT-UHFFFAOYSA-N 430.511 2.283 10 20 IECD C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1 1790922333 CATYDDGNGGNFDK-LQJIQPLVSA-N 439.512 2.280 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cn[nH]c3)CCC2)cc1 1792315202 PCMNRWLZXZSIED-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817843546 QUXCOOABYSMZFS-ZBFHGGJFSA-N 429.477 2.481 10 20 IECD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)ccn1 1829276310 PWFSZSCHXNUHCO-SFHVURJKSA-N 440.500 2.444 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831913177 IMNBWVQRQPHMTC-AWOXUWAMSA-N 432.517 2.471 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H]2CCC(F)(F)C2)=NN1c1ccccc1 1847220819 RDLYCIKUFGRBCC-WBAXXEDZSA-N 430.455 2.417 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)n(C)c2ccccc12 671058453 PUBVNHQTOGSGJQ-IBGZPJMESA-N 447.583 2.430 10 20 IECD COc1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(C)C 727177135 CVAQRPCIITYCMZ-UVTDQMKNSA-N 430.573 2.233 10 20 IECD COCCNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1Cl 729062128 NUWQMAISRRYZAR-GFCCVEGCSA-N 449.891 2.246 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCCC(=O)N1CCN(c2ccccn2)CC1 731282470 RDHUGIRIIYWDFC-UHFFFAOYSA-N 425.533 2.448 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3CCS(=O)(=O)CC3)c2C)cc1 733025376 HRDFMVRJVNWJMU-UHFFFAOYSA-N 447.509 2.431 10 20 IECD CS(=O)(=O)Nc1ccc(F)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736196042 LZWAOCOALGZXGU-UHFFFAOYSA-N 435.521 2.336 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)cc1 739923048 CRLSNQIDFJOTGE-QFIPXVFZSA-N 439.512 2.032 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 743719383 ZTXHQKUYTBAFRG-UHFFFAOYSA-N 430.526 2.222 10 20 IECD C[C@H](CS(C)(=O)=O)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 744401932 BSEWTXVEBUJZHR-CQSZACIVSA-N 440.521 2.298 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnn(Cc4ccccn4)c3)CC2)cc1 746373159 XRHGBBVOOARKRK-UHFFFAOYSA-N 434.500 2.012 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 746989148 DYAHYJVGUGCGQS-HUUCEWRRSA-N 442.491 2.102 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN(c4ccccn4)C3)cc2F)CC1 753127923 QRCLERPLRWOYGW-IBGZPJMESA-N 426.540 2.441 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](c4nncn4C(C)C)C3)CC2)cc1 754072365 UISDCZHPNMTEJY-IRLDBZIGSA-N 442.608 2.230 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1ccccc1S(=O)(=O)C(F)F 759579595 MZZBACHLEYEKCQ-SOFGYWHQSA-N 427.381 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nn(C)c4ccccc34)CC2)cc1 760144589 WZNFUYSBPDRLIO-VAWYXSNFSA-N 433.512 2.103 10 20 IECD O=S1(=O)CC[C@H](c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)C1 761626012 KINQAXHUMOCKAR-JTQLQIEISA-N 441.512 2.207 10 20 IECD COc1ccc([C@H](C)NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 771727225 ROAAZHCWTZIGGH-LBPRGKRZSA-N 446.485 2.242 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCCN1CCN(C)CC1 778951842 XLKLEEOMLSEUBN-GOSISDBHSA-N 448.567 2.358 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 781485257 XKIZHDMOSIMBPX-UHFFFAOYSA-N 429.448 2.345 10 20 IECD O=S(=O)(c1cccc(NCc2ccc(N3CCOCC3)cc2)c1)N1CCC(O)CC1 785554687 HMBHTUYRNSZKFU-UHFFFAOYSA-N 431.558 2.281 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(O)nc4ccc([N+](=O)[O-])cc34)cc2)CC1 787320890 ACMJREGPAADIKV-UHFFFAOYSA-N 449.467 2.447 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 787853132 VTDQTAAZSQKRIE-FQEVSTJZSA-N 437.588 2.258 10 20 IECD Cc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 788402560 RCSOWYYBEWKDKM-QGZVFWFLSA-N 429.492 2.171 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 788757403 LNZAGPKXJJYCBY-QGZVFWFLSA-N 428.499 2.492 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(C)noc1C 789845801 MFBJHNVBBXALSH-SFHVURJKSA-N 432.496 2.275 10 20 IECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859211 AJBXFCGNIPVXSH-FQEVSTJZSA-N 425.558 2.148 10 20 IECD O=C(NCC1(OCCO)CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 800710823 XQPANKMQLQYNOE-INIZCTEOSA-N 443.491 2.114 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nc(-c2ccccc2)no1 803663720 XXNFZZLBJMTHNH-CQSZACIVSA-N 425.464 2.478 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807769116 SCEWQZAPSTZTKM-INIZCTEOSA-N 439.503 2.384 10 20 IECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807836405 WIEHWBPKFVWRMN-UHFFFAOYSA-N 445.324 2.491 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCCn3c(C)cc(=O)cc3C)CC2)cc1 811353530 AUHLVVUGJVDNJU-UHFFFAOYSA-N 441.528 2.146 10 20 IECD COC(=O)C12CCC(C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)(CC1)CC2 814590150 GORDZXUPDNXRFM-UHFFFAOYSA-N 444.528 2.401 10 20 IECD C[C@@H](NC(=O)c1cnn(C)c1I)c1ccc(N2CCOCC2)cc1 815115372 YNIHQWAEIPDDAC-GFCCVEGCSA-N 440.285 2.352 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(-c2ccccc2)[nH]n1 1796601529 URAHRRQUKBWWJA-BJWYYQGGSA-N 433.468 2.449 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801296422 LZHLFMSHJGDWIW-GJYRHAHMSA-N 448.472 2.016 10 20 IECD CCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1813784555 BJIACJHYCNSIJN-JTQLQIEISA-N 425.894 2.470 10 20 IECD C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189278 DFYSPTDMTZDYDR-LBIFLRBASA-N 444.582 2.080 10 20 IECD CC(=O)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821981409 OHGIDWYAWFMCLB-OAHLLOKOSA-N 449.895 2.306 10 20 IECD CC(C)c1nc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)co1 1842166255 DSJUPJDGQBKOIU-UHFFFAOYSA-N 435.484 2.408 10 20 IECD C[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 725803781 QBTGYGWJAMQWDL-LFMVTYOGSA-N 433.555 2.075 10 20 IECD Cc1ccnc2nc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)nn12 742752321 FZHQLHMARFLLQZ-KRWDZBQOSA-N 439.520 2.495 10 20 IECD C[C@H]1CCCN1CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 746111159 ZLPKWPXPWMOSLM-NWRYFCBHSA-N 433.555 2.217 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 748298200 SBSVBWKJXXJKRD-SBUREZEXSA-N 448.539 2.354 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc21 749730214 LRNFHNOPQYVEEB-UHFFFAOYSA-N 433.559 2.472 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 756365049 XVOFYWPSHOAQFC-OAHLLOKOSA-N 434.514 2.051 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cnn(-c4ccccc4)c3)CC2)cc1 759136071 ZJJGKKASKSVTPK-HKBQPEDESA-N 438.553 2.478 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3cccc(Cl)c3)CC2)cc(OC)c1OC 759406491 UALBZTDTIOSSEO-UHFFFAOYSA-N 447.919 2.444 10 20 IECD O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914060 CBQPYQRIKMQZRB-HZPDHXFCSA-N 432.995 2.047 10 20 IECD COc1cccc(CNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c1O 769498694 MAMBITFWSXXSSO-SNVBAGLBSA-N 433.258 2.464 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)cc2F)cc1 770480609 CKSQLCPWJLJIBN-KRWDZBQOSA-N 435.521 2.361 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc([S@@](C)=O)cc4)n3)CC2)cc1 771082153 JKSSKSBKQSYFBL-WJOKGBTCSA-N 440.525 2.374 10 20 IECD CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 773676174 NYTCXAYIFZLSNB-LJQANCHMSA-N 447.919 2.268 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F)c1ccc(N(C)C)cc1 773845441 JPIOAPXFPWNTQV-AWEZNQCLSA-N 448.520 2.248 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3csc([C@H](C)OC)n3)CC2)cc1 778314755 UTBNPOASNINUAG-QWGSZXSUSA-N 444.557 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCN(CC(C)C)C3)CC2)cc1 778390362 ARKKKNVGGOYSSN-ZJVMWOEPSA-N 442.604 2.384 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)cc1 785424694 LLFZELBKLMTNAN-NRFANRHFSA-N 444.963 2.212 10 20 IECD Cc1ccc(OCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 785497168 RGLHSOBCPOJLJY-UHFFFAOYSA-N 425.529 2.294 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2 788309726 GPRSKXUGADVMLP-HXUWFJFHSA-N 437.496 2.232 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cncc(C(=O)OC)c2)cc1 788491421 BOWJDKMNAKOUKK-UHFFFAOYSA-N 427.504 2.211 10 20 IECD C[C@H](CN1CCOCC1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 788874291 JGGXSJZGVKWFRD-MRXNPFEDSA-N 444.498 2.404 10 20 IECD CC(C)(C)OC(=O)NC[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 788936103 HDASDWKCEOJROY-IBGZPJMESA-N 430.549 2.323 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(OCC4CC4)CC3)cc2F)C[C@H](C)O1 789819159 MDXOWKPKPGCYCU-IRXDYDNUSA-N 447.551 2.473 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCOc2ccc(F)cc21 789841261 VVANRCMWKPXTEM-LJQANCHMSA-N 445.466 2.182 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)CCn3cc(S(N)(=O)=O)cn3)cc2Cl)C1 800570616 AZOREFARPKHSCB-AWEZNQCLSA-N 439.969 2.127 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cncc(-n2ccnn2)c1 801660929 KJQZSIAHQZABCB-UHFFFAOYSA-N 432.406 2.448 10 20 IECD C[C@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451447 LDJBJYWPMOMFRP-HNAYVOBHSA-N 438.519 2.172 10 20 IECD CN1CCN(CCCN(C)C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803677012 ZSAVGWCRFCWFGV-UHFFFAOYSA-N 443.636 2.168 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1)C1CCCCC1 803677198 IWRYLIQLEWMVTR-SFHVURJKSA-N 426.561 2.199 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@@]4(CC=CCC4)C3)CC2)cc1 803751312 UJZZEXFVGAGZRX-VWLOTQADSA-N 440.588 2.282 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc([S@@](C)=O)cc3)CC2)cc1 804318141 APKZFYGFOUZAHA-WJOKGBTCSA-N 443.569 2.176 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccccn3)cc2F)CC1 805009848 OYTSYDQURSFJJE-QFIPXVFZSA-N 439.535 2.343 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCCO[C@H]1C(C)(C)C 807246654 NQBWJBVCICPENR-TZIWHRDSSA-N 431.577 2.439 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807450442 JJQLGDZMBFFVFX-HXUWFJFHSA-N 437.588 2.038 10 20 IECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 808835455 CCHPHYNZTXBXNM-TZIWHRDSSA-N 431.577 2.384 10 20 IECD Cc1c(NC(=O)C(=O)N(C)Cc2ccccc2O)nnn1CCOc1ccc(F)cc1 815398487 KFHYJCWYSRKOEI-UHFFFAOYSA-N 427.436 2.107 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](CSC)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 872160622 IYXFVMINQFNNAT-AQNXPRMDSA-N 445.585 2.251 10 20 IECD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 913305444 RGOQVJYIESLOFM-GFCCVEGCSA-N 448.391 2.137 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 916668148 MIMINKHCWVWRCR-UHFFFAOYSA-N 436.509 2.234 10 20 IECD Cc1ccccc1[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(N)=O 917834841 RHQBSSCAXLINOQ-RXVVDRJESA-N 437.544 2.113 10 20 IECD O=C(NCCCN1CCCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919784043 ZIGUKSDUOBMSGP-UHFFFAOYSA-N 441.555 2.227 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 919859928 KWSYOOKMEHFHHL-UHFFFAOYSA-N 447.532 2.377 10 20 IECD NS(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)cc2c1CCC2 1320798406 QCCNTPWGJUGVPY-UHFFFAOYSA-N 425.304 2.221 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 1321269271 ZDBXEYWHHSTUSE-WFASDCNBSA-N 434.518 2.284 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c(F)c1 1777852788 VIQMVINPACZPCJ-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(CCC1CCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795040722 HNGPFCYGRCQUNL-PCLDGEOKSA-N 444.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(-c2ncc[nH]2)cc1 1796603795 XEZHSTRVMLRBJW-BCDXTJNWSA-N 433.468 2.449 10 20 IECD COc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc(F)c1F 1796604220 RGVRVEUHZRJAPV-CLLJXQQHSA-N 433.411 2.345 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)Cc2cc[nH]n2)cc1 1800290826 WBEMKCZOWBFJJX-IRJINJETSA-N 447.539 2.263 10 20 IECD COC1(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1813672417 BNMNXFNGSWQFFW-IERDGZPVSA-N 440.500 2.167 10 20 IECD CC(C)c1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)co1 1848308784 CJZAZUVMQXIZMB-OALUTQOASA-N 435.484 2.406 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3cccc(C(=O)NC)c3)cc2F)CC1 730116083 BIOZXHWWQBIFDC-UHFFFAOYSA-N 427.524 2.327 10 20 IECD CN1CCN(C)[C@@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 732149396 INMKFABIQGICEY-HNDQUVLASA-N 438.644 2.092 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NCCCSc2nccs2)c1 733899677 MENPRHRSSLINCR-UHFFFAOYSA-N 430.529 2.177 10 20 IECD CN(C)CCN(CCN(C)C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903242 DNRWPSLCJQXWBW-KRWDZBQOSA-N 427.540 2.392 10 20 IECD O=C(NOCc1cccnc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 747620157 XEOWMNCNADFEKT-UHFFFAOYSA-N 444.425 2.358 10 20 IECD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)C1 748485501 HSJZJOTVUIYPCG-HZPDHXFCSA-N 445.541 2.314 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(N(C)C)n1 750217064 ZVGCSJYQTICKHF-IYBDPMFKSA-N 443.523 2.464 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1O 750820828 XELWJJSKQOVOID-UHFFFAOYSA-N 434.489 2.095 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc2c(cc1C(=O)OC)OCO2 753809448 DTPLOAOXRLYEFE-UHFFFAOYSA-N 427.457 2.255 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN([C@@H](C)C(=O)N4CCCC4)CC3)CC2)cc1 755982321 BNMRYFVBYOJGNS-IBGZPJMESA-N 443.592 2.002 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(C(=O)NC4CC4)cc3)CC2)cc1 757848086 RQMRVKSSRVWLNL-UHFFFAOYSA-N 437.496 2.093 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2 765094825 VOPMUQCXUSFAJM-UHFFFAOYSA-N 441.553 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN([C@H](C)c4nccs4)CC3)CC2)cc1 767010711 RIQNXYGCLJDCKH-GOSISDBHSA-N 429.590 2.179 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H]2CCCC[C@@H]2N1 769025656 WUTYWKFSRGGMEX-ROUUACIJSA-N 440.466 2.495 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@H](COC(C)C)C3)CC2)cc1 771297241 SSLNXVIWWWARRT-QFIPXVFZSA-N 434.581 2.043 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)C3=Cc4ccccc4OCC3)cc2)CC1 772604108 ANHVFKGSKPFSCQ-UHFFFAOYSA-N 448.566 2.164 10 20 IECD CCN1CCOC[C@@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 775041771 HFXSVTMHVHEYNB-LJQANCHMSA-N 428.485 2.312 10 20 IECD O=C(CN1CC[C@@](O)(c2ccc(F)cc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 777737179 MABBNUNBJLNWMR-QHCPKHFHSA-N 431.483 2.011 10 20 IECD CCNS(=O)(=O)[C@@H]1CCN(Cc2cc(Br)cc(Br)c2O)C1 779609402 RDFBNTIZKGPUHQ-LLVKDONJSA-N 442.173 2.431 10 20 IECD O=C(CN1CCOC[C@H]1[C@@H]1CCCC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 784355743 HTWZOBGNZGITGK-PXNSSMCTSA-N 432.476 2.471 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)cc1 785648340 OXNQDELYWBGOMF-OAQYLSRUSA-N 442.560 2.240 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)ccc1C 786122071 MOPGIFZYQAPJCZ-UHFFFAOYSA-N 444.557 2.100 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(CO)(NC(=O)OC(C)(C)C)CC1 788002454 DMWJKPMHCUHSOM-UHFFFAOYSA-N 434.581 2.063 10 20 IECD Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801497 UHICKESHFJBGGQ-OAHLLOKOSA-N 445.539 2.416 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc([C@H]4CCCOC4)nn3C)CC2)cc1 790917171 FISDKCFINNSVHQ-KRWDZBQOSA-N 441.532 2.000 10 20 IECD O=C(COC(=O)c1nc2cccnc2s1)NCc1ccc(N2CCOCC2)c(F)c1 792402144 PBJFUXMATCTMCL-UHFFFAOYSA-N 430.461 2.140 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CN(C)[C@H]3CCS(=O)(=O)C3)cc2Cl)C1 800572628 ZXZIPJZZRQLRAB-WBVHZDCISA-N 427.998 2.311 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(F)c(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 803299109 YVMNVOYJYSDCGN-KRWDZBQOSA-N 442.535 2.218 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCC(CCCO)CC1 803448757 XAENCUPUILBIIU-UHFFFAOYSA-N 439.503 2.384 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3c3cn(C)nc3C)CC2)cc1 804317398 BTKJBWQHFMZADN-NRFANRHFSA-N 425.533 2.186 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CC(C)(C)OC3(C)C)cc2F)CC1 805009377 JLFJKFKOHLDEQO-IBGZPJMESA-N 434.556 2.046 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NCc1ccc(N(C)C)cc1 915309248 LXFYZDVFRHIURB-UHFFFAOYSA-N 448.545 2.104 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295934 UDYRBUFHCUUYOV-MRXNPFEDSA-N 429.429 2.455 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1 918434509 OJMDKNFWNGXMKL-UHFFFAOYSA-N 444.557 2.328 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1 1320485950 IGTRSQAOYQIYCB-YJBOKZPZSA-N 441.402 2.311 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2)CC1 1322011578 FRVHROOIQAHLSY-IBGZPJMESA-N 449.555 2.342 10 20 IECD Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1 1784908630 KRAMVCNBUFWXTB-IHPCNDPISA-N 439.512 2.027 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CCC(CC1)CC3)C2 1804340725 ZAMDVNQJBZNTBF-OBYNBTBUSA-N 435.615 2.455 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824203934 RLNNXMZZPZIIEK-OALUTQOASA-N 430.549 2.210 10 20 IECD Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1825699282 CIXJNGJVTVNYJD-SFHVURJKSA-N 425.489 2.138 10 20 IECD O=C(Cn1cc(Cl)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426452 WIEZRVSUGSQJLJ-QGZVFWFLSA-N 447.923 2.276 10 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O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)Nc1ccc2c(c1)OCO2 731844175 AJJKIDOUTFWWCD-QGZVFWFLSA-N 427.457 2.450 10 20 IECD COc1ccc(CN2CC[C@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 734525643 NJEIZNWANGBISH-QFIPXVFZSA-N 438.528 2.132 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2n[nH]c(C)c2C(=O)OCC)cc1 740813125 UCYIPMQYSHKMFP-UHFFFAOYSA-N 444.535 2.237 10 20 IECD C[C@]1(C2CC2)NC(=O)N(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801444 ZJUYTGTYLMOTHQ-SPLOXXLWSA-N 436.459 2.094 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO 747579297 CFHXHKPLZFHOLW-UPVQGACJSA-N 438.572 2.205 10 20 IECD O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)Nc1c(-c2ccccn2)nc2ccccn12 751302925 RIUYULXEFIUUTJ-IBGZPJMESA-N 448.527 2.048 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H](C)c3nnc4ccccn34)CC2)cc(OC)c1OC 759215472 FUNAQFOLCKHZGS-OAHLLOKOSA-N 440.504 2.348 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](c4ccc5c(c4)CCO5)C3=O)CC2)cc1 761185755 RAGDEWMTYMWNSJ-JOCHJYFZSA-N 436.512 2.045 10 20 IECD CC[C@@H](O)CCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 761573536 OPWWCGPBVUBPJK-OAHLLOKOSA-N 437.474 2.382 10 20 IECD COC[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769949893 XRBJGOPGUGLZNT-OAHLLOKOSA-N 435.458 2.352 10 20 IECD C[C@H](NC(=O)N1CCC([C@@H](O)c2nccn2C)CC1)c1ccc(N2CCOCC2)cc1 771971310 RLUITIBSVCECKJ-LAUBAEHRSA-N 427.549 2.473 10 20 IECD CC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC[C@@H]1O 783753578 JZXONVBIPWKGRH-SFHVURJKSA-N 449.485 2.334 10 20 IECD CN1CCN(C[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c2ccccc2)CC1 787737269 ONIVQCXPPHPFRT-DEOSSOPVSA-N 449.599 2.008 10 20 IECD O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)NCc1ccc(N2CC=CC2)cc1 787850928 HWLGTMGHXIBQMF-UHFFFAOYSA-N 447.583 2.008 10 20 IECD Cc1c(S(N)(=O)=O)sc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1Cl 791207840 DNFDIPQROMFFEI-UHFFFAOYSA-N 429.951 2.124 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccccc3-n3ccnc3)CC2)cc1 793721541 WWZIWPRNZQYDJU-UHFFFAOYSA-N 433.512 2.236 10 20 IECD CC[C@H](C)[C@H](C)N(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CC1 793735166 XDXSGAFJEJUPBQ-LNLFQRSKSA-N 428.577 2.430 10 20 IECD C[C@@H](COc1cccc(F)c1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793780656 AFVUWCURFCTWMO-DLBZAZTESA-N 429.492 2.423 10 20 IECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Cc1ccccc1 793841944 ZENFQHGGOHYSRB-OAQYLSRUSA-N 425.529 2.148 10 20 IECD CCN(CC)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccco1 793842634 IFMLWCQKQIXCLD-OAQYLSRUSA-N 442.560 2.274 10 20 IECD COc1ccc(CNS(=O)(=O)c2cc3c(cc2Br)OCCO3)c(O)c1 795362162 IULMTYXIEMPPKR-UHFFFAOYSA-N 430.276 2.413 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c(O)c1 797388467 ZOOQDRDGGRMTJG-HOTGVXAUSA-N 427.501 2.265 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@H]3C[C@@H](O)c3cccs3)ccc21 803688885 DQRFVOWHMIPKKL-UYAOXDASSA-N 443.569 2.098 10 20 IECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCCCSc3nccs3)C2=O)cc1 806280579 RJUZKUGJUBAXBE-INIZCTEOSA-N 432.571 2.362 10 20 IECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)O2 806701876 NVGJFMGHZMGOAO-VXEBSTKISA-N 446.544 2.338 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1COCCN1CC(F)(F)F 807108385 WCUAZTQZIVCRBY-CVEARBPZSA-N 435.874 2.389 10 20 IECD CC(C)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808852096 NKAMFCJDLORXCK-JOCHJYFZSA-N 444.645 2.435 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc4nc(O)nc(O)c4c3)cc2F)C[C@@H](C)O1 918140367 LXEULZJSUKBOGN-TXEJJXNPSA-N 427.436 2.119 10 20 IECD COc1ccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 918338324 PUTIMDRWNGJTFN-UHFFFAOYSA-N 432.542 2.188 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918462634 DHFITPRVSAAFKD-GOSISDBHSA-N 438.528 2.430 10 20 IECD COC(=O)CSCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786377589 GAUDPDVRCDNPEZ-UHFFFAOYSA-N 445.497 2.147 10 20 IECD CC(=O)N(C)[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427941 ISLCLQCTRFLRMI-CYBMUJFWSA-N 426.473 2.107 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1798803997 VKHTZEFLGLTBDB-ZURAMSNBSA-N 439.468 2.172 10 20 IECD C[C@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802890483 XUJQEJFBCSDEBV-HNKHHVNMSA-N 428.514 2.320 10 20 IECD CCc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807991004 MIGQMCKAIZUXRM-KSFYIVLOSA-N 447.495 2.479 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cnoc2C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992137 VHTQLJQFRBFCMT-QRWLVFNGSA-N 449.467 2.387 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000166 XRWORCGTLWQSQY-GIMINZRKSA-N 440.500 2.024 10 20 IECD Cc1c[nH]cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818220925 DDWMSGYIUFLOCW-AWEZNQCLSA-N 446.558 2.212 10 20 IECD O=C(c1cnc(Cl)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424659 LVWBJTDCWZPZKW-INIZCTEOSA-N 445.907 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2CCN(c3ccccc3)CC2)C1 1841310809 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426.429 2.335 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c1 743337552 WAVWJNNQHBGONP-CQSZACIVSA-N 431.514 2.439 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(CS(C)(=O)=O)c3)CC2)cc1 746772628 KLDFVAHXGRXXLH-UHFFFAOYSA-N 446.573 2.184 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1C 747607922 SFYNJWFEJMLGNE-UHFFFAOYSA-N 430.479 2.483 10 20 IECD COCCCS(=O)(=O)NCCN(Cc1cccs1)c1ccc2c(c1)OCCO2 747839380 GGYJWBUBKSPPTC-UHFFFAOYSA-N 426.560 2.482 10 20 IECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H](CC)CN1C(C)=O 752878818 GEZKEVCAGIDJGE-PWRODBHTSA-N 443.592 2.319 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3coc(S(=O)(=O)N(C)C)c3)cc2F)C[C@@H](C)O1 755579911 VPTGKLRVSQPDLZ-OKILXGFUSA-N 439.509 2.213 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@@H](C)Cn3ccnc3C)CC2)cc(OC)c1OC 760105291 CULSMGHOABDREH-MRXNPFEDSA-N 431.537 2.385 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cn(-c5ccccc5)nn4)n3)CC2)cc1 771054523 BNZUETLOYKKMBZ-UHFFFAOYSA-N 445.483 2.217 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(S(N)(=O)=O)c(C)c3)CC2)cc1 775227269 YZDGSJVTXZPMFA-UHFFFAOYSA-N 432.546 2.073 10 20 IECD COC(=O)[C@H]1C[C@H](OC)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778236370 ZPRQBIBLXJCMJR-AUUYWEPGSA-N 436.464 2.053 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H](c1ccc(C)cc1)n1cncn1 785440770 CELPBKSYVQPZAA-FCHUYYIVSA-N 434.544 2.453 10 20 IECD CN(C)c1ccc(CN(c2ccc(C(=O)N3CCS(=O)(=O)CC3)cn2)C2CC2)cc1 786777936 YBQZIQXMJLOPCK-UHFFFAOYSA-N 428.558 2.187 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCN(C4CC4)CC3)cc2F)C[C@H](C)O1 789818697 KCCGYPKMSUFUJS-IRXDYDNUSA-N 446.567 2.046 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789863442 GWEZTTNGEAZMJS-UHFFFAOYSA-N 428.558 2.193 10 20 IECD CCOC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(C)C 789948569 CYJHJLAEWATNLP-SFHVURJKSA-N 445.482 2.336 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 793135159 JRDZIPAHPWDCTE-JOCHJYFZSA-N 430.549 2.105 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn4c(n3)CCCC4)cc2F)C[C@@H](C)O1 799587464 ZEPCCQWHKYNTQO-IYBDPMFKSA-N 444.507 2.445 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nnn(Cc2ccncc2)c1C 803031050 JIETXGRYPCUYBQ-UHFFFAOYSA-N 429.864 2.204 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ncnn3-c3ccccc3)cc2)CC1 805023745 AJGWMMWNTDIZQR-UHFFFAOYSA-N 432.528 2.436 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 807100165 KZPZUMYIVCZMOE-XXBNENTESA-N 438.572 2.083 10 20 IECD CCC[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768331 HGDGDELBVIOGDX-CRAIPNDOSA-N 425.476 2.401 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 906260537 ILPFYLHHZZAWEB-UHFFFAOYSA-N 444.399 2.439 10 20 IECD O=C(Nc1cccc(N2CCOC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295325 DLJRDKIRRUCNJX-LJQANCHMSA-N 439.468 2.495 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)c1 919815776 BOTWYNKDXKEFGB-UHFFFAOYSA-N 445.328 2.428 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCN(C)C)CCO3)C2)cc1 1781752957 CPRGUYAAECESIO-RUZDIDTESA-N 438.572 2.489 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2 1782007207 DREJTSMWAZJDNF-XCLFUZPHSA-N 440.949 2.338 10 20 IECD Cc1cc(C)cc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)c1 1784223512 MSZVBIJXECVLOP-XMMPIXPASA-N 439.512 2.186 10 20 IECD Cn1cc(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)cn1 1787380234 JUWAHRLZDZSGCV-UHFFFAOYSA-N 443.554 2.028 10 20 IECD CC(C)N[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)C(C)C 1809943638 RPOCQOGVOIESOK-HXUWFJFHSA-N 432.565 2.360 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1 1814166646 RVYFWEOHGZGWOZ-BFCCKJOKSA-N 441.459 2.276 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(Cl)n2)[nH]n1)c1cc(O)nc(O)c1 1817846261 OBCAPBBNRNEOIX-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD C[C@H](CC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291689 ZAMXJIZOSFVNNN-QMTHXVAHSA-N 449.895 2.292 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2)C1 1840972421 FGODUZAQSXRCCM-QPJJXVBHSA-N 429.860 2.382 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 117630422 GGNNMDVIMCRMHP-HUUCEWRRSA-N 435.521 2.277 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)cc2F)CC1 730194985 VCRRWPHHMVYBMX-QXAKKESOSA-N 444.551 2.148 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 735196368 YWZVWWQQWFMCJQ-WYIRRWHOSA-N 434.514 2.112 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c1O 737286172 RUYNBHSHUKUNSO-UHFFFAOYSA-N 442.497 2.102 10 20 IECD Cc1oc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1S(N)(=O)=O 755651245 JLHSZUVMSXGKNL-UHFFFAOYSA-N 429.445 2.236 10 20 IECD COc1cc(N2CCN([C@@H]3CC(=O)N(Cc4ccccc4)C3=O)CC2)cc(OC)c1OC 758822651 UVSQUJRQPUFXAR-LJQANCHMSA-N 439.512 2.162 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](NC(=O)NC2CC2)C1 760905224 FISXRYFDGPHBFC-HOCLYGCPSA-N 446.507 2.325 10 20 IECD CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 761895904 ZOLDDTBDCQZYKH-UHFFFAOYSA-N 446.890 2.413 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N[C@H](C)c3cc(OC)ccc3O)cc2)[nH]1 761967068 GDDUPYWILCVHHA-CYBMUJFWSA-N 425.441 2.086 10 20 IECD CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2NC1=O 769932481 UPKSUOOQTDTCRP-PIGZYNQJSA-N 433.486 2.364 10 20 IECD COc1ccc(N2CCN(C(=O)c3cnn(CC(=O)NC4CCCC4)c3)CC2)cc1F 772105049 GTYTUSFDFCZVNN-UHFFFAOYSA-N 429.496 2.052 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NC(=O)Nc1ccc2c(c1)OCCCO2 774751431 LXLUTCMNIMNPEV-UHFFFAOYSA-N 426.473 2.461 10 20 IECD CCc1nc(N)nc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 776292648 SAJKFOLQLXJKJD-BETUJISGSA-N 434.541 2.177 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-n4cnnc4C)c3)CC2)cc1 778401733 HRYVUSFVSBASSG-KHPPLWFESA-N 446.511 2.428 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1 784026162 GDKFOXICMJFMKJ-UHFFFAOYSA-N 449.504 2.449 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCN(c4ncccc4F)CC3)CC2)cc1 784411927 LJWCGNFBMIVKPY-UHFFFAOYSA-N 427.524 2.090 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(c4ccccc4)CCC3)cc2)C1 785833500 AYOCUTAUALRROE-HXUWFJFHSA-N 448.567 2.243 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C)nc12 786372411 SQEFYKCTCXNPSU-OCCSQVGLSA-N 448.476 2.300 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1 786652922 CHOKOMUBGGBNQQ-UHFFFAOYSA-N 442.535 2.485 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3cccc(OC)c3)cc2F)CC1 786765265 BEZPCIQQCDAEJD-KRWDZBQOSA-N 442.535 2.470 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)c(Cl)c3)cc2)C1 786972059 KSLPEKNJNABYBF-INIZCTEOSA-N 446.910 2.113 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 787636620 VMKSFWUSSQZQTC-INIZCTEOSA-N 447.486 2.150 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 803306176 SSKVLXXJUKESKT-CRAIPNDOSA-N 443.466 2.270 10 20 IECD CCC[C@]1(CO)CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 808796210 HKDHXRFXSLQMSD-QFIPXVFZSA-N 433.574 2.409 10 20 IECD CCn1c(O)nnc1SCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 844263215 JEIYZBRZWBIDNZ-UHFFFAOYSA-N 435.531 2.034 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2C(=O)OC)cc1OC 917759770 YNVAKLOCQYYNCI-UHFFFAOYSA-N 428.488 2.044 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC2)cc1 918482398 YOCHCMJJCRXJEM-UHFFFAOYSA-N 431.468 2.267 10 20 IECD C[C@H]1CCCCN1S(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919730170 RBSCYJCTGAOPNV-KRWDZBQOSA-N 448.568 2.151 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccnc1N1CCCC1 920416430 OTCSOYXQBNUPNN-UHFFFAOYSA-N 429.546 2.238 10 20 IECD C[C@H](NC(=O)c1ccc(CCNS(C)(=O)=O)s1)c1ccc(N2CCOCC2)cc1 920880805 IPYBMTPUSAHAKV-HNNXBMFYSA-N 437.587 2.167 10 20 IECD O=C(Cn1ccccc1=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426475 LEZATNKOIQTNGM-UHFFFAOYSA-N 434.452 2.102 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(F)c1 1800309728 RVMXOWYGTGJFQX-BTTYYORXSA-N 435.546 2.246 10 20 IECD COC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828192740 PWYJYFHMRRKAGM-BIPYJSMBSA-N 447.513 2.310 10 20 IECD Cc1cccnc1CCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1841994352 BMQWOYDBAAVWAG-RMKNXTFCSA-N 437.496 2.356 10 20 IECD COc1ccc(OC)c(-n2nnnc2SCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 110308865 HPCQCAKLGFWVGM-UHFFFAOYSA-N 442.545 2.496 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 479019322 MSNJKSZYRAKRRX-UHFFFAOYSA-N 445.522 2.183 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 728839926 XXSPXZDCILEBEI-ILRDRHFLSA-N 435.446 2.451 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CC(=O)OC)Cc3cc(Cl)ccc3O)nc12 731845050 PCDFYZHWHXGWMY-UHFFFAOYSA-N 448.863 2.146 10 20 IECD Cc1ccc(C(=O)OCC(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c(O)c1O 733475921 HQMJDHYBNBYKMG-UHFFFAOYSA-N 430.482 2.391 10 20 IECD CN(C)C1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOCC1 733845565 DWAIFKBXBYQZAC-UHFFFAOYSA-N 444.498 2.452 10 20 IECD COc1ccc(O)c(CNC(=O)Nc2cc(C(=O)N3CCN(C)CC3)ccc2OC)c1 734063017 QCCWEZWGENWBIA-UHFFFAOYSA-N 428.489 2.119 10 20 IECD COCCN1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 736652665 CJLCASWLPGCCJG-INIZCTEOSA-N 430.471 2.062 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)n[nH]1 737106801 BGRHKYVEQOAMAG-UHFFFAOYSA-N 438.463 2.011 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2I)c1O 737285520 FJSJGTJSYKERCV-UHFFFAOYSA-N 426.210 2.260 10 20 IECD Cc1cc(C(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)c(C)n1-c1ccccn1 737999102 IKDPUGNINNECAL-UHFFFAOYSA-N 447.543 2.078 10 20 IECD COC(=O)Nc1ccc(CNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 738298805 IATAWYBZQGGTLD-UHFFFAOYSA-N 426.517 2.450 10 20 IECD CC(=O)CCc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 745109381 RLNYZQARQDAHTE-UHFFFAOYSA-N 444.553 2.138 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751136029 CNDTXSUCBXPODA-GOSISDBHSA-N 435.498 2.314 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)CCc3ccccc3)CC2)cc1 753306726 LDONLBGBRYSWMQ-DGXIYAMASA-N 437.540 2.010 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)ccc1O 757657339 QFWUEUJCBJQNCX-UHFFFAOYSA-N 440.499 2.066 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 760214229 ZDEHDXLFZFRDLE-QGZVFWFLSA-N 434.500 2.228 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc21 767787303 IVKQNCJJDNTFFB-UHFFFAOYSA-N 445.541 2.302 10 20 IECD O=C1C[C@H](c2cccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2)CN1 772474648 MSRVIFCWYOBYEO-AZUAARDMSA-N 437.496 2.142 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cc1 775408825 CKWXPZWRHHSJEW-LJQANCHMSA-N 444.601 2.245 10 20 IECD CCO[C@@H]1C[C@](CO)(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 780189139 WBYOOGIIEAIATD-ZJSXRUAMSA-N 448.608 2.073 10 20 IECD CCN(CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1C 788041735 TVJRHYTTYTWQQC-UHFFFAOYSA-N 438.572 2.433 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)C1CCOCC1 788310213 JHSOGTVWSLONAC-HSZRJFAPSA-N 437.540 2.424 10 20 IECD COc1ccc(C[C@@H](C)CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788312261 FXYWYUJVBWQPNK-LJQANCHMSA-N 439.556 2.485 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788930735 AAMCWZTVQOQSAN-QGZVFWFLSA-N 430.549 2.371 10 20 IECD COc1c(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc(Cl)cc1C(N)=O 792954690 RBZPNLWPTIWFNC-UHFFFAOYSA-N 430.892 2.303 10 20 IECD CC(C)CC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC1 793717582 HSSYXOSXRDPSCW-IBGZPJMESA-N 428.577 2.337 10 20 IECD CC(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793723901 OGQDACDPMHAGLD-WOJBJXKFSA-N 428.577 2.289 10 20 IECD COc1ccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c(O)c1 794377047 FFVWZXJXIGCLBQ-GJZGRUSLSA-N 434.514 2.129 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H](CO)[C@H]1CCOC1 797762239 JVKMVSCNVNFGOM-BHJNDZAMSA-N 440.612 2.491 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](Cn2ccccc2=O)c2ccccc2)c1 800688024 SUYBICLEAQDQLB-GOSISDBHSA-N 427.482 2.097 10 20 IECD Cc1cccc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)c1 803299455 KLYCQTAVSRPFNS-HXUWFJFHSA-N 436.556 2.358 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803305708 OGOSSJALSUEQLD-MJGOQNOKSA-N 445.560 2.138 10 20 IECD C[C@@H]1C[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCN1C 803451186 GCPLZKSHJGBOGF-CRAIPNDOSA-N 438.519 2.314 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@H]1CCO 803451722 UNYUMMABIHYASY-KBXCAEBGSA-N 425.476 2.040 10 20 IECD CC[C@@H]1Oc2cc([C@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc2NC1=O 803662832 HKEWMNMJQKFETC-DJJJIMSYSA-N 442.491 2.495 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CCOC)[C@@H]3CC[C@@H](C)C3)cc2F)CC1 805006979 BNRNHACHRNYNQU-UYAOXDASSA-N 448.583 2.247 10 20 IECD CCOC(=O)C[C@H](OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(C)=O 805337402 PMPFBQKGFCPWHT-INIZCTEOSA-N 439.376 2.438 10 20 IECD CNC(=O)CC[C@H]1CCCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 806333091 FJWCOGJMMNAQKY-OAQYLSRUSA-N 445.608 2.298 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 808345706 GGMPJAXELVQWEU-DHIUTWEWSA-N 444.620 2.374 10 20 IECD CC(=O)N1CCN(C(=O)[C@@H](OC(=O)c2cc(C)n(-c3ccccn3)c2C)C(C)C)CC1 914903345 KRXMKQUNIWEJNQ-NRFANRHFSA-N 426.517 2.361 10 20 IECD CCOc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C(=O)O 915215963 DXVCVORODPQCPC-UHFFFAOYSA-N 434.514 2.441 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnc(N)n3C3CC3)cc2F)C[C@@H](C)O1 917212601 MNJIFVQFOFNBDT-BETUJISGSA-N 434.541 2.356 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc(C(N)=O)c3)cc2F)C[C@H](C)O1 918023465 PPQVBLMDPLHSMQ-IRXDYDNUSA-N 442.535 2.286 10 20 IECD CCCNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920924468 BWVOLCSUTBXFRO-QGZVFWFLSA-N 438.528 2.479 10 20 IECD CC1(C)CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)C1 1791345261 PRAROCIXSYUEOZ-USDOSNGCSA-N 444.528 2.233 10 20 IECD COc1ncc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1792454274 XUMZFRIDVFKLMY-BTTYYORXSA-N 432.864 2.115 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728120 JEULFTXVVHVDJE-ZFWWWQNUSA-N 445.545 2.048 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1842195901 DVAHDMFCIDNOLF-UHFFFAOYSA-N 438.509 2.367 10 20 IECD CCc1ncccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842222347 HOLDKJXPMFPDAJ-UHFFFAOYSA-N 431.496 2.254 10 20 IECD COC(=O)CCCCCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846429294 QMAAYDXKSWTGRD-PKNBQFBNSA-N 446.500 2.144 10 20 IECD O=C(Cc1cccc(Cl)n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033765 CIEYTBPDWMJUOW-SOFGYWHQSA-N 443.887 2.311 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nc4sccc4c(=O)n3C)CC2)cc1 23473841 SOPHBUQNGBNKCW-UHFFFAOYSA-N 430.555 2.445 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 728291584 KJQIQYNHFLGKGT-UHFFFAOYSA-N 449.485 2.023 10 20 IECD O=C(NCCCSc1nccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1 733974852 MZXSGQCDOJMXSX-UHFFFAOYSA-N 427.573 2.076 10 20 IECD COC(=O)c1c(C)cccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740609361 ITGXQQQBKQNEGE-UHFFFAOYSA-N 431.514 2.284 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)CC2)cc1 746339808 REDVHJZRGFEPKZ-KRWDZBQOSA-N 428.455 2.470 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O 746340295 YEMZYXSQVHRFIU-KRWDZBQOSA-N 428.455 2.218 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)c1 749154618 OFJWCGUNFHFVLJ-UHFFFAOYSA-N 442.515 2.434 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@H]3OCCc4ccccc43)CC2)cc1 754026613 XCKPDAKFYAIHAQ-WIOPSUGQSA-N 425.573 2.424 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(S(N)(=O)=O)nc3)c2C)cc1 762872898 DLDUGOJHHLBZCP-UHFFFAOYSA-N 427.482 2.485 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1 771054964 WRFORQWBRFLQRB-YJBOKZPZSA-N 443.997 2.188 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1cnn(CC(F)(F)F)c1 772715391 ZRJXJRUKXLYCFX-UHFFFAOYSA-N 432.468 2.133 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@H](c1ccco1)N1CCCC1 774865142 HCVRFYIIMOGIAB-HXUWFJFHSA-N 442.585 2.402 10 20 IECD O=C(NCc1cccc(O)n1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 777457795 BTZARGPOZFVFQV-UHFFFAOYSA-N 444.425 2.132 10 20 IECD O=C1N[C@H](CC(F)F)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777615612 CXYVEEGQYLMRHC-OAHLLOKOSA-N 434.422 2.018 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2c(OC)ccc(S(N)(=O)=O)c2OC)cc1F 777858730 CCRTTXDTTIERIX-UHFFFAOYSA-N 439.509 2.267 10 20 IECD COC(=O)c1cc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1F 778223664 NVESXOHBCPCMOE-KTKRTIGZSA-N 441.459 2.464 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 781864160 KHIDPPJFCHZLFX-UHFFFAOYSA-N 434.879 2.219 10 20 IECD Cc1nc(COc2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)no1 785304578 QDSKRHSRCJDUBK-GFCCVEGCSA-N 426.429 2.054 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 787196949 ILNSWOMNMLNRFM-QZTJIDSGSA-N 439.560 2.036 10 20 IECD C[C@H]1C[C@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 787704849 HCPSAHOWXCTBFJ-OALUTQOASA-N 432.634 2.340 10 20 IECD NC(=O)[C@H]1CCC[C@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 787820719 IHOGWZWQBZDHIG-KBPBESRZSA-N 434.448 2.235 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](c3ccnn3C)C(C)C)CC2)cc1 788097996 RVDOQKMRLOTJCM-OAQYLSRUSA-N 428.581 2.290 10 20 IECD CCOc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)n1 788928698 BOTNHYGDXKPDGA-UHFFFAOYSA-N 437.544 2.046 10 20 IECD CCc1nsc(N2CCCN(C(=O)C(=O)NCc3ccc(N(CC)CC)cc3)CC2)n1 788928976 QKPOLJHEPUSUNC-UHFFFAOYSA-N 444.605 2.302 10 20 IECD Cc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801394 SPYGIBZRWAAHFU-QFIPXVFZSA-N 441.503 2.187 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 791248931 AUFZGJHSOJZYMY-QHCPKHFHSA-N 444.532 2.096 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@]4(CCO[C@@H]4C)C3)cc2)CC1 805026023 ZCPHZHMKFNRFPU-XLNZFTOWSA-N 429.561 2.334 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3cccnc3)cc2F)C[C@@H](C)O1 805644426 ZWFIFVYAYYGSPN-IAGOWNOFSA-N 445.491 2.211 10 20 IECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 807095481 AXSGUFPFURYKJN-GOSISDBHSA-N 440.544 2.090 10 20 IECD CCCCN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)[C@@H]1CCS(=O)(=O)C1 835861241 FKUNSVPMNPXQMO-OAQYLSRUSA-N 438.590 2.216 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)C(=O)CC3)cc2)C1 917834182 YEORIBWLCARCBH-SFHVURJKSA-N 433.512 2.188 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccccc1Cn1cncn1 918440249 PDZDGJVTPFIRAI-UHFFFAOYSA-N 436.541 2.135 10 20 IECD O=C(COC(=O)c1ccc(-n2cccn2)cc1)NCc1ccc(N2CCOCC2)c(F)c1 918898021 FJCZSHDFASDANI-UHFFFAOYSA-N 438.459 2.321 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cc(Cl)c2c(c1)OCCO2 1323860233 QOXKNQZAFSEDGI-HNNXBMFYSA-N 435.860 2.356 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3nc(S(C)(=O)=O)n4ccccc34)CC2)cc1 1324297919 LUUOSOSXCHVOCV-UHFFFAOYSA-N 428.514 2.099 10 20 IECD Cc1nn(C)cc1CCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1324801773 LKJVWQVOIWRMKD-IYBDPMFKSA-N 446.523 2.273 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cn1)C1=NN(c2ccccc2)C(=O)C1 1795295519 WDSSHFDHKANOKQ-VBUUOAMHSA-N 435.459 2.265 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)n1cccc1 1796935665 XLIBPZMEGKDMGL-XEYPJELSSA-N 433.512 2.480 10 20 IECD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cs1 1799770831 MLVPZIAHNLOBPR-DRXBFXEBSA-N 437.905 2.033 10 20 IECD C[C@H](Nc1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800717841 AEUDWGXRTVSBDO-MHEUCROKSA-N 445.907 2.294 10 20 IECD CC(C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803238581 ORPIMZGYMWYPJY-ZMYBRWDISA-N 447.919 2.483 10 20 IECD CC[C@H](NC)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811804240 SXVMCYLEQNZZNX-DKSSEZFCSA-N 446.935 2.464 10 20 IECD CC(C)(C)CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814186248 NAYOARWVAVIIIG-HNAYVOBHSA-N 448.614 2.384 10 20 IECD O=C1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1826662598 JZFOFLZDIHXTMP-SJORKVTESA-N 449.935 2.263 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CNC(=O)N(C)C)C2)cc1 1841135014 KTORYZGCPRNGFJ-UHFFFAOYSA-N 437.544 2.182 10 20 IECD Cc1cccc(CCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1841943595 QNKUAZQXABYAHO-JXMROGBWSA-N 437.496 2.356 10 20 IECD O=C(/C=C/c1ccc(O)cc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251137 ZFQOLWTVKKCTOU-HWKANZROSA-N 429.860 2.382 10 20 IECD COc1cc(F)cc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1846261589 UWSDAAJKHSOMPT-ONEGZZNKSA-N 427.432 2.171 10 20 IECD COc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)ccc1OS(=O)(=O)c1ccc(C)cc1 16406179 UCTYRTVQGBOGSR-UHFFFAOYSA-N 444.465 2.205 10 20 IECD Cc1c(CNC(=O)C(=O)NCCc2cc(F)cc3c2OCOC3)n(C)c2ccccc12 563300259 HHHFXQYFCJVHOD-UHFFFAOYSA-N 425.460 2.467 10 20 IECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 730680822 VGZFGRWYQJDITE-UHFFFAOYSA-N 449.454 2.198 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 734407157 CKNXBDUFMVXTJC-UHFFFAOYSA-N 435.521 2.151 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CSCCOc1ccc(S(N)(=O)=O)cc1 734468471 WVFBGHPUBILRPO-UHFFFAOYSA-N 437.587 2.137 10 20 IECD COc1ccnc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 734910175 VGXPUMJLLLRSQX-UHFFFAOYSA-N 443.481 2.185 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN(c4ccc(C(N)=O)cc4)CC3)CC2)cc1 735581106 XPYUQTQRLWUPGO-UHFFFAOYSA-N 437.544 2.295 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1F 742071123 GNXBZFRLTIUPAD-CQSZACIVSA-N 439.557 2.005 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 742805526 KTJXITWLOQKUMF-GFCCVEGCSA-N 445.513 2.325 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br 750029015 AOWZTVDHRGEWPS-NSHDSACASA-N 445.270 2.433 10 20 IECD CN(C)CCOc1cc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccn1 762677751 JUWJOAQLSCALRL-UHFFFAOYSA-N 441.576 2.230 10 20 IECD C[C@@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 768243985 SRBIPLJAWBUHBE-RHSMWYFYSA-N 431.455 2.223 10 20 IECD O=C1c2ccccc2C(=O)N1C[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 769534815 YMIIFROLYZOHKA-SFHVURJKSA-N 439.487 2.159 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c1 771019888 GAWYUHRXQQQGAC-NSHDSACASA-N 432.420 2.403 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(Cc2ccccn2)CC1 771767636 CMZHLPUXDRYNKE-UHFFFAOYSA-N 427.524 2.209 10 20 IECD COc1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 773243908 MLAIPBQVDCIALH-OAHLLOKOSA-N 444.919 2.305 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cnc2ccc(Br)cc2c1=O 773751243 OBEXSUMGGQKJEV-LLVKDONJSA-N 432.274 2.318 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1 775456003 ZWHVHNIPYFWOAM-HOCLYGCPSA-N 428.327 2.322 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC3(CC2)CNC(=O)O3)c([N+](=O)[O-])c1Br 780659849 XQZIZBKJIOYJJG-UHFFFAOYSA-N 431.199 2.353 10 20 IECD C[C@@H]1C(=O)CC[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 781314744 WFLRRTFFCJWAMZ-WBVHZDCISA-N 434.508 2.463 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H](CO)C1CCOCC1 782498230 CLOHVVPIUOPAOC-SFHVURJKSA-N 431.455 2.129 10 20 IECD O=C(NCCSCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785388821 WOVUNFJEKLJUEO-UHFFFAOYSA-N 431.533 2.328 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3c(C)cccc3C)CC2)cc1 785526680 HCFOEHFGVFFHAU-UHFFFAOYSA-N 438.572 2.257 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccc(C)cc4)C3)cc2)CC1 786262738 PEVHUBQNTPYKII-QHCPKHFHSA-N 448.567 2.328 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N2CCOCC2)c1 787611850 HVXIVQMNFHDOKJ-HSZRJFAPSA-N 438.572 2.209 10 20 IECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 788009519 ZRLAIMKOUVCVTC-UHFFFAOYSA-N 428.577 2.229 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)ccc1O 790406025 APQNELCUGOMHMT-UHFFFAOYSA-N 440.421 2.042 10 20 IECD CC(C)Oc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccn1 803299417 LBRNDGOKSXZSIL-KRWDZBQOSA-N 426.517 2.199 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@@H](C)c3ccccc3F)CC2)cc1 803747390 QTOSOUMSPNUKSW-SFHVURJKSA-N 442.535 2.292 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3nccs3)CC2)cc1F 804851557 GUHHIDLMXIPGEL-UHFFFAOYSA-N 433.553 2.484 10 20 IECD CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806280706 RYQBNQQAHRTROZ-ZDUSSCGKSA-N 428.580 2.209 10 20 IECD CCC(O)(CC)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771184 SHRXICNBVPEJQD-HNNXBMFYSA-N 427.492 2.430 10 20 IECD COCC1(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCOCC1 811434245 MKZBOZHKCRFOPK-UHFFFAOYSA-N 437.448 2.387 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@H](CS(C)(=O)=O)C2)c([N+](=O)[O-])c1Br 813627402 JQDFXFFSKKYIHB-QMMMGPOBSA-N 438.256 2.145 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]4C[C@H]4N3C(=O)OC(C)(C)C)cc2)CC1 816379898 YZAHUPORSCZJBT-NRSPTQNISA-N 442.560 2.369 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 915083687 BPNKIBCFFFDVDW-UHFFFAOYSA-N 429.542 2.474 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1 918311496 SASMCMQRERJBKA-UHFFFAOYSA-N 436.512 2.013 10 20 IECD C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338148 VHTNHSMIOSESGI-QGZVFWFLSA-N 428.554 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 920252024 FRPPMIJVUSXWOO-SSSWZJSRSA-N 448.567 2.291 10 20 IECD Cc1cc(C(=O)CN(C)C2CC2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 920405777 GHTIXXZMTSQFKV-UHFFFAOYSA-N 431.558 2.392 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)cc1 920482564 SUDLGZKMZPJXMU-UHFFFAOYSA-N 428.488 2.351 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 1319382193 QAVQOPZTGIKKMT-IBGZPJMESA-N 433.549 2.453 10 20 IECD Cn1cnc(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)c1 1792314126 VDCSGHITNCNEJI-UHFFFAOYSA-N 443.554 2.028 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1ccccc1 1795817054 XPIAHWZKWNCYOY-JEWCPBCISA-N 438.480 2.188 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccc2nccn12 1804289276 AILFYAHQPWOEQY-FJXIAYRNSA-N 448.479 2.416 10 20 IECD COC(C)(C)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1804971107 QOPPWYKTTTZYSN-SOFGYWHQSA-N 432.517 2.473 10 20 IECD CC[C@H](NC)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708527 FFQQNTQUKHYTLA-PWSUYJOCSA-N 438.937 2.432 10 20 IECD Cn1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)n1 1830735580 QWVWHMIIRKMQFA-INIZCTEOSA-N 447.923 2.427 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(F)cc3F)CC2)cc1 12069017 BYPTWHKMXJXXOD-UHFFFAOYSA-N 425.501 2.464 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(OC)c(S(=O)(=O)N(C)C)c3)CC2)cc1 110358165 UYQUHRVSERVRBY-UHFFFAOYSA-N 447.557 2.353 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1 725904404 XGVVBOPHRKSJHF-UHFFFAOYSA-N 433.486 2.111 10 20 IECD Fc1cc(CNC(=S)NC2CCOCC2)ccc1N1CCN(c2ncccn2)CC1 727783107 XZZBGXABOQFLGZ-UHFFFAOYSA-N 430.553 2.085 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1OC 727946905 HJUFWYDATLBMPO-HNNXBMFYSA-N 443.500 2.365 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)NCc3ccccc3)cc2F)CC1 730124942 IVFCVKWYLHZPAU-UHFFFAOYSA-N 441.551 2.473 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(N4CCNC(=O)C4)cc3)cc2)CC1 731131098 GEUKFVPKZXNRBI-UHFFFAOYSA-N 449.555 2.114 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4ccc(F)cc4)ccc3=O)cc2)C1 731577332 FABDCFNPXXHKQE-KRWDZBQOSA-N 449.486 2.003 10 20 IECD Cc1cc(C(=O)COC(=O)CC2CCOCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 735357250 IJZLCBQEMXQLBB-UHFFFAOYSA-N 434.514 2.284 10 20 IECD NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)cc1 735509598 CMLSVLITMOZBLQ-UHFFFAOYSA-N 439.585 2.371 10 20 IECD O=C(Cc1ccn(-c2ccc(F)cc2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742050747 MHLVMCMKLRLFLP-UHFFFAOYSA-N 442.516 2.105 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(N2CCC(O)CC2)cc1 746162454 IESOJVUPQZFHER-UHFFFAOYSA-N 429.542 2.135 10 20 IECD CCc1nn(C)c(CC)c1S(=O)(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 754006283 QHKSOPYWHSHXEN-UHFFFAOYSA-N 437.585 2.304 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](CO)C[C@@H](O)c3ccccc3)cc2F)CC1 754641091 QAOCMFSROURGTB-NFBKMPQASA-N 444.551 2.251 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1 761637456 KUIYLFFMJFIQJL-UHFFFAOYSA-N 438.484 2.276 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)n(C)c(=O)n4C)c2)CC1 768014927 CGESHDNZWWTKJJ-UHFFFAOYSA-N 443.573 2.208 10 20 IECD C[C@H]1CCC[C@@H](C)[C@]12NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 772876244 OVONIUUXGKMQSR-MICWEPACSA-N 446.523 2.025 10 20 IECD C[C@@H](NC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccc(N(C)C)cc1 773995240 SAHRUMRMGVSSBH-OAHLLOKOSA-N 435.521 2.404 10 20 IECD O=C(NCCc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 775130075 PELFSVAHJKJBOL-UHFFFAOYSA-N 433.911 2.415 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4CS3(=O)=O)cc2F)C[C@@H](C)O1 775683049 PXJPQVMIKLNEOM-IYBDPMFKSA-N 447.532 2.406 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nn1-c1cccc(F)c1 776492855 WSFUIRPWFSFIPC-UHFFFAOYSA-N 437.475 2.411 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@]4(C3)C(=O)Nc3ccccc34)cc2)C1 779537354 RHJMHNUHTJWQRT-BVZFJXPGSA-N 447.539 2.194 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(OC)c1 782104351 CVDXDBHNCHFIHZ-UHFFFAOYSA-N 443.525 2.290 10 20 IECD C[C@H](NC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1 784362855 WFEXBLPSOZUJCS-YUXAGFNASA-N 427.545 2.142 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccc(C)cc4)C3)cc2)CC1 786262737 PEVHUBQNTPYKII-HSZRJFAPSA-N 448.567 2.328 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 786668488 VNVJXACZBFCLKC-INIZCTEOSA-N 427.501 2.034 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C4CCOCC4)C3)cc2F)C[C@@H](C)O1 789823726 FNHNKYDVDSQORR-FUHIMQAGSA-N 447.551 2.331 10 20 IECD Cc1nc2c(s1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CCC2 789833709 IPURYTJQOLBZGB-GOSISDBHSA-N 446.548 2.362 10 20 IECD COc1ccc(CNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c(O)c1 792998958 VYZBHMWDRUYJGJ-LJQANCHMSA-N 426.517 2.098 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 793940319 ZPEHOVASBYLTSW-IAGOWNOFSA-N 433.549 2.304 10 20 IECD Cc1cc(C(=O)CN2C[C@@H](N3CCCC3)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796427488 DHXWITJVZLLPIN-JXFKEZNVSA-N 444.601 2.483 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 797611291 OADYGJGVEOYCMU-OAHLLOKOSA-N 428.489 2.121 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@@H]3c3ccc(C)o3)CC2)cc1 804317412 CCMQQMLWQUAFCH-HXUWFJFHSA-N 427.501 2.282 10 20 IECD CCO[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771001 QRGAYQSPFUYLDO-YJBOKZPZSA-N 425.476 2.401 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F 810365130 OIMMEOYFWOIZGM-UHFFFAOYSA-N 434.443 2.059 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C34CCC(C(=O)OC)(CC3)CC4)nc12 814590381 LMWRXEFPILHPOT-UHFFFAOYSA-N 431.445 2.168 10 20 IECD O=C(NCCCN1CCOCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 915880439 ALTPHRWEGZFRMU-UHFFFAOYSA-N 430.471 2.064 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(-n4nccn4)nc3)CC2)cc1 916197114 UJVOBGKJRUNACU-UHFFFAOYSA-N 436.520 2.005 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917236556 DADBADBOFIWSHP-UHFFFAOYSA-N 447.419 2.052 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(O)c4)CC3)cc2)C1 918118222 PIASOVYXGRWDFI-LJQANCHMSA-N 437.544 2.126 10 20 IECD C[C@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1 920882301 WODHNHPCFZBGSE-AWEZNQCLSA-N 444.513 2.500 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)CC2)cc1 1321272523 BSCSLSULQYHZRZ-UHFFFAOYSA-N 435.521 2.437 10 20 IECD C[C@]1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CC1(F)F 1782007078 BAEOHUWDQFGNLP-MSOLQXFVSA-N 430.835 2.240 10 20 IECD O=C(CC[C@H]1CCOC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007219 DXKFWUPIJNRPCX-LHSJRXKWSA-N 438.908 2.011 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)nc1)c1cc(O)nc(O)c1 1795174155 LMMSTCNHXJCRRV-BTTYYORXSA-N 436.390 2.472 10 20 IECD O=C(Cc1ccccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795224876 QCBYFXBLIMJITM-YVWYUNDQSA-N 448.878 2.336 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H]2[C@H]4COC[C@H]42)C3)cc1 1799622638 HODWUOHVQWPLEP-XZUXCOOYSA-N 449.551 2.190 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c(C)c1 1804336103 VZVIZZOPGOTUDQ-QDMKHBRRSA-N 447.582 2.116 10 20 IECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nc1 1807990121 DZMVIVOSCNMWEU-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CC(=O)Nc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)o1 1810546471 GSYLOLXIFUPRKX-UHFFFAOYSA-N 442.472 2.203 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844535 CJDTZBUIAZZVHI-JXFKEZNVSA-N 437.456 2.255 10 20 IECD CO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1826163740 PUYVUTRJSIMJBG-WCBMZHEXSA-N 425.894 2.468 10 20 IECD CCCC(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1834443956 KGVMRKYBZNXSKC-UHFFFAOYSA-N 439.560 2.151 10 20 IECD C[C@H]1CCc2c(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)n[nH]c21 1847038018 YQGFGJLVTUIBBW-LJLILKBBSA-N 438.484 2.107 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 24088645 SNDCZTYUMVILMC-UHFFFAOYSA-N 431.558 2.041 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)CC2)cc1 110356809 HZNJJBHPXYMLQH-RUZDIDTESA-N 448.523 2.174 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc(C(F)(F)F)cnc1O 726287234 AQCPTKHTLKWYHA-UHFFFAOYSA-N 442.369 2.037 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CC2)cc1 726562371 LLFHVONJGRQQFX-KRWDZBQOSA-N 431.558 2.456 10 20 IECD CCN1CCN(c2ccc(CNc3cc(C)nc4nc(C(=O)OC)nn34)cc2F)CC1 730108090 FYWXRPDBDFLKFV-UHFFFAOYSA-N 427.484 2.112 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nnc2n(C)c(=O)c3ccccc3n12 731844500 DHCAHTIJMIOQDB-UHFFFAOYSA-N 441.875 2.115 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 734073650 TZCWYLPCXWOSQB-KBPBESRZSA-N 431.464 2.408 10 20 IECD C[S@@](=O)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 735045522 HSWNWQSDVFNBID-AFBAXIAKSA-N 447.401 2.145 10 20 IECD C[C@](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)(C(N)=O)c1ccccc1 744394633 LFJIQDGJDFMVST-RUZDIDTESA-N 427.460 2.391 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(O[C@@H]4CCOC4)CC3)CC2)cc1 748615669 JGKUVNVCAGXFQD-HSZRJFAPSA-N 446.592 2.187 10 20 IECD O=C(Cn1c(-c2ccncc2)noc1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749357442 FJBKGZVGSQGLMG-UHFFFAOYSA-N 426.388 2.312 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN3Cc3ccc(F)cc3)nc12 750505879 ZJHRTPZIBAQGJR-SFHVURJKSA-N 442.447 2.459 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CN(C)C(=O)OCc3ccccc3)CC2)cc1 756475174 YHCQIISOASAAEJ-UHFFFAOYSA-N 440.544 2.202 10 20 IECD Cc1cc(S(C)(=O)=O)cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1C 758668598 UYHVBOVQKKTIKL-UHFFFAOYSA-N 436.555 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@](C)(O)CN3C(=O)C(C)(C)c4ccccc43)CC2)cc1 760053998 RIRZERBEZZUVMZ-VWLOTQADSA-N 437.540 2.419 10 20 IECD COc1cc(Cl)cc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1O 761200924 AODZUZCNOZWXPH-UHFFFAOYSA-N 438.933 2.416 10 20 IECD Cn1nc2c(c1NC(=O)C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CCC2 761941011 PXJOFJIQKUVGBR-UHFFFAOYSA-N 433.459 2.234 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCCC[C@H]3N3CCOCC3)cc2F)CC1 763658711 XMKPCKNYIJFQMT-FYYLOGMGSA-N 447.599 2.410 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@H]1CCCS1(=O)=O 766349329 GERRHXNRUAAYSY-PCRWRXJSSA-N 444.625 2.423 10 20 IECD O=S(=O)(c1ccc2ccccc2c1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768438015 NYCMDALWWRQTNG-JOCHJYFZSA-N 440.521 2.478 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCC(=O)N2CCN(c3cccc(Cl)c3)CC2)c1O 775048230 IHDITHHAEMLXGG-UHFFFAOYSA-N 434.880 2.401 10 20 IECD O=C(Nc1cnc2c(c1)COCC2)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 777256226 VRUPPWKUAPMHFB-HNNXBMFYSA-N 446.454 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CO)c3c(F)cccc3F)CC2)cc1 778423722 VUMQSCQORPHGML-GDCKJWNLSA-N 445.466 2.028 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3cccc(Cl)c3)CC2)cc1 779219625 VZODXCOHHUBIMD-NRFANRHFSA-N 446.979 2.402 10 20 IECD CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785303852 MANRTRTUGJQRSM-AWEZNQCLSA-N 429.473 2.418 10 20 IECD CCc1nc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)nn1-c1ccccc1 786257510 QDHJDDHBUSBNLN-UHFFFAOYSA-N 432.528 2.428 10 20 IECD COC(=O)c1cn(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c2ccccc12 786257778 SWSNQQNQFMHMSE-UHFFFAOYSA-N 448.523 2.413 10 20 IECD COC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789948565 CWPHMSCBIGJTNE-HNNXBMFYSA-N 443.466 2.043 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(OCCS(=O)(=O)CC)cc1 790411945 XCZOWJAXDFXHSW-UHFFFAOYSA-N 429.516 2.405 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 791248928 AUFZGJHSOJZYMY-HSZRJFAPSA-N 444.532 2.096 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nc(Br)cs3)CC2)cc1 792330730 SAEWPZCLWCOLRP-UHFFFAOYSA-N 425.352 2.466 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCO)Cc3cccnc3Cl)CC2)cc1 792946572 QLUJICYEJHSGIY-UHFFFAOYSA-N 447.967 2.070 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccsc3)cc2)C1 793723951 OTWNHUHDVNFRCY-XLIONFOSSA-N 440.569 2.430 10 20 IECD COc1c(C)cnc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 803304360 ATBQVYOHSVSDBA-GOSISDBHSA-N 440.544 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@@H]3C[C@@H](C)O)CC2)cc1 804449360 YYRVCTVVWJPPOB-KGWQINORSA-N 429.561 2.442 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCOc3ccc(F)cc3F)CC2)cc1 804913348 JWKYOTIQZYLTNH-UHFFFAOYSA-N 433.455 2.207 10 20 IECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 806180111 KAHKKRGNUVNIEA-VQTJNVASSA-N 428.577 2.399 10 20 IECD COc1ccc(O)c(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)c1 806810988 QHWQJFAAHXIKBX-UHFFFAOYSA-N 427.910 2.140 10 20 IECD COCCN(C)CCN1C[C@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1=O 808269633 LDBSXKVSXHGPAA-LJQANCHMSA-N 430.524 2.142 10 20 IECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1(C)C 808854650 GTSUVUDVQDDPBQ-PXDATVDWSA-N 442.604 2.155 10 20 IECD O=C(Cn1cc(Br)cc(F)c1=O)NCc1ccc(N2CCOCC2)c(F)c1 809971978 AYPFNFZSEFHQPI-UHFFFAOYSA-N 442.260 2.042 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccc(CC(N)=O)cc3)cc2F)C[C@@H](C)O1 811864294 VELCHNXVLVMXNS-HZPDHXFCSA-N 428.508 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)nc4c3c(C)nn4C)CC2)cc1 899622482 JTPNSSNLJPXBNE-UHFFFAOYSA-N 437.500 2.099 10 20 IECD Cc1cc(C(=O)COC(=O)CN2CCCNC2=O)c(C)n1-c1ccc2c(c1)OCCO2 915432406 DBBSLXQIELEHSM-UHFFFAOYSA-N 427.457 2.007 10 20 IECD CCCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284904 ULZPWLLVDCKVST-UHFFFAOYSA-N 443.475 2.484 10 20 IECD Cc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782003707 LMBKYAGEZVCOGT-QFIPXVFZSA-N 445.903 2.141 10 20 IECD Cc1onc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1C 1782004542 ZVXCZYXTNMFSCF-FQEVSTJZSA-N 435.864 2.113 10 20 IECD O=C(/C=C/C1CCCC1)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510186 QSLOAWHHLLNWFR-HYIAZSBSSA-N 442.512 2.393 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1 1803651599 ANEBDZYVDYDCOH-DJUHHCJWSA-N 426.448 2.100 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cc[nH]n1 1815372193 QKMRPVIERTZROI-SFHVURJKSA-N 446.471 2.232 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cncc(F)c1)CC2)c1cc(O)nc(O)c1 1816722648 TUUUOAVYMQOHAS-GFCCVEGCSA-N 429.433 2.023 10 20 IECD Cc1onc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1C 1836987987 VVLNPGVPWROVIC-UHFFFAOYSA-N 444.488 2.024 10 20 IECD O=C(c1cc2cnccc2[nH]1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037684 QPCYAALWABBVOZ-HWKANZROSA-N 434.452 2.210 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)Nc3cc(C(=O)OC)ccc3C)nnc2n1 104568357 YWPKURXYGVATIX-UHFFFAOYSA-N 444.521 2.209 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cccc(S(=O)(=O)NC4CC4)c3)CC2)cc1 108431832 AZRJPPUFEFDDBK-UHFFFAOYSA-N 429.542 2.488 10 20 IECD CCOC(=O)[C@H]1CCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 727227679 FWYNBBIDZYUEBM-HXUWFJFHSA-N 447.557 2.342 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCCC4=O)C3)cc2)C1 732887254 IMFMHTAFSMJOCB-TZIWHRDSSA-N 441.576 2.075 10 20 IECD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCCSc1nccs1 733974853 NEHRZGWGYILQAW-UHFFFAOYSA-N 447.629 2.067 10 20 IECD Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 737117962 WDXZBIZHDAPXCV-UHFFFAOYSA-N 438.528 2.131 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 742805073 FXTMALQCLHPEIV-HZPDHXFCSA-N 445.532 2.435 10 20 IECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2c(O)ccc3c2CCCC3)c1 743718737 KNLXEUFKPVIPNV-UHFFFAOYSA-N 432.542 2.434 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H](C(F)(F)F)O1 745690538 CTANMLRPRICVLV-FRFSOERESA-N 428.455 2.250 10 20 IECD Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 749627688 BVFXZPWJASACDX-UHFFFAOYSA-N 435.484 2.479 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2COC(=O)NC2CCCC2)c1 753007196 OWWGVHKWLHFTOF-MRXNPFEDSA-N 439.534 2.427 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 755301990 MPIJBSKESHXSNJ-JTQLQIEISA-N 425.429 2.075 10 20 IECD COc1cc(N2CCN(C[C@@H](O)COc3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759873647 XWDGMFIQOSWJDX-GOSISDBHSA-N 447.488 2.183 10 20 IECD COC(=O)[C@H]1CN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 778270965 CIHBJIOTTNJUEJ-VIOKTNGOSA-N 449.507 2.203 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCO4)cc2F)C[C@@H](C)O1 782776911 VIBSTYBSHGUIDE-OKILXGFUSA-N 429.448 2.423 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789815894 BIPPXZUAHHSJKQ-JENIJYKNSA-N 434.556 2.046 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 793808972 CQYSCEBMPIGNRA-NTKDMRAZSA-N 430.593 2.361 10 20 IECD Cn1cc2c(n1)CCC[C@@H]2C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 798405640 TWRRARLYBLQDIM-SFHVURJKSA-N 449.534 2.412 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCN(C)C(C)(C)C3)cc2F)C[C@H](C)O1 799364899 PZFCEWJIFJAGKR-ROUUACIJSA-N 435.588 2.265 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccnc3c2nnn3C)NC(=O)OC(C)(C)C)cc1 801162164 NOWYFSHLACFVAR-QGZVFWFLSA-N 439.520 2.425 10 20 IECD C[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)(C)CN(C)C 803449427 ALRWBBYJCSKNEW-OAHLLOKOSA-N 440.535 2.466 10 20 IECD CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 803661583 GYGIWKVTEZRIHH-AWEZNQCLSA-N 435.500 2.283 10 20 IECD C[C@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803689698 XCRHLASVWIMWGL-MRXNPFEDSA-N 427.574 2.047 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCO[C@@H](C(=O)OC(C)(C)C)C3)cc2)CC1 805026425 NEETZSSSKIDMGT-HXUWFJFHSA-N 445.560 2.108 10 20 IECD COC(=O)CNS(=O)(=O)c1cccc(NCc2cc(Br)ccc2O)c1 809683228 VVWGSEIKUCETSS-UHFFFAOYSA-N 429.292 2.218 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnc(NC(=O)C(C)C)c3)CC2)cc1 815480486 XBZPZWJGYLNCIC-UHFFFAOYSA-N 440.500 2.190 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)cc2)C1 917833023 KNRJZJZUWAYUQI-LEWJYISDSA-N 434.540 2.053 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(S(N)(=O)=O)c1 918196736 DDLRKLHDCAHSCR-INIZCTEOSA-N 446.573 2.103 10 20 IECD CCCOc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918337660 FFVMCWAQWJRPQU-UHFFFAOYSA-N 432.542 2.405 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 919812023 YJQYYIHLIKOXAD-UHFFFAOYSA-N 431.514 2.060 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC(=O)N(Cc2ccccc2)C1 919970631 PRZRUMZSWOFDDY-IBGZPJMESA-N 425.504 2.452 10 20 IECD CCn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920196490 WSMBDMLTVXBIPI-UHFFFAOYSA-N 434.500 2.057 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)C1CC3(CCC3)C1)CCO2 1785510506 NEVCWNXFXAFCJF-ISTCRNMPSA-N 442.512 2.227 10 20 IECD COCC1(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)CC1 1792314431 AWVRODBYRYZUNL-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)s1 1794550372 ZKQRFMKTMJNDTD-JJLQDPRZSA-N 437.905 2.033 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CC(C)(C)O)cc1 1795367618 UWFRLYQMMBDDHO-JHDGKUDLSA-N 439.556 2.458 10 20 IECD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cc1 1816727257 JORZRVPPHXDANT-CYBMUJFWSA-N 440.481 2.498 10 20 IECD COc1cc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc(S(C)(=O)=O)c1 501436467 OLTHULXXPFBGBD-UHFFFAOYSA-N 429.498 2.154 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 726568170 YGJMKJDGLGCMNJ-UHFFFAOYSA-N 445.513 2.325 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)c4cc(C)oc4C)CC3)nc12 727437109 NAMQKMFNNSEMMX-UHFFFAOYSA-N 441.488 2.216 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)c2c(F)cccc2F)CC1 727832524 VORJABMLWKKURH-UHFFFAOYSA-N 430.499 2.447 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)C[C@H]3C)CC2)cc1 731669042 BZDICQGMVCXCIQ-GOSISDBHSA-N 432.565 2.285 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(N3CCSCC3)CCCCC2)c1 732678183 UQCUFXXEWJTLJD-UHFFFAOYSA-N 427.592 2.245 10 20 IECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958076 KBNZXMVOVQCCDR-AWEZNQCLSA-N 425.485 2.499 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 752096941 NDNRLXUDVAOKEV-MRXNPFEDSA-N 425.485 2.055 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)cc1F 753856272 CCODRKMTLZARHX-UHFFFAOYSA-N 440.519 2.165 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 754097513 OXZULHNASXANSX-FPOVZHCZSA-N 433.593 2.089 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCN(C)C)Cc3ccco3)CC2)cc1 755967675 QJWAUQAVHCCNRV-UHFFFAOYSA-N 429.565 2.184 10 20 IECD O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 758031746 FGGJCESRHQBNGI-AATRIKPKSA-N 437.475 2.474 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2C1=O 761026694 WMCCGJZKIBSJCD-LJQANCHMSA-N 437.496 2.167 10 20 IECD O=C(O)COc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 761259172 JATDKCWESFYXFG-UHFFFAOYSA-N 440.905 2.119 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913889 BAJZRJQGNFWOOZ-MRXNPFEDSA-N 429.908 2.013 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cn1 771138847 HBSGWQLSDMNWRQ-UHFFFAOYSA-N 428.514 2.491 10 20 IECD CN(CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCSC1 772049493 OVXNVGWJIZDLEO-CQSZACIVSA-N 438.505 2.381 10 20 IECD CN(CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1CCSC1 772059399 HXJYJYRLBSZYNL-HNNXBMFYSA-N 438.505 2.381 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1NS(C)(=O)=O 774187995 HRTINWFEJNLWMJ-UHFFFAOYSA-N 430.530 2.004 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3O)CC2)c1 775645946 BPEMETUCTNUOJM-UHFFFAOYSA-N 430.935 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Oc3ccc4c(c3)NC(=O)CC4)CC2)cc1 781145888 YTHRJXMDXYZGCD-ZHACJKMWSA-N 435.480 2.390 10 20 IECD COCCn1c(N)c(C(=O)CN(C)c2ccc(OCc3ccccc3)cc2)c(O)nc1=O 781964434 UXCNIFTYXRTVOF-UHFFFAOYSA-N 438.484 2.076 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCC(=O)N(C)Cc3ccccc3)cc2)CC1 787754768 NYROJXRTHZUQST-UHFFFAOYSA-N 436.556 2.314 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 789812614 NPYVFESKRJCKCW-FCHUYYIVSA-N 441.503 2.315 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)nc2ccccc12 789859241 BDSQHRRLOKGWNG-UHFFFAOYSA-N 435.553 2.424 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cc3cc(OC)c(O)c(OC)c3)CC2)cc1 789874354 BRCUKNDUYJOJBN-UHFFFAOYSA-N 443.544 2.289 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C3CC3)ccc21 793633113 HXKLUTCNDNRBAJ-SFHVURJKSA-N 430.549 2.105 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Cc2cccc(Br)c2)c1 795468207 ZPDGBLQJBHIISS-UHFFFAOYSA-N 442.287 2.495 10 20 IECD CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688665 YJSKMDAZSPUZKL-UHFFFAOYSA-N 426.536 2.415 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCC[C@@H](C(C)C)C3)CC2)cc1 803751764 WLJFVLIIIOWESD-WOJBJXKFSA-N 430.593 2.264 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CC[C@H](O)C1 807921465 WZKRTVWWQBZYNQ-NRFANRHFSA-N 425.529 2.014 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CC(N)=O)C3)cc2Cl)C1 807955668 ABFKEIFNXKVFGW-WBVHZDCISA-N 434.968 2.307 10 20 IECD CC(=O)C(=O)COC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 808494001 UDWVIMLXKNCENE-UHFFFAOYSA-N 440.817 2.364 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)SCC(=O)N4)CC2)cc1 811297204 ILSYAPSTGUPHED-UHFFFAOYSA-N 441.509 2.245 10 20 IECD COc1ccc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1S(N)(=O)=O 812429672 SCPSXKASEIRIQA-UHFFFAOYSA-N 432.546 2.283 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc4c(c3)NC(=O)CO4)CC2)cc1 915328349 XSKDTEFUNJSHJI-UHFFFAOYSA-N 439.516 2.360 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)COc3ccc4ccc(=O)oc4c3)cc2)C1 917831899 DOYOARZIFNWHRT-GOSISDBHSA-N 435.480 2.190 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)C2CC2)cc1 918456376 JOMZKELGFHEJIA-UHFFFAOYSA-N 445.523 2.487 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(OC)c(OC)c(OC)c3)CC2)cc1 918461513 YEMREAYVMLDUAH-UHFFFAOYSA-N 443.500 2.398 10 20 IECD C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644499 ZRGBYIXTECIQKP-OAHLLOKOSA-N 449.960 2.010 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N3CCC(C(=O)N(C)C(C)C)CC3)CC2)cc1 1319848488 YONSOSXMMWYXAE-UHFFFAOYSA-N 430.593 2.313 10 20 IECD CC/C=C(\C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1827458755 HZZULAORZNLRRW-LLMHMKPQSA-N 438.600 2.272 10 20 IECD CC(C)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1834390569 ODYOHFDQLZIHCG-UHFFFAOYSA-N 439.560 2.007 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)cc1 21412566 MZHIRDSXYDNBTH-UHFFFAOYSA-N 441.576 2.352 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N3CCC[C@H](NC(C)=O)C3)ccc21 728640625 YAIGYULFOTYNAK-IBGZPJMESA-N 429.517 2.188 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)OC)c2C)cc1OC 731179200 XPQRVQIKUPKZKV-UHFFFAOYSA-N 442.515 2.353 10 20 IECD COC(=O)[C@@H](C)[C@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 751034246 YWEYERUHEQZKNA-MBSDFSHPSA-N 425.529 2.484 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](O)CC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 751756124 NMBPWPFYRFOGAS-SFHVURJKSA-N 436.530 2.265 10 20 IECD Cc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1C(=O)O 753778916 QWEPBIMFBWVDDD-UHFFFAOYSA-N 438.527 2.037 10 20 IECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc(F)c1Cl 761260234 QKTOYLQHCZISIA-UHFFFAOYSA-N 428.869 2.492 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(C(=O)NC2CC2)c1 765928514 ZJRNOEYKPYJOIY-UHFFFAOYSA-N 432.274 2.302 10 20 IECD O=C(CN1CCC(O)(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 767850166 QESQWJQAIYBBKH-UHFFFAOYSA-N 427.520 2.262 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1)c1ccc(N2CCOCC2)cc1 774163922 IVFQAGJQPMLVRO-WYIRRWHOSA-N 433.505 2.216 10 20 IECD O=C(NCc1ccc2c(c1)OCO2)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774408808 PGJWZRQPDNDTLH-UHFFFAOYSA-N 447.438 2.418 10 20 IECD O=C(NCc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774410601 YWRYBQGFDPWELU-OAHLLOKOSA-N 447.438 2.418 10 20 IECD C[C@@H](NC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 775710331 WNUIQNOYXLSLQA-FOIQADDNSA-N 437.500 2.156 10 20 IECD CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 776118709 SMENNMKZSLHYLZ-RTWAWAEBSA-N 435.540 2.248 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 776492835 WJCIUYBSOCOALT-CQSZACIVSA-N 431.514 2.496 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 779480737 HZRJDKZDDOMELM-WOJBJXKFSA-N 427.526 2.484 10 20 IECD COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)on1 781276028 GMORFADNHDTRLZ-NSHDSACASA-N 448.387 2.421 10 20 IECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1CC(C)(C)O 782004592 NEKUHJJWFNFZLV-INIZCTEOSA-N 435.524 2.178 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1 785297901 UGSALUYSYPIWBD-HNNXBMFYSA-N 425.485 2.296 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 788401935 NJFCGIMCLWSRMM-UWJYYQICSA-N 442.512 2.492 10 20 IECD COCn1nc(C)c(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)c1C 789727998 QAHHCDNYMOZYBQ-UHFFFAOYSA-N 439.519 2.257 10 20 IECD CC[C@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 789799027 HNAGCYCKVQQBLT-INIZCTEOSA-N 444.507 2.167 10 20 IECD CCCN1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789819104 LMDCGUGUQWZSEM-ROUUACIJSA-N 448.583 2.294 10 20 IECD CCN(CCCN1CCCC1)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819449 MYZBPBXABBUFKY-RTBURBONSA-N 448.583 2.390 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820420 QPAAWAYRAHPPAN-IAGOWNOFSA-N 445.539 2.109 10 20 IECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)on1 789840405 HALYUBOCVBZHEM-IBGZPJMESA-N 430.480 2.063 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)O1 789948480 BCNUWDYDOOZPRW-YOEHRIQHSA-N 443.466 2.184 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCCC1 793707149 DTRWKKWWHITIDO-IRXDYDNUSA-N 438.519 2.364 10 20 IECD CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793734555 UPBZEMGZRZDWDS-MISYRCLQSA-N 446.617 2.137 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2Cl)C1 800049327 IGFQDQZJAUOTJJ-FPPCVNACSA-N 445.947 2.355 10 20 IECD COCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309774 BRZYDGYPUKSMDX-PXNSSMCTSA-N 429.517 2.496 10 20 IECD Cc1ccc(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 804033455 PFDNYSUFBXIYID-QGZVFWFLSA-N 432.471 2.435 10 20 IECD O=C(NCCOc1cccc(C(F)(F)F)n1)C(=O)NCc1ccc(N2CC=CC2)cc1 807288564 XOPSNLJIKLNNLY-UHFFFAOYSA-N 434.418 2.288 10 20 IECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)OC(C)(C)C 807668481 XHLUHZWWYDOSOY-QGZVFWFLSA-N 449.548 2.319 10 20 IECD Cc1c(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cccc1[N+](=O)[O-] 807810585 NGQGXTPISQKBKL-UHFFFAOYSA-N 426.473 2.015 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O 808229389 AAJATRVRVKHFBW-OAHLLOKOSA-N 429.439 2.190 10 20 IECD CCN1C[C@H](C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914910190 AVVOERGRSGCLBX-UONOGXRCSA-N 434.448 2.201 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc(CN2CCOCC2)cs1 915316470 MKMDOIJPIBTSSA-UHFFFAOYSA-N 431.562 2.476 10 20 IECD CC(=O)N1CCc2cc(S(=O)(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc21 920871022 VTDBRGLVZSCHLL-MRXNPFEDSA-N 429.542 2.472 10 20 IECD CCOc1ccc(N2CCN(C(=O)C3CCN(c4ccc5nncn5n4)CC3)CC2)cc1 1320386567 MKDTXHMGIZMSGU-UHFFFAOYSA-N 435.532 2.088 10 20 IECD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c(C)n1C 1782007874 YVZQLSVPIFSVCV-JOCHJYFZSA-N 447.919 2.464 10 20 IECD Cc1cc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc2s1 1782296879 FUEJDPUJGNOKFL-NRFANRHFSA-N 442.497 2.101 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)O)C[C@@H]32)cc1 1790126162 YJNCAKKSSWDEOS-UDDWMFPDSA-N 425.529 2.068 10 20 IECD O=C(CSc1nc[nH]n1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791819790 IWXZYGRQTHHZBW-UHFFFAOYSA-N 440.485 2.151 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)o1 1792217714 JNUHLEKNIUQFIK-MXGZIJRMSA-N 442.468 2.012 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cncnc3)CCC2)cc1 1792313887 GWBGNHZJKBEHJL-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1F 1798789772 ORRLAEVBRHBCAS-IVWMJMPLSA-N 434.851 2.407 10 20 IECD Cc1ncc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1802918657 GTEYFPIYJOBYGO-NCSLWMNCSA-N 443.525 2.462 10 20 IECD CC[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 1804077840 SIFLDJRKYXLYGQ-QKPAOTATSA-N 448.520 2.048 10 20 IECD O=C(CSc1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804332301 VVHJKAGXHQOZMO-QDMKHBRRSA-N 449.623 2.277 10 20 IECD C/C=C/C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808470903 ZVHHUYLAUMCENW-PQRYCNGKSA-N 431.496 2.456 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ncc(Cl)cn3)CC2)C1 1810542953 GIGOAILTENXOTH-UHFFFAOYSA-N 431.880 2.095 10 20 IECD O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C1CC1 1832875898 RYNNRYUCFBDHCZ-PDFOZTTASA-N 442.512 2.415 10 20 IECD COc1ccc(Cl)cc1CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250840 USDGHEXSYWGQBZ-UHFFFAOYSA-N 431.876 2.215 10 20 IECD O=C(Cc1noc2ccccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039184 VGBADVYWSVFVEH-VQHVLOKHSA-N 449.463 2.404 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 16134913 XJUUOKZMBAITDT-UHFFFAOYSA-N 429.542 2.118 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 108287583 GKIWZBPPFNMQGW-GJZGRUSLSA-N 434.512 2.166 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(c3ncnc4ccsc34)CC2)n(C)c2ccccc12 563997363 YRSCESGJFFEFQM-UHFFFAOYSA-N 448.552 2.456 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(-n2ccnc2)nn1 725886850 PWFBUAVQMQWZRR-UHFFFAOYSA-N 432.406 2.448 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)NC3(CCS(=O)(=O)CC3)C2=O)c1C 729153894 VVEILQRMCUKIQL-UHFFFAOYSA-N 443.525 2.084 10 20 IECD NC(=O)[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NN1c1ccc(F)cc1 731859120 RXNHFKNWWQQIIR-ICSRJNTNSA-N 440.475 2.159 10 20 IECD Cc1cccn2cc(CC(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)nc12 732355623 GDXRBHBCYGLQBE-UHFFFAOYSA-N 440.475 2.021 10 20 IECD O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804822 BQHPJYSPTDLXGT-CJNGLKHVSA-N 434.530 2.293 10 20 IECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1-n1cnnn1 743890383 YZRRGCOSUFSRHF-UHFFFAOYSA-N 449.515 2.258 10 20 IECD CN(C)C(=O)Cn1cc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 747552493 JSGAXUKZWOYSTF-AWEZNQCLSA-N 436.463 2.363 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc4c(c3)CCCN4C)cn2)C[C@@H](C)O1 747571260 MOJDXSVQVQDUNE-IAGOWNOFSA-N 440.548 2.223 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)o1 751365577 FFTVWGGIESNWSV-SFHVURJKSA-N 435.546 2.384 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c(C)c([N+](=O)[O-])c1 753829321 QCQPXYUJGIUZLC-LLVKDONJSA-N 431.401 2.220 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1F 753883532 NSHKKWJGSRKFHL-UHFFFAOYSA-N 436.509 2.453 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1F 753911564 OBUHEPGGOFBLTC-MRXNPFEDSA-N 441.507 2.044 10 20 IECD CCc1nc([C@H]2CCCCN2C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)no1 754013319 ROIZMTNCDUNWDX-TZIWHRDSSA-N 429.565 2.351 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(C(=O)N(C)C)ccc3C)CC2)cc1 758223530 KZOKPQVTJVUIDK-OAQYLSRUSA-N 427.545 2.267 10 20 IECD COc1cc(N2CCN(Cn3cc(C)n(-c4cc(C)on4)c3=O)CC2)cc(OC)c1OC 758963912 JOIOVXRSTJTWNM-UHFFFAOYSA-N 443.504 2.049 10 20 IECD COc1cc(N2CCN(CC(=O)N3CCc4sccc4C3)CC2)cc(OC)c1OC 759876573 ANLBWLQUKHHJQJ-UHFFFAOYSA-N 431.558 2.481 10 20 IECD Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 760096099 YONUXMVWLKRRAE-NRFANRHFSA-N 426.492 2.353 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)C3CC(=O)C3)c2C)c1 765413933 PBZJXMBJUBAVHP-UHFFFAOYSA-N 441.436 2.372 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773617354 DDUBDELLGCPCSC-HUUCEWRRSA-N 447.561 2.048 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1)c1ccc(N(C)C)cc1 773855331 GOOUFEDNEMEVMS-INIZCTEOSA-N 438.528 2.477 10 20 IECD O=C(NCCc1ccco1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 775114924 KOJLVAKSGOACMA-UHFFFAOYSA-N 425.407 2.110 10 20 IECD C[C@H]1CN(Cc2cc(Br)cc(Br)c2O)CCN1S(C)(=O)=O 776691091 JPXYBQOXXUZVJB-VIFPVBQESA-N 442.173 2.383 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@H](C)C(C)(C)C3)CC2)cc1 785529744 XAEZGWSALRRHMB-IBGZPJMESA-N 430.593 2.218 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1OC 787308690 XHICSHHXPLYISB-UHFFFAOYSA-N 425.485 2.021 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1 787974687 NOYDVVXWHQMSJA-OAQYLSRUSA-N 425.529 2.321 10 20 IECD C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789798967 GZDCZUOLBNSOQR-HDICACEKSA-N 448.583 2.151 10 20 IECD COC(=O)c1cn(CCNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1 790855625 ZJJHKRKRSFKHLC-AWEZNQCLSA-N 434.928 2.454 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)[C@@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)cc1 792884150 WNVCCWVHWGCHOA-QFIPXVFZSA-N 430.549 2.107 10 20 IECD C[C@@H]1CCC[C@@](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)(N(C)C)C1 793809018 DPXNJPZCUFIZNA-KHCICDEESA-N 430.593 2.327 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCN(C2CCC2)CC1 803450457 HYDHAQMFMJSWKM-UHFFFAOYSA-N 436.503 2.070 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(OCC4CC4)nc3)CC2)cc1 803568366 XSHVFSFVGFQYMH-UHFFFAOYSA-N 438.528 2.280 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)Nc1ccn(CC(=O)N2CCOCC2)n1 806286989 TZJGKUXKKJWYLR-UHFFFAOYSA-N 428.276 2.076 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CCN(CCc2ccccn2)CC1 807289330 PZWALESAXOILLA-UHFFFAOYSA-N 447.583 2.240 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292802 ZDHLXBBNNCYWEL-PKOBYXMFSA-N 428.533 2.052 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnc5[nH]c(C)nc45)n3)CC2)cc1 809465212 UBJDDXBNICHQSH-UHFFFAOYSA-N 433.472 2.216 10 20 IECD COC(=O)c1cnn(C)c1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 815430568 PMLXLEBTSUUMDY-UHFFFAOYSA-N 427.505 2.231 10 20 IECD CCCCCNC(=O)C1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 917054177 WXZTVAWMWXAQCB-UHFFFAOYSA-N 430.593 2.362 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCn3c(=O)oc4ccccc43)cc2)C1 917832372 VUTMVJBRYKVAMS-SFHVURJKSA-N 436.512 2.393 10 20 IECD O=C(CCn1c(S)nc2ccccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 918141500 YOIMGILNQPLHFG-UHFFFAOYSA-N 442.516 2.367 10 20 IECD Cc1cc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 920873025 WIZMLCURXWEVRA-VQIMIIECSA-N 447.561 2.270 10 20 IECD Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)[nH]1 1786508664 OYOPPMLYRWCBOA-UHFFFAOYSA-N 443.554 2.326 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1CCCCO1 1794023823 UCPNBUAEESEETP-NHPUWBORSA-N 430.501 2.414 10 20 IECD COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1796932662 OYYXKBLYFVMYOL-VBUUOAMHSA-N 447.495 2.135 10 20 IECD CC(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)n1 1799769139 OEYVSVGNZKLWBA-ZSBFGKGUSA-N 448.907 2.046 10 20 IECD CC(C)CCC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812603839 GTHNYRNAYSSOBN-OXQOHEQNSA-N 448.614 2.384 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]cc3c1CCC3)CC2)c1cc(O)nc(O)c1 1816727308 NDCXFIOGAOBPQN-LBPRGKRZSA-N 439.497 2.306 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847655 RDIFSVBQMAFGSF-INIZCTEOSA-N 439.476 2.104 10 20 IECD CC(=O)O[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C(C)C 1819248498 KQVRYTOGBOBBCJ-BEFAXECRSA-N 445.476 2.110 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)C2CC(O)C2)CC1 1824117974 WIGYFDVFNPNOGJ-XIXLEAKQSA-N 444.528 2.207 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@@H]2C1 1827428174 KMGWOTGRHXQVHQ-XLNTUCKNSA-N 442.560 2.066 10 20 IECD CC(C)(C)n1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1842251867 JIMMANFGBBDPBM-SOFGYWHQSA-N 440.500 2.285 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2 1843250415 WFQXKIRSMFFWOR-UHFFFAOYSA-N 429.423 2.320 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2[nH]nc3ccncc23)C1 1843281442 KAEZFNIYNNTXAT-UHFFFAOYSA-N 427.848 2.153 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC12CN(C(=O)C1(c3ccccc3)CCC1)C2 1847055576 MTJGJSJPAFPNBJ-UHFFFAOYSA-N 443.594 2.172 10 20 IECD CCOC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730132849 HACPFRHVPAEMGS-GOSISDBHSA-N 435.544 2.388 10 20 IECD CC[C@](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)(C(=O)OC)c1ccccc1 732201587 HASLCRRQAOLESW-XMMPIXPASA-N 443.519 2.347 10 20 IECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 735836985 OLSSUJNGBMTALK-GOSISDBHSA-N 430.509 2.322 10 20 IECD COCCNS(=O)(=O)c1ccc(NC(=O)NCc2ccc3c(c2)CCCN3C)cc1 743212197 CQDKNYQJOYYSCI-UHFFFAOYSA-N 432.546 2.315 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](N2CCNC2=O)C1 744200480 KRYIVGFPVQMRHW-JKSUJKDBSA-N 446.507 2.279 10 20 IECD CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)ccc1Cl 748485565 LEBNTKKKYZZNAN-UHFFFAOYSA-N 439.921 2.331 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C(=O)[C@H]4CSCN4C3=O)c2C)cc1 752913747 WTVJNRNNGISYKO-QGZVFWFLSA-N 427.482 2.401 10 20 IECD COC(=O)C[C@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 753011502 WUBREHYEZWYTAK-PBHICJAKSA-N 427.448 2.230 10 20 IECD COC(=O)c1ccc2c(c1)CN(C[C@H](O)CN1CCN(c3ccc(OC)cc3)CC1)CC2 754096144 ANSKOLDBZWXKIU-HSZRJFAPSA-N 439.556 2.023 10 20 IECD COC(=O)Cc1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c(F)c1 758230994 MXCJPRMQWVFYTH-IBGZPJMESA-N 432.492 2.112 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(c2cccnn2)CC1 758396768 FQTXFNHEYIMPCP-UHFFFAOYSA-N 428.512 2.045 10 20 IECD CCC(CC)[C@@H](C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)N1CCOCC1 760087377 YLTBEMCPJKABDA-QFIPXVFZSA-N 449.592 2.498 10 20 IECD CN1CCN(c2ncc(CN[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2)CC1 761969566 ITFJUAGOHPQBEM-HXUWFJFHSA-N 430.984 2.342 10 20 IECD C[C@@H](NC(=O)NCc1ccnc(OCCN(C)C)c1)c1ccc(N2CCOCC2)cc1 762562651 XNRVXFRALAZYMI-GOSISDBHSA-N 427.549 2.419 10 20 IECD CNS(=O)(=O)c1ccc([C@H](C)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764685423 VOLGGPQFEGMEOG-IBGZPJMESA-N 446.617 2.466 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)c1 769715310 OYPVSGQQSVTWDZ-UHFFFAOYSA-N 432.502 2.321 10 20 IECD C[C@H](NCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc(N2CCOCC2)cc1 775258538 DGXOTDKYFGJBLE-PGRDOPGGSA-N 449.617 2.132 10 20 IECD Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 777972700 YDGXKCZRTKTYIG-UHFFFAOYSA-N 427.429 2.497 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779011147 DZUUMVQVNYKTMG-CHWSQXEVSA-N 427.523 2.139 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 787093510 KZNBZACYSGUOSD-UHFFFAOYSA-N 440.544 2.391 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccc(Cl)nc3)cc2F)C[C@@H](C)O1 789828756 YHSUHWWAJDDGLZ-HUUCEWRRSA-N 448.926 2.463 10 20 IECD C[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860564 LYZZQSULZIRHOC-GOSISDBHSA-N 427.570 2.266 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C3CC3)ccc21 793633112 HXKLUTCNDNRBAJ-GOSISDBHSA-N 430.549 2.105 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 793940316 ZPEHOVASBYLTSW-DLBZAZTESA-N 433.549 2.304 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1F 796686798 HQSCJEPPFICWLM-UHFFFAOYSA-N 447.438 2.185 10 20 IECD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(S(C)(=O)=O)cc1Br 801690827 BEXURTVNWVQEDP-UHFFFAOYSA-N 434.333 2.379 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(C)C[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803308708 IRIRRZZJPAJKSY-AUSIDOKSSA-N 436.556 2.216 10 20 IECD CCCCCCNC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662529 COOLIBPMVRYSBF-SFHVURJKSA-N 434.556 2.443 10 20 IECD COc1ccc(CN2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 803664174 GXKWJFCVKYYDMC-UHFFFAOYSA-N 442.535 2.251 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 806275536 KCVCOPDCHZLRLI-LBPRGKRZSA-N 425.967 2.185 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc(C2CCOCC2)cs1 806847724 WJNNZBXPMRJBKZ-UHFFFAOYSA-N 444.557 2.471 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(CN2CCOC2=O)c1 807387316 HYCCGSHQMIEZLI-UHFFFAOYSA-N 448.273 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(OC(C)C)c(C(N)=O)c3)CC2)cc1 811767593 LFKYXHWDWAUFFX-UHFFFAOYSA-N 426.517 2.342 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC(=O)N1CCCC1=O 913359886 FXPIXWWUJOJFDX-RAXLEYEMSA-N 438.552 2.422 10 20 IECD COc1cc(CNCc2ccc(N3CCOCC3)c(F)c2)cc(Cl)c1OCC(N)=O 916836388 AVSBSAIQDIBHJP-UHFFFAOYSA-N 437.899 2.478 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1F)NCc1ccc(N2CCSCC2)cc1 917386008 KOMHJUNXCPVMFM-UHFFFAOYSA-N 437.562 2.364 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787540186 MLANQMAIQFSKSE-VCOUNFBDSA-N 446.507 2.073 10 20 IECD NC(=O)c1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424145 ABKAFLMDSXEMGA-UHFFFAOYSA-N 447.451 2.048 10 20 IECD Cc1cccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1803506518 QUWKDFVQRPPICZ-BTTYYORXSA-N 435.546 2.246 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1[nH]cc2c1CCC2 1811291854 PDRXNXDQOQMXKS-OPAMFIHVSA-N 447.495 2.338 10 20 IECD CO/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901118 CBTXUBNLPKEFFF-GRNBYLDVSA-N 439.603 2.017 10 20 IECD CC(C)C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834392275 SFHKZARHYAIXKB-GQCTYLIASA-N 431.533 2.044 10 20 IECD COc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 60106110 GMJQAPSNJXOXNP-INIZCTEOSA-N 447.557 2.273 10 20 IECD COc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)NC(C)C 437003892 CEJJWEVQGOKVFR-UHFFFAOYSA-N 433.530 2.487 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCc3cccc([N+](=O)[O-])c3)C=C2)cc1 536239411 PAHWEVHJZTZGEZ-UHFFFAOYSA-N 425.466 2.297 10 20 IECD O=C(NCC(=O)N1CCc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 726191804 KOVDTDHVUCEEDW-UHFFFAOYSA-N 426.492 2.175 10 20 IECD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 726234675 JDTGVBDMHPMLRE-PMACEKPBSA-N 443.592 2.082 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@H](C)C(=O)N3CCN(C(C)=O)CC3)ccc21 728637698 DVSOKOYJXPJNIK-QGZVFWFLSA-N 429.517 2.141 10 20 IECD C[C@@H](NC(=O)NCCNC(=O)Cc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 748825490 FFWKWQLUMBPELN-QGZVFWFLSA-N 428.508 2.381 10 20 IECD O=C(Cn1c(-c2ccncc2)noc1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 749357408 DCXHBPUTCHHJRS-UHFFFAOYSA-N 426.388 2.312 10 20 IECD O=C(Cn1c(-c2ccccn2)noc1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749359104 YYTMQBQOWXTXOB-UHFFFAOYSA-N 426.388 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(Cl)ccc(OC)c3N)CC2)cc1 750231022 VEWWLOIWWNCUJK-UHFFFAOYSA-N 433.892 2.445 10 20 IECD COC(=O)c1cc(Br)cc(S(=O)(=O)NCc2cccc(OC)c2O)c1 751305103 JMSPWKKIPVICDP-UHFFFAOYSA-N 430.276 2.428 10 20 IECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@H](CC)CN1C(C)=O 752878812 GEZKEVCAGIDJGE-NJDAHSKKSA-N 443.592 2.319 10 20 IECD COc1cc(C)cc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1O 754720904 VMDNPKQKIYMKDC-UHFFFAOYSA-N 448.541 2.377 10 20 IECD C[C@@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 756593379 YRDMPJPLRUARES-OAHLLOKOSA-N 434.518 2.087 10 20 IECD CCN1CCN(c2ccc(CN3C(=O)N[C@H](c4ccc(OC)c(O)c4)C3=O)cc2F)CC1 761277256 HIFLYHWXVISXGE-OAQYLSRUSA-N 442.491 2.475 10 20 IECD COc1ncc(/C=C\C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)cn1 775828446 YGYNOBONGXAQJL-YVMONPNESA-N 428.514 2.262 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@H](O)c3cccc(F)c3)CC2)cc1 778391862 YMNRFEBIBYUJGN-IDRJMLMJSA-N 441.503 2.277 10 20 IECD COc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1-n1cnnn1 782015199 TZBOSLANDIYLFY-KRWDZBQOSA-N 442.907 2.424 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 783330011 ZMEYXRJFWIUNQB-UHFFFAOYSA-N 437.544 2.065 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCCC3(C)C)CC2)cc1 785531372 VFIXPUFZTIRUMS-OAQYLSRUSA-N 430.593 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)Cc3ccccc3)cc2)CC1 786656130 KUGKYMGTPNCAAT-DEOSSOPVSA-N 448.567 2.205 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 788312279 GIQAKSGNTUXAED-YADHBBJMSA-N 441.503 2.315 10 20 IECD COc1ccc([C@@H](C)CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788334677 ZEIGXQJEOWNVJD-SFHVURJKSA-N 425.529 2.458 10 20 IECD C[C@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(N(C)C)C1 789844415 RYPMQFOSOFMAAJ-XDHUDOTRSA-N 448.583 2.030 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 792046036 ZZQNRFZSKVJLHT-DOTOQJQBSA-N 433.553 2.101 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)cc2F)C[C@@H](C)O1 792955653 IGBSLKWKSSLCSI-GASCZTMLSA-N 441.507 2.437 10 20 IECD COc1ccc(N2CCC(N[C@H](C(=O)N(C)Cc3nnc4n3CCC4)C(C)C)CC2)cc1 793248188 YPIIOTKFIOQGMV-QHCPKHFHSA-N 440.592 2.475 10 20 IECD CC1(c2ccccc2)CC(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793735888 ZIAGGMMXWAHJCJ-QNRDPGIFSA-N 448.567 2.241 10 20 IECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 793912601 YOGVEYZUZPJQQI-IBGZPJMESA-N 430.593 2.108 10 20 IECD Cc1cc(OCC(=O)NC(N)=O)ccc1NC(=S)NCCCN(C)c1ccccc1 797792206 AVJFSWGWRPBCQW-UHFFFAOYSA-N 429.546 2.382 10 20 IECD O=C(NCCCSc1nccs1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 801154672 JQHYKPLOBVCGHY-UHFFFAOYSA-N 445.563 2.215 10 20 IECD CCOC(=O)c1nc(=NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(C(C)(C)C)[nH]1 804419760 VPNWPMYQFRCEEX-UHFFFAOYSA-N 446.573 2.220 10 20 IECD COC(=O)[C@H]1CN(C(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c2ccccc2O1 807511535 OIQZPOPVZATPAE-OAHLLOKOSA-N 439.251 2.282 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCOCC1 807548034 OXKGDLHJNTYJME-GDBMZVCRSA-N 425.476 2.304 10 20 IECD O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809541777 XMVXSWHIUMDZGN-JYRKZWEQSA-N 428.529 2.364 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN4c5ccccc5C[C@H]4C3)CC2)cc1 810050680 LLHWNUBBKZUNKF-ZEQRLZLVSA-N 436.600 2.315 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 916565427 DNNMIIMKTGUIJI-NJYVYQBISA-N 427.545 2.435 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920925917 MMIMSSWWPJSYJZ-INIZCTEOSA-N 436.512 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CN(C(C)=O)C4)CC2)cc1 1319887354 FRPZTUSDEOKIOU-KTKRTIGZSA-N 448.523 2.401 10 20 IECD C[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785509920 CKUVUTKKXPHTNL-PPWNLUBZSA-N 444.528 2.473 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cscn1 1796244152 SIMDFASBTBBKOV-ITPDYZAISA-N 429.498 2.154 10 20 IECD CC[S@](=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798291102 MOILBMGQMSBEGK-NCSLWSIVSA-N 428.938 2.162 10 20 IECD O=C(c1cc(O)nc(Cl)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810542956 GMMBXPOHMVGGQE-UHFFFAOYSA-N 446.891 2.405 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CN2CCN(C)CC2)C3)cc1 1845398752 ZIIIWIXPGIIUND-UHFFFAOYSA-N 449.599 2.159 10 20 IECD NC[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1ccccc1 1845500885 ABGZOWFADASIMB-INIZCTEOSA-N 429.904 2.311 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)cc1F 1847356635 QNGGFYGDPXKDKR-KBPBESRZSA-N 441.937 2.155 10 20 IECD C[C@H](NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(=O)O 15036892 OFBBDBGYYAKVRD-OITNDJBGSA-N 429.317 2.240 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cnn(CC(=O)N4CCOCC4)c3)ccc21 525093436 MZIUMTUEUQORBM-UHFFFAOYSA-N 439.516 2.212 10 20 IECD CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccc(N2CCOCC2)cc1 741736188 OUUWHISRROITBP-UHFFFAOYSA-N 428.445 2.231 10 20 IECD CCCN(Cc1ccccc1O)C(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1 743156858 XSSFYTSIRWMOOH-UHFFFAOYSA-N 447.561 2.313 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1C 751238220 YORIBJWBLDEYFU-UHFFFAOYSA-N 436.505 2.360 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 751817551 JTQGFERERGVJCC-QGZVFWFLSA-N 438.528 2.349 10 20 IECD CNC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 754336678 BQRYPFAKEPLCPI-OWBHPGMISA-N 438.600 2.213 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(-c4ccncc4)n3C)CC2)cc1 758197929 SHAWDVIAPFLEPA-IBGZPJMESA-N 440.573 2.161 10 20 IECD CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NCCCSc1nccs1 760110174 NBTOQBZDQFDQNX-UHFFFAOYSA-N 431.536 2.064 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c1 760660094 PSPRPWCBWKOKAC-TZIWHRDSSA-N 436.505 2.407 10 20 IECD CCO[C@H](CCN(C)C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768230305 IQBQVJBHOKFKMI-OAHLLOKOSA-N 441.575 2.341 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc5c(c4)OCCO5)n3)CC2)cc1 771058002 RMGXFNBYKSYKDS-UHFFFAOYSA-N 436.468 2.408 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)c1 771567311 TYFCMEIHBIIDAW-DMZKTXOQSA-N 427.457 2.054 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 774778814 FNUVNFDJEVBBKI-NHCUHLMSSA-N 425.529 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 778298709 RGZYUNYHSODDHQ-SIFUEBAJSA-N 441.532 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc4c(cc3F)NC(=O)CC4)CC2)cc1F 778652108 IGKNJNYKCSDBFV-UHFFFAOYSA-N 444.438 2.145 10 20 IECD CN(C)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCC1 783751653 PTWCVNHJBRDRBD-UHFFFAOYSA-N 448.501 2.315 10 20 IECD CC[C@H](CSC)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949821 KRFFDTRPEIRSKQ-CQSZACIVSA-N 433.496 2.416 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(F)cc2C)cc1OC 793368087 RKIREFNAWGHLLD-UHFFFAOYSA-N 446.478 2.403 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(C)C[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803308710 IRIRRZZJPAJKSY-WMZHIEFXSA-N 436.556 2.216 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804420703 DITDQMOMAVLSSO-SJLPKXTDSA-N 438.519 2.364 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CC(C)(C)CN3CCOCC3)cc2)CC1 805024318 RNVPCYAGXSZXPZ-UHFFFAOYSA-N 444.620 2.356 10 20 IECD CN(C)Cc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 806042543 WEXDRTAAIGTTNI-FQEVSTJZSA-N 443.519 2.417 10 20 IECD C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807600148 ZIIBUKBLHWXSKF-PMPSAXMXSA-N 425.476 2.304 10 20 IECD COC(C)(C)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807605210 QFQZNGOFRDJSPE-SFHVURJKSA-N 430.593 2.155 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1=CCN(C)CC1 807771231 TYVQVGANLBOGJJ-DOTOQJQBSA-N 436.503 2.140 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3([S@@](C)=O)CC3)cc2Cl)C1 807955258 RBJBRKTUUITVNT-HJFSHJIFSA-N 425.982 2.220 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O 808615878 NIQXLWJJZZDION-QFIPXVFZSA-N 436.556 2.061 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)Cc3cnc4ccccc4n3)nc12 815463863 XQEAODXZNUAGNP-CYBMUJFWSA-N 435.440 2.477 10 20 IECD CCN(C(=O)[C@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 914613213 KZJOZDZGYOYBGK-IRXDYDNUSA-N 433.530 2.070 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F 918306190 VQALGIBMOBKPCB-UHFFFAOYSA-N 448.520 2.029 10 20 IECD CCN1C(=O)c2ccc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2S1(=O)=O 920882663 VUMVNPLNYORWFB-OAHLLOKOSA-N 443.525 2.179 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1 1320519202 CDGGJWVEQOVLCR-QKKBWIMNSA-N 440.468 2.037 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1 1784075666 QTNNZZVJEBNDDC-CNOZUTPLSA-N 433.263 2.119 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cc2sccc2s1 1797374914 DQPXPJADQVSSSU-KSPBDQMDSA-N 445.522 2.286 10 20 IECD CN1CCCC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1814893277 NSUVLGGOFZCMRH-CVEARBPZSA-N 428.493 2.006 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C3CC3)on1)CC2)c1cc(O)nc(O)c1 1816720369 OBYHYJNBYZYXBN-NSHDSACASA-N 441.469 2.354 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829165846 GKOZKXSTMTWGNX-KRWDZBQOSA-N 427.505 2.380 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)C23CC(C2)C3)CC1 1832470562 QPYUUIACNSYAGU-JERHATOGSA-N 435.615 2.267 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cccs1 1834107716 KJJUPGIOJVCHCK-UHFFFAOYSA-N 430.530 2.053 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1 729062638 TXLBOWFUEHNRHH-LBPRGKRZSA-N 437.452 2.223 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c1 729062927 GNWAFUSNOXIDJO-CQSZACIVSA-N 443.525 2.406 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1 729293525 MBJKELQDMFGRSQ-DEOSSOPVSA-N 439.556 2.452 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CC(=O)N(C4CCC(C)CC4)C3)nc12 731389756 NYPUDRPADBIXPJ-NPCAHTBFSA-N 444.488 2.082 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 733341656 DCBILTMSRGXIGJ-JYJNAYRXSA-N 429.558 2.404 10 20 IECD CCOC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 752886427 QPDQLWMQDJSDBX-INIZCTEOSA-N 428.489 2.157 10 20 IECD C[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 753207416 OBTMQHIOACDAKJ-SNVBAGLBSA-N 432.396 2.183 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ncn(C2CCCCC2)n1)c1ccc(N2CCOCC2)cc1 755214194 XDXNGKVSNMRYRH-MRXNPFEDSA-N 426.521 2.436 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1S(C)(=O)=O 758970256 RGGVTGDIUJMPMS-UHFFFAOYSA-N 447.582 2.207 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2cc(Cl)cc(OC)c2O)c1 761205564 GAESEWGERMQPBA-NSHDSACASA-N 427.910 2.079 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1 764936295 YZVMHVGOMBIVFP-UHFFFAOYSA-N 449.554 2.474 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1cccc(N2CCS(=O)(=O)CC2)c1 771934256 VYFXAUWCJHUPJW-UHFFFAOYSA-N 449.916 2.249 10 20 IECD CCN(CC)c1ccc(CNC(=O)N(CCCOC)[C@@H]2CCS(=O)(=O)C2)cc1F 774210928 MCISJXZZDVYYDD-QGZVFWFLSA-N 429.558 2.407 10 20 IECD C[C@@H](NCC(=O)N1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 775835785 JIOPUNPQFHBXPE-QGZVFWFLSA-N 448.564 2.075 10 20 IECD Cc1cc(C(=O)CN(C)[C@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776856316 ACGGRYQYLAROKS-MRXNPFEDSA-N 448.589 2.159 10 20 IECD CC[C@@H]1CCCCN1CCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778276415 QXJLQCBEYNBWMF-ZCPJJFRWSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(c4cc(C)[nH]n4)CC3)CC2)cc1 778418358 DLJOHUIDYLNIGA-FPLPWBNLSA-N 437.544 2.338 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1F 779529204 RMZBCKVLQODKBU-RBUKOAKNSA-N 431.489 2.187 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1 785434891 WNSWAMXDSXPHKY-UHFFFAOYSA-N 440.519 2.063 10 20 IECD O=C(NCc1ccnc(N2CCCC2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786503725 HYEMCOZNDLDFEV-HXUWFJFHSA-N 438.528 2.211 10 20 IECD CCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1C 786655121 DHPBYTSNEUXKLJ-UHFFFAOYSA-N 426.517 2.407 10 20 IECD Cn1ncc2c1CCC[C@@H]2NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 789592104 QQKCGGHSYNMSHW-SFHVURJKSA-N 447.486 2.300 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOc4ccccc4C3)cc2F)C[C@@H](C)O1 789815830 ASUOLIYINILAJA-IAGOWNOFSA-N 441.503 2.477 10 20 IECD CCN(Cc1ccccc1C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793723424 WSNCCARFZIVJQT-OAQYLSRUSA-N 436.556 2.362 10 20 IECD COc1cc(N2CCN(Cn3c(=O)oc4cccc([N+](=O)[O-])c43)CC2)cc(OC)c1OC 794638459 FKENAPRXAFHSSQ-UHFFFAOYSA-N 444.444 2.308 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)cc1 797431859 ZTYVLTJNTSDBLY-UHFFFAOYSA-N 432.483 2.082 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 798426331 WYHNFNLNWZKKPR-UHFFFAOYSA-N 434.514 2.139 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(F)c(F)cc(F)c3F)CC2)cc1 800912453 LGRWQUPGOHZDHM-UHFFFAOYSA-N 447.454 2.352 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(N2CCOCC2)cc1 803304607 GDEPJKPXEDGMRJ-JTSKRJEESA-N 441.503 2.440 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@@H]1CCO 803451725 UNYUMMABIHYASY-RDTXWAMCSA-N 425.476 2.040 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)cc1F 804852513 JNIODBGWLFBILK-GOSISDBHSA-N 434.556 2.299 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295293 CPJZQCSUCHGKQV-QGZVFWFLSA-N 446.525 2.250 10 20 IECD Cc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1N1CCNC1=O 919839156 DMHHHVJFYPQLHQ-UHFFFAOYSA-N 428.514 2.012 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](Cc4nccn4C)C3)CC2)cc1 1322657113 QIXZGVLFCMYRDY-HXUWFJFHSA-N 440.592 2.215 10 20 IECD CC1(C)CC(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)C1 1784030643 JKGSAYSIDWSFMF-FIYNHDKVSA-N 430.501 2.083 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)Cl)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246290 UCAUDZDAFXITEQ-FWDPORAESA-N 439.242 2.176 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCn1ccnc1 1802877610 ITRRGSODSXGPTO-DTUWPTEXSA-N 440.500 2.132 10 20 IECD O=C(COc1ccc(O)cc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810549675 XCYAKQAOLZIHIV-UHFFFAOYSA-N 441.484 2.122 10 20 IECD O=C([C@H]1CCc2nc[nH]c2C1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502267 HEFLIDWEQKJWPS-LBPRGKRZSA-N 430.892 2.096 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)n3cnnn3)C2)cc1 1846647161 HUGZNQCLDNZLRI-SFHVURJKSA-N 433.516 2.159 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cc(F)ccn1 1848174015 YDCZHGSZXXFFMD-ZYQPHWHESA-N 441.459 2.185 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726562277 JDQJXCYQUROWOT-UHFFFAOYSA-N 431.558 2.321 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](c4nnc5ccccn45)C3)CC2)cc1 738316177 ALCFUJPIQOYADP-LJQANCHMSA-N 434.544 2.266 10 20 IECD Cn1c(=O)nc(O)c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 742801722 SEQYOXMLOWHSOL-ZDUSSCGKSA-N 445.426 2.034 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2cnn(C)c2)CC1 746670123 XGWMZZMFSKSUBH-MRXNPFEDSA-N 443.507 2.345 10 20 IECD NC(=O)CC[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060635 MTVOFXCHEMLATJ-CYBMUJFWSA-N 437.543 2.372 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C(C)C)N3C[C@@H](C)O[C@H](C)C3)CC2)cc1 751385275 JMAMBLRSENMXQP-VIZSFHNOSA-N 432.609 2.067 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-c4nnc(C)o4)c3)CC2)cc1F 754211579 GTAAPTSVXYNUKL-UHFFFAOYSA-N 439.447 2.480 10 20 IECD COc1ccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1OC 759885249 BQFUXTCGLFIWMI-UHFFFAOYSA-N 445.516 2.490 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c1 765418359 PVMKIYIMCUNKHL-HNNXBMFYSA-N 441.868 2.092 10 20 IECD COc1cc(CN2CCOc3cc(N(C)C)ccc32)ccc1OCC(=O)N1CCOCC1 765659009 SMAGMWVEDFDUQC-UHFFFAOYSA-N 441.528 2.398 10 20 IECD CN1CCCc2cc(CNC(=O)N[C@@H](Cc3ccccc3)C(=O)N3CCOCC3)ccc21 765883796 USRYMPIYSBKCKL-QFIPXVFZSA-N 436.556 2.338 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cccc21 769258437 DMBIMWAAZORSJT-SFHVURJKSA-N 437.496 2.448 10 20 IECD CCCN(Cc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 776061875 QCZWBMRWRGNAGZ-UHFFFAOYSA-N 434.518 2.252 10 20 IECD COc1ccc(OC)c(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 786683086 KUAMXWZNPNWSRI-KRWDZBQOSA-N 441.528 2.077 10 20 IECD CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 787079906 HHIGLMFTGCZWRJ-QGZVFWFLSA-N 438.528 2.317 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3[C@@H](O)c3ccc(F)cc3)CC2)cc1 787254283 UYASWLOKSPNBDR-GMAHTHKFSA-N 440.519 2.296 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](c3ccnn3C)C(C)C)CC2)cc1 788539730 VOUVKVVQGZBEDF-YUQDSPFASA-N 439.560 2.190 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 788933074 PBHJQWVEELWIDT-FQEVSTJZSA-N 438.503 2.354 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H]1C 789826380 PUVKZRWOBIYVJD-JPLJXNOCSA-N 448.583 2.387 10 20 IECD CCOC(=O)N[C@H](CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)CC(C)C 789931668 BOVKIJWWVAUIHU-SFHVURJKSA-N 448.564 2.011 10 20 IECD C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NCc1cccc(Br)c1O 792484101 JWQIKTXQIXVYDR-MRXNPFEDSA-N 449.223 2.403 10 20 IECD C[C@H](c1ccc(F)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735840 ZALOVPQXIFXNRA-VQIMIIECSA-N 440.519 2.363 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc4nn[nH]c34)cc2F)C[C@@H](C)O1 800205631 LIMWFGGCEVMNJH-OKILXGFUSA-N 441.463 2.184 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)cc1 805005322 NAWAXGKSGZRIRQ-UHFFFAOYSA-N 425.576 2.228 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCCCSc1nccs1 806277128 RBDUBMGAUNAJLR-CYBMUJFWSA-N 428.580 2.209 10 20 IECD COc1ccc(C)cc1CN1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806277446 CFZOKYLRIZZZSJ-UHFFFAOYSA-N 448.614 2.403 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCC4=O)cc2)C1 814379582 HXDXEAIDNXLIJB-GOSISDBHSA-N 441.553 2.386 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918140713 OJXFROCCWONLJT-GJZGRUSLSA-N 435.521 2.325 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 920311518 AVJFDFXPXAJPFN-UHFFFAOYSA-N 436.870 2.438 10 20 IECD C[C@H](NC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)c1ccc(N2CCOCC2)cc1 920887278 CIFPYVLWTIYEIH-AWEZNQCLSA-N 435.484 2.160 10 20 IECD CC(=O)NCCN(Cc1ccc(N2CCN(C)CC2)c(F)c1)[C@H](C)C(=O)OC(C)(C)C 1320822961 QAZNZOBAOJMAQL-QGZVFWFLSA-N 436.572 2.246 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505435 IFZYXRZKSALHRV-QLLAKKRXSA-N 430.501 2.083 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)N1C[C@H]2C[C@@H]2C1 1798325341 WTEAWWOHXODQFH-JWQALPOXSA-N 433.936 2.343 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCSCC1)CC2)c1cc(O)nc(O)c1 1816730829 BPCVLVYUINQXSH-LBPRGKRZSA-N 434.543 2.318 10 20 IECD Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817843755 YEHMCBZBTFRYCC-KRWDZBQOSA-N 436.472 2.468 10 20 IECD O=C(c1cnc(Cl)s1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442651 RFRZVGCJRGJCHU-UHFFFAOYSA-N 443.916 2.406 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2n[nH]c3c(Cl)cccc23)C1 1845591079 BBJMCTIMUARRHG-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CC(C)c1ccc(CC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056275 ZLTVIKNPJXZLCI-UHFFFAOYSA-N 445.610 2.416 10 20 IECD O=S(=O)(c1ccc(Cl)c(NC(=S)NCc2ccccn2)c1)N1CCOCC1 16214429 HGGODLAYXAFXEJ-UHFFFAOYSA-N 426.951 2.243 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(Cn4cncn4)cc3)CC2)cc1 28065250 XIQKDJDHXIVVCT-UHFFFAOYSA-N 434.544 2.277 10 20 IECD COC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1 727248328 ALDPNOQVEQZIJM-UHFFFAOYSA-N 442.482 2.373 10 20 IECD O=C1CCCc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1 728756808 LNQXVKLMEKPYDS-UHFFFAOYSA-N 440.475 2.192 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3N(C)C)cc2F)CC1 730390877 CNIWEGJAQCJJEM-UHFFFAOYSA-N 427.524 2.289 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c(OC)c1 743882562 AFUQILDVBBJZKB-UHFFFAOYSA-N 441.484 2.346 10 20 IECD Cn1cc(N2CC[C@H](NC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2=O)cn1 745832283 XMUBTFHONPAKRY-KSSFIOAISA-N 448.474 2.095 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 749656617 ZIVFIHCYXQALQS-UHFFFAOYSA-N 428.514 2.079 10 20 IECD CN(Cc1ccccc1O)S(=O)(=O)c1cc2c(cc1Br)n(C)c(=O)n2C 751241184 XJVBUQIUFBNTPZ-UHFFFAOYSA-N 440.319 2.166 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H](O)c1cccc(F)c1 752878941 HEVVYGGOBMWFKU-KLHJMIIUSA-N 428.508 2.449 10 20 IECD CCN(CCS(C)(=O)=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 753043088 NUZSYSZTRJZEKD-UHFFFAOYSA-N 437.484 2.118 10 20 IECD O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CC=CC2)cc1 754207121 IKCBXZJTWGCJST-UHFFFAOYSA-N 430.486 2.244 10 20 IECD COc1ccc(N2CCN(Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)CC2)cc1F 755271670 PMACGFOVOYEQID-UHFFFAOYSA-N 429.408 2.339 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1 760092026 UZJLXVVDSCZVIJ-KBPBESRZSA-N 430.480 2.406 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C(=O)[C@@H]2C1 761635105 HXEMMHVBWBRCEN-UNEWFSDZSA-N 437.443 2.473 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 761752112 PCFJGYHWUVKMPE-UHFFFAOYSA-N 440.319 2.001 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Br)cc(C(=O)O)c2)cc1 762467500 RBFKZFMFUXOKTR-UHFFFAOYSA-N 449.304 2.320 10 20 IECD COC(=O)c1cn([C@H]2CCCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)C2)nn1 762571093 KQGIZGVZVQOBFZ-LPHOPBHVSA-N 442.520 2.009 10 20 IECD COc1cc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c(O)cc1C 768441961 MSFQMPNXVJGUTB-UHFFFAOYSA-N 434.543 2.220 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=N)CN3CCCC[C@H]3C)cc2F)C[C@@H](C)O1 768516170 BBIRHNKUWUSWCP-KZNAEPCWSA-N 449.571 2.428 10 20 IECD O=C1c2ccccc2C(=O)N1C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 769533205 PCXPYKBMWUZRMA-CQSZACIVSA-N 431.832 2.451 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N(CCCO)C1CC1 770147565 FPQLPCQVNZJEDK-UHFFFAOYSA-N 435.458 2.088 10 20 IECD COc1cc2c(c(OC)c1OC)CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC2 770251868 MUPOIUCKADCLBX-UHFFFAOYSA-N 427.545 2.495 10 20 IECD Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cccc1S(=O)(=O)NC1CC1 773845357 HSEKOIGALAFYGY-OAHLLOKOSA-N 444.557 2.318 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccccc3C(=O)N(C)C)CC2)cc1 778238242 MKDQWXMJYZKVEE-OUKQBFOZSA-N 436.512 2.241 10 20 IECD CCOc1cnc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 778536670 VROQBQPWHVOSDM-GJZGRUSLSA-N 446.479 2.101 10 20 IECD COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 779541199 CPWUGUALGKRCFJ-LJQANCHMSA-N 433.530 2.339 10 20 IECD CC(=O)N1CCN(c2ccc(CN=c3c(Br)c[nH]cc3[N+](=O)[O-])cc2)CC1 786066291 DVYKSRVQCZDGKC-UHFFFAOYSA-N 434.294 2.455 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(Cl)c(S(C)(=O)=O)c3)cc2)CC1 786256071 QGRRVXPYMJYMGK-UHFFFAOYSA-N 449.960 2.342 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCN(Cc3ccccc3)C(C)=O)cc2)CC1 786256290 CUZWLVJNCIITNR-UHFFFAOYSA-N 436.556 2.410 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)OC(C)(C)C3)cc2F)C[C@H](C)O1 789823351 DFZJLWWZHBHWFA-HOTGVXAUSA-N 435.540 2.472 10 20 IECD COC1CCC(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789840408 HFDRAXQUSPKUIJ-UHFFFAOYSA-N 435.540 2.115 10 20 IECD Cc1ccc(C)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793732078 HBQWHIPNBRZTKS-HXUWFJFHSA-N 436.556 2.280 10 20 IECD CO[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771788 PKDLLJBICYBMQC-DMZKTXOQSA-N 447.447 2.453 10 20 IECD C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 799319919 OISBLNVQPKVDFX-NQIIRXRSSA-N 436.556 2.142 10 20 IECD CCC[C@@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805010111 URGYXBWSFGPKRY-DEOSSOPVSA-N 448.583 2.392 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 807469291 GNGQSDJXHDJQDY-CVDCTZTESA-N 438.572 2.117 10 20 IECD CCNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807953674 VXRFNIGETAFUAQ-HNNXBMFYSA-N 436.984 2.471 10 20 IECD CC(=O)N1C[C@H]2[C@@H](NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CCC[C@H]2C1 808357530 JNUFNTHOLYAOEK-DSKINZAPSA-N 432.540 2.233 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920925889 MCUMRANXZPFIMG-MRXNPFEDSA-N 445.541 2.133 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(C[C@@H]4CCCN4CC)C3)CC2)cc1 1341406045 CIBRNWIRDSENIZ-CTNGQTDRSA-N 428.577 2.067 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC=CCC3)C2)C1 1781161041 LYXVOAKNPJMWSD-ISJXGEBLSA-N 428.485 2.003 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2 1782007209 DREJTSMWAZJDNF-ZUOKHONESA-N 440.949 2.338 10 20 IECD Cc1nnc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)s1 1800715584 UYYSQDGYMZUHLJ-CLLJXQQHSA-N 436.921 2.406 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1F)CC2)c1cc(O)nc(O)c1 1816722498 JAZXTGRGKHXCKI-JTQLQIEISA-N 429.433 2.023 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817843834 CWGKSYNWJDPWEB-ZDUSSCGKSA-N 443.439 2.260 10 20 IECD O=C1CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1826537738 JZFOFLZDIHXTMP-IRXDYDNUSA-N 449.935 2.263 10 20 IECD C[C@@H](Oc1ccccc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1845241782 OEDNXUJRZORKCV-GOSISDBHSA-N 446.507 2.450 10 20 IECD CCNC(=O)COc1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cc1OC 13362922 LGGQFUPLJZDCPZ-GDNBJRDFSA-N 438.527 2.276 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNc3ccc(S(N)(=O)=O)c4cccnc34)cc2)C1 726377026 YNRQZQQFZVACLF-INIZCTEOSA-N 439.541 2.196 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1 733350817 CXXHDPTWYBGQJF-KRWDZBQOSA-N 432.565 2.486 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCc4nn(C)c(=O)cc4C3)c2C)cc1 742428618 DFRQCZPETWBGEM-UHFFFAOYSA-N 434.496 2.215 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN1CCC[C@@H](C(N)=O)C1 745830776 QBYBROLDENGJBV-CQSZACIVSA-N 441.370 2.274 10 20 IECD CCN(CC(=O)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1)c1ccc(OC)cc1 746109501 RBHDPCJPUDFDGC-QFIPXVFZSA-N 439.512 2.032 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(Cc2ccncc2)c1 746364393 PIFMPYHBKMDRRM-UHFFFAOYSA-N 436.541 2.135 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)C[C@H](O)c1ccccc1 754569795 LZBKPGFUXAQFMU-AVRDEDQJSA-N 431.508 2.071 10 20 IECD CNc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cs1 756203683 FEPNAOBPMRMPFZ-UHFFFAOYSA-N 448.526 2.279 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c(OC)c1 761247773 APEWWZQHMQIOLW-UHFFFAOYSA-N 427.548 2.001 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(Br)nc1)c1ccc(N2CCOCC2)cc1 766382659 PAGWQVVJCIYSGY-ZDUSSCGKSA-N 433.306 2.497 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cc(OC)ccc2O)cc1F 769658729 SKOIXGCLVZWKLC-UHFFFAOYSA-N 432.495 2.170 10 20 IECD COc1ccc([C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)N2CCOCC2)cc1OC 779494045 QFTDRWHSDRYVLQ-PYJQOMOHSA-N 428.485 2.318 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1[N+](=O)[O-] 780406969 BMYKGPRHTJIZSM-UHFFFAOYSA-N 434.474 2.073 10 20 IECD CCNC(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)cc1 787186051 YNDMMBQNNDONIQ-UHFFFAOYSA-N 428.508 2.354 10 20 IECD CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800794 ONZGJZADBUFNNY-YSGRDPCXSA-N 435.540 2.234 10 20 IECD Cc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 793735776 YTQPEMOPRXISDI-LPHOPBHVSA-N 440.544 2.043 10 20 IECD COc1ccc(CNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)c(O)c1 795356423 DAZOQPQXIGXYAQ-UHFFFAOYSA-N 428.264 2.224 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nn1 799232660 MBBWJZKXENRSKF-UHFFFAOYSA-N 439.394 2.440 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 803648219 VVBDTPQLPOUVQY-QHCPKHFHSA-N 432.568 2.360 10 20 IECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803686461 AUHJIUDGPMRFFK-UHFFFAOYSA-N 430.549 2.012 10 20 IECD NC(=O)CCOc1ccccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807512855 MGBSUJFHCBJBLZ-UHFFFAOYSA-N 426.256 2.208 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1CCCN(C2CCC2)C1 808021485 PEIIWTGORBZQOU-FPOVZHCZSA-N 442.604 2.251 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@H]1CCOC2(CCC2)C1 808855309 BOSMSHJOHFGHSW-NRFANRHFSA-N 440.588 2.053 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCOC4(CCSCC4)C3)CC2)cc1 809456821 CBUNUGLJUZWXLV-GOSISDBHSA-N 447.601 2.295 10 20 IECD CS(=O)(=O)C[C@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 917120654 KVAMGWKLJBBXII-HNNXBMFYSA-N 440.521 2.157 10 20 IECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 917365117 VIPIJFXMNGPRIS-HNNXBMFYSA-N 439.424 2.104 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCS(=O)(=O)c3ccc(F)cc3)cc2)C1 917832324 SUNCAJNVIDRKDD-KRWDZBQOSA-N 447.532 2.008 10 20 IECD CCN1C(=O)c2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2S1(=O)=O 918089828 XBCNWSGBPIRKGZ-UHFFFAOYSA-N 445.566 2.334 10 20 IECD CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCSCC2)cc1 918212889 ACLDQFZCSLPASD-IBGZPJMESA-N 440.635 2.243 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1 1778483000 SYWMVTBWVZRWSR-QFIPXVFZSA-N 443.525 2.190 10 20 IECD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cs1 1794907751 DNPXJBALQJORKY-DRXBFXEBSA-N 437.905 2.033 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1C 1804335753 JJJPBWDRCJXBHH-BJWYYQGGSA-N 431.583 2.416 10 20 IECD Cc1ccn(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727337 PFBQLRCACJIWJY-GFCCVEGCSA-N 427.486 2.136 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817843540 QUXCOOABYSMZFS-GDBMZVCRSA-N 429.477 2.481 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1cc(O)nc(O)c1 1817845608 RPBQLHQZKKJFKD-HNNXBMFYSA-N 426.408 2.370 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cncn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293782 PHHXVCVULOWFDY-AWEZNQCLSA-N 445.867 2.072 10 20 IECD CCOC(=O)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827429925 WKLORWWATFIJKL-QGZVFWFLSA-N 445.516 2.069 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1832235940 JUBIYMUWKFRAAO-CRAIPNDOSA-N 427.505 2.184 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(C3CC3)cc2)C1 1845509264 ANWIHBZBVIUOHT-UHFFFAOYSA-N 429.567 2.241 10 20 IECD NS(=O)(=O)c1ccc(CNC(=S)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 726445612 YWMCBTGYFURBJJ-KRWDZBQOSA-N 435.571 2.095 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1 728985600 YWPLWPXZGKCXIO-CQSZACIVSA-N 443.525 2.439 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c1 729534912 FPJCTJDSITZGPB-NSHDSACASA-N 436.515 2.488 10 20 IECD CCOC(=O)C1=C(COC(=O)c2cc(O)cs2)NC(=O)N[C@H]1c1ccc(OC)cc1 731911896 NBJYROPBGACGQH-KRWDZBQOSA-N 432.454 2.490 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3[C@@H](O)C(F)(F)F)cc2F)C[C@@H](C)O1 732201864 PSJSCMPORVXERD-VLBMKZOESA-N 447.473 2.443 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)c3cnn(-c4ccccc4)c3)cc2)C1 733758657 NZEHLTRZPYXDKE-SFHVURJKSA-N 431.496 2.073 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCc2c(O)ccc3c2CCCC3)c1 743719513 DOMLBNAUSNFOOZ-UHFFFAOYSA-N 430.526 2.458 10 20 IECD Cc1cc(C(=O)CN2CCN(S(=O)(=O)Cc3ccon3)CC2)c(C)n1-c1ccccc1 744414898 JXYZMZQKWSDMKF-UHFFFAOYSA-N 442.541 2.412 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn(-c2ccccc2Cl)nn1 746835136 MZKJHDSIDRFBRV-UHFFFAOYSA-N 445.932 2.086 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C4CCOCC4)CC3)cc2F)C[C@H](C)O1 747496201 TVHKSAMFCWXGDG-ROUUACIJSA-N 434.556 2.446 10 20 IECD Cc1cc(C(=O)CSCCO)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 747836622 BFIXCJLTOKEHEU-UHFFFAOYSA-N 438.571 2.023 10 20 IECD CCOC(=O)c1ccc(N2CC(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)C2)nc1 762074126 FOUPZXAPJYVQCE-UHFFFAOYSA-N 444.875 2.270 10 20 IECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3cccc(Br)c3O)ccc21 765728659 JAWUHQAFJJKXNJ-UHFFFAOYSA-N 446.301 2.110 10 20 IECD CCCc1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n(C)n1 772254658 JFMWVSYIWHWMTH-UHFFFAOYSA-N 438.576 2.160 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 772402741 JIRKHQCBRGDGPH-UHFFFAOYSA-N 446.573 2.434 10 20 IECD CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1Cl 774361567 HBWNJXGJBOSZPW-UHFFFAOYSA-N 433.892 2.434 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 785072494 WLNQOIMONGVVOA-UHFFFAOYSA-N 432.565 2.190 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 785297625 QMZCKBBZXOBJET-CQSZACIVSA-N 434.452 2.431 10 20 IECD C[C@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787905052 VGCBMVFUIVAAPD-SFHVURJKSA-N 448.583 2.174 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 788393745 BRMIMTCVIGXETL-QGZVFWFLSA-N 441.528 2.373 10 20 IECD COc1ccc(C)cc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789386938 KZDULQDTKFQJRB-UHFFFAOYSA-N 429.492 2.036 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](N4CCCCC4)C3)cc2F)C[C@@H](C)O1 789824191 GWGXQFFTFJLQLD-GGPKGHCWSA-N 446.567 2.142 10 20 IECD CN(C[C@@H]1COc2ccccc2O1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854396 HLVBNKBECCXMQO-LJQANCHMSA-N 441.553 2.154 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(S(=O)(=O)NC)o1 791247271 CPEDRNDYGMILMX-UHFFFAOYSA-N 437.518 2.190 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(S(=O)(=O)NC)c(C)c1 795064763 NMTIASJFFGGFLB-UHFFFAOYSA-N 425.576 2.180 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c(O)c1 797389598 PSHJNGFHRDSEDG-UHFFFAOYSA-N 435.362 2.255 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2cccc(O)c2)C1)c1ccc(N2CCOCC2)cc1 803301121 ZEVZZBXNQWDWCW-VGSWGCGISA-N 439.512 2.006 10 20 IECD C[C@H]1CC(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 803448358 PDGAFVYWONHKTL-KBPBESRZSA-N 425.476 2.445 10 20 IECD Cc1c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] 807810246 QLJAOBQEBNKFLR-SFHVURJKSA-N 427.457 2.433 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](CO)(c4ccccc4)C3)cc2)C1 813044278 WCTGIVDDLKKDFU-NLFFAJNJSA-N 436.556 2.234 10 20 IECD Cc1cc(C(=O)CN2CCN(C(=O)C(=O)NC(C)C)CC2)c(C)n1-c1ccc(F)cc1 821985744 TVPJABGBAYAJCS-UHFFFAOYSA-N 428.508 2.085 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccccc4OCC)CC3)nc12 916974472 KDLGPXCSBDWNRM-UHFFFAOYSA-N 425.489 2.333 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)cc1 917163871 HZYDSTPKMNPFAN-UHFFFAOYSA-N 444.963 2.245 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3c(=O)nc(O)c4ccccc43)cc2F)C[C@@H](C)O1 918141628 WTEGDBGLGQHRAY-HUUCEWRRSA-N 440.475 2.171 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920924504 CREZIJYXTPRUFO-QGZVFWFLSA-N 438.528 2.349 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1254279390 JFQBWZCYEWAWHY-SXSDINLZSA-N 431.533 2.137 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 1321367454 XBVUXJVBDMPCFT-OALUTQOASA-N 440.496 2.241 10 20 IECD CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c[nH]1 1804331350 UZJKAOJNPGGFLI-QDMKHBRRSA-N 448.614 2.424 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@H]1C[C@H]1F 1807821256 WDRMEAPCMZKYDH-ITBLURSFSA-N 449.486 2.238 10 20 IECD C[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)n1cccc1C=O 1809994198 RRFFTCWGWDEVAI-MRXNPFEDSA-N 440.500 2.213 10 20 IECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cc(O)n1 1818051455 NYFJIBJSRWOTJQ-HNNXBMFYSA-N 438.444 2.245 10 20 IECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 737131621 RRHHJVKWZLYRGI-UHFFFAOYSA-N 442.491 2.024 10 20 IECD Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NCc1ccc(N2CCOCC2)cc1 741671585 JCQKSECPDLSHEI-UHFFFAOYSA-N 429.542 2.302 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3cccs3)cc2)C1 749019259 XURLRVZSELUNTF-QGZVFWFLSA-N 443.573 2.069 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNS(=O)(=O)c2cccs2)cc1 751407008 SSTMCLUYUPDGBJ-SFHVURJKSA-N 437.587 2.300 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3nc(-c4cnn(C)c4)oc3C)CC2)cc1 752285654 VQIJWRIHXCFXRV-UHFFFAOYSA-N 438.532 2.334 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc4c(cc3F)NC(=O)CC4)CC2)cc1F 754040321 OMLCTDAAIUDDGP-UHFFFAOYSA-N 437.468 2.369 10 20 IECD Cc1cc(=O)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 761861672 VKPUUPILUGVWPT-GASCZTMLSA-N 432.452 2.134 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1 765236339 YROYNHFGKHRKPZ-UHFFFAOYSA-N 436.262 2.379 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1=O 771057803 KLMQDOOFCFHJGE-INIZCTEOSA-N 436.940 2.237 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 775046070 WRPYDFBKKKFBLY-UGKGYDQZSA-N 436.556 2.091 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775258770 BAIKVVGLMIJBSR-SFHVURJKSA-N 444.601 2.400 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](C)C(=O)NC(C)(C)C)cc2F)C[C@@H](C)O1 776849708 LVJOVSJCCKZIPP-BRWVUGGUSA-N 436.572 2.291 10 20 IECD CC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 777201905 JSLCVALZALPBAN-UHFFFAOYSA-N 432.423 2.477 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H]3C(=O)OC(C)(C)C)CC2)cc1 778311076 VKJABIVYPBOTMH-SGWGQVFISA-N 443.544 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3c(F)cccc3F)CC2)cc1 778346024 HXNFKVHEVYLRIY-QJRAZLAKSA-N 445.466 2.028 10 20 IECD C[C@H](OC(=O)c1cccc(C(N)=O)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781725822 CFVAFCGDDSZXGI-LBPRGKRZSA-N 443.415 2.140 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3(CNC(=O)OC(C)(C)C)CC3)cc2)CC1 786655664 HAUGNFAIRVDCKR-UHFFFAOYSA-N 430.549 2.276 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 786734119 DUGOEVDGIIDCBW-UHFFFAOYSA-N 449.577 2.127 10 20 IECD C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 787368201 WAHMJUZZQGGABQ-KRWDZBQOSA-N 439.512 2.006 10 20 IECD CCCC(=O)Nc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788014138 JVXZZMHILYKBEQ-UHFFFAOYSA-N 438.528 2.194 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1 788964381 NJDPMRUVHZWPKF-VXKWHMMOSA-N 430.593 2.033 10 20 IECD Cc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789837238 XGGOOJWUESNYIP-QGZVFWFLSA-N 443.519 2.295 10 20 IECD COc1cc(N2CCN(CN3C(=O)NC(C(C)C)(C(C)C)C3=O)CC2)cc(OC)c1OC 799569885 IQVCTFLTGQBIBT-UHFFFAOYSA-N 448.564 2.395 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)cn1 799636479 QLUFPQLNZXGEOE-UHFFFAOYSA-N 425.513 2.418 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21)c1ccc(N2CCOCC2)cc1 803298410 SSGSSFIYQQZOQN-VLQPXKRTSA-N 435.615 2.196 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 805010423 DWXOTNYMKJCJFC-CQSZACIVSA-N 444.966 2.403 10 20 IECD C[C@H](c1nccs1)N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806281875 AWNZBIPKZKHCRE-CYBMUJFWSA-N 425.605 2.103 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 808216940 GENYQYKJAZWWJY-JOCHJYFZSA-N 436.556 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnn4CC(F)F)n3)CC2)cc1 809464437 FZQNGPUQYOJIPF-UHFFFAOYSA-N 432.431 2.098 10 20 IECD COc1ccc(N2CCCN(C(=O)c3c(I)cnn3C)CC2)cc1 814107536 LLBKPZVIQKMALQ-UHFFFAOYSA-N 440.285 2.386 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4nc(OCC)[nH]c4c3)nc12 815441875 NDFALDVRYQOXRC-UHFFFAOYSA-N 425.401 2.244 10 20 IECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc2)CC1 863987891 OJBMJQKTYPMMEQ-UHFFFAOYSA-N 430.574 2.071 10 20 IECD Cc1c([N+](=O)[O-])cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 917832822 HGEAKUMFYVTJKM-OAHLLOKOSA-N 441.444 2.443 10 20 IECD C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919379600 HVMPBGGNZXBMNZ-LBPRGKRZSA-N 448.391 2.137 10 20 IECD COc1ccccc1[C@@H](CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)N1CCCC1 920980748 ZKSUYGAYQPLSJF-XCMFGDQWSA-N 430.574 2.205 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3nccc4c(S(N)(=O)=O)cccc34)CC2)cc1 1254501888 UEWPLIKKZVTXMB-UHFFFAOYSA-N 440.525 2.243 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)CC2)cc1 1319847091 JEOLLOONAMKBSY-UHFFFAOYSA-N 428.445 2.483 10 20 IECD CC(=O)N(C)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424224 JRSPICIOZVBAJF-UHFFFAOYSA-N 426.473 2.109 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cnco3)CCC2)cc1 1792314802 YPBHONOQYUWWNF-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2c(Cl)cccc2n1)c1cc(O)nc(O)c1 1797373848 QVLDWFQYNUDXHN-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccnc(F)c1 1803840096 KPXITWOBBZWHEF-FOIQADDNSA-N 437.431 2.055 10 20 IECD Cc1onc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1C 1803890108 VQERFWRWVZODFQ-MGPUTAFESA-N 437.456 2.126 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cccc2cc[nH]c12 1804333122 FIZTVRSHCYHCFV-QDMKHBRRSA-N 442.566 2.280 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCC=C1F)C2 1804340731 ZFSWTDQHVWEGIV-JHXTVGTDSA-N 443.541 2.231 10 20 IECD C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816013861 BAHBBOUBSUSCIN-BBRMVZONSA-N 439.476 2.055 10 20 IECD CC[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)N(CC)CC 1816720376 OHTXOENRWAJFNH-UKRRQHHQSA-N 447.561 2.296 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C(C)C 1817845920 BYTZNKGEOKNAQD-HNAYVOBHSA-N 445.476 2.110 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc(F)n1 1819734756 FPUPOMLKJFVPRW-CQSZACIVSA-N 426.408 2.370 10 20 IECD COC(OC)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708110 MAQSRYKTXPPGRI-VIFPVBQESA-N 441.893 2.052 10 20 IECD CCOCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708834 QLHLOARWGQYENQ-SNVBAGLBSA-N 425.894 2.470 10 20 IECD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1827425131 XYTZRDFMHNHGOZ-CRAIPNDOSA-N 431.533 2.277 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2F)C[C@@H](C)O1 108283888 LPPCOWITWVDZHV-AHCXZYCDSA-N 431.508 2.231 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2OCc2ccccn2)SC1=S 727176630 NIKBNGLHTHJDCB-ATVHPVEESA-N 449.579 2.411 10 20 IECD O=C(CCN(Cc1ccccc1O)C[C@@H]1CCCO1)NN1C(=O)NC2(CCCCC2)C1=O 731844913 RCUAXSICTDGORE-SFHVURJKSA-N 444.532 2.049 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1 746038144 NEYIDYBXPQJQLM-UHFFFAOYSA-N 425.533 2.240 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(c3cnn(C)c3)CC2)c([N+](=O)[O-])c1Br 746390552 JEJQBSLMGVUEFL-UHFFFAOYSA-N 441.242 2.334 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCC(C(=O)NCCCN3CCCC3)CC2)cc1F 746978667 ZSBHYDJBQXDQOL-UHFFFAOYSA-N 433.572 2.415 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)ccc2OC)cc1 747605833 CNGZIFHGVKETGA-UHFFFAOYSA-N 428.488 2.044 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCn2ccnc2C1 749209152 XCFFXKVPRNKXOD-SFHVURJKSA-N 435.507 2.018 10 20 IECD O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 753965702 GITZMNOWOGQYDS-GOSISDBHSA-N 437.562 2.039 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(C(=O)OC(C)(C)C)CC3)CC2)cc1 754030984 PXKJDXLYWRZXNP-OAQYLSRUSA-N 433.593 2.232 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(NC(C)=O)c3C)CC2)cc1F 754209662 BTAHHKWUKLWQLP-UHFFFAOYSA-N 428.464 2.388 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c(OC)cccc3OC)CC2)cc1 757155384 HYDDJGITCXEBGH-UHFFFAOYSA-N 428.485 2.147 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(C(C)=O)cc3[N+](=O)[O-])CC2)cc1 758225741 UTQQHKVIPJJIFY-IBGZPJMESA-N 429.473 2.368 10 20 IECD Cc1ccc(N(C(=O)COC(=O)c2cccc(O)c2O)[C@H]2C=CS(=O)(=O)C2)cc1C 758571266 CPFUNWXOOXPISD-INIZCTEOSA-N 431.466 2.215 10 20 IECD COc1cc(N2CCN(C(=O)C[C@H](NC(N)=O)c3cccs3)CC2)cc(OC)c1OC 759406674 UXTCSBAIGOKOGT-HNNXBMFYSA-N 448.545 2.222 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)Nc1cc(-n2cnnn2)ccc1F 760839563 AMQAWSFZXVCEMN-KRWDZBQOSA-N 426.452 2.127 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3-c3cccc(F)c3)CC2)cc1F 770748404 JGDKAXYZMZOCEK-UHFFFAOYSA-N 441.438 2.446 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl 772982167 UFKYIXVQSOEYCG-FUHWJXTLSA-N 446.013 2.316 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1F 773249942 ROPFTGKAMHLCNT-UHFFFAOYSA-N 436.870 2.438 10 20 IECD CC[C@@H](C)n1nc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1C 776042287 PYZYVQCBQDNTHX-QGZVFWFLSA-N 442.564 2.048 10 20 IECD COC(=O)[C@H]1CN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 778270963 CIHBJIOTTNJUEJ-GMGKOPGTSA-N 449.507 2.203 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccccc3Cn3cncn3)CC2)cc1 781397304 YRDCETHVZJEEPC-UHFFFAOYSA-N 427.530 2.236 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 781533560 JACOICJEPCBFPA-UHFFFAOYSA-N 447.542 2.358 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)cc1 784058392 SXZVUSFMWSGIIC-UHFFFAOYSA-N 430.530 2.481 10 20 IECD O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 785538564 DDHOWPPUDLABQM-UHFFFAOYSA-N 436.556 2.052 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1 787203831 VIEHAWJLCCPNET-SFHVURJKSA-N 439.560 2.086 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1 788966423 LDLFYKIJHNXGQX-UHFFFAOYSA-N 431.558 2.010 10 20 IECD CO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1(C)C 789949721 KHLAUTZHHJMWCG-SJORKVTESA-N 443.466 2.088 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2c1=O 792966715 PMCMYDPLFMIRRI-UHFFFAOYSA-N 436.537 2.347 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(S(N)(=O)=O)ccc2F)cc1 798322269 RLVOIIOHMFPTIW-QGZVFWFLSA-N 435.521 2.361 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cc1 803686659 GAXYLCKMOUOCMR-UHFFFAOYSA-N 436.556 2.479 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2cccc(CS(C)(=O)=O)c2)C2CC2)cc1 803705117 RCABDKDGJACWFT-UHFFFAOYSA-N 443.569 2.105 10 20 IECD CCN1CCO[C@@H](C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 805473115 KGIKSJXYCWPLDA-VBKZILBWSA-N 436.464 2.053 10 20 IECD CN(C)C(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806495603 IKWGCBVMCRTEQL-QUCCMNQESA-N 445.564 2.151 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)o1 806792978 HOBXMGYTFXCQSU-FQEVSTJZSA-N 429.517 2.393 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)c3Cl)cc2)C1 806857494 RELVLHJAUWABOI-CQSZACIVSA-N 432.883 2.436 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC)c1 807079271 OLGPCVIZUPUTHL-UHFFFAOYSA-N 437.493 2.207 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 807671446 PESHUCSSBHUFRB-HSQYWUDLSA-N 425.529 2.281 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccnc(N(C)C)n3)cc2Cl)C1 807954326 OUXJFAWZVZKJAD-HNNXBMFYSA-N 444.967 2.365 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@H]1CCOC1 807954953 IXFHYULOVSORSY-AEFFLSMTSA-N 437.968 2.456 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 812493853 YBQCQKHIYHSZRC-GASCZTMLSA-N 428.526 2.202 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c[nH]1 814531861 MKBRBAHJJAHKLK-KBPBESRZSA-N 447.463 2.027 10 20 IECD COc1cc(Br)cc(CN(C)CCOc2ccc(S(N)(=O)=O)cc2)c1O 816625280 ZJFZEQVZZCXKAD-UHFFFAOYSA-N 445.335 2.322 10 20 IECD C[C@@H]1CCC[C@@]1(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818999572 LDCBNUDQITXMEU-ZUOKHONESA-N 449.485 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)S(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 879288546 DPVPREDHBOJTBA-UHFFFAOYSA-N 431.558 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)CN(/C=C/c4ccccc4)C3=O)CC2)cc1 915672861 KDVONKDWVQMEIV-VAWYXSNFSA-N 434.496 2.279 10 20 IECD COC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918035907 NRNVSGSTFMEERP-KRWDZBQOSA-N 440.500 2.262 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 918136364 YWCIHEOMUMQMDE-UHFFFAOYSA-N 447.580 2.411 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3C(=O)c3ccco3)cc2)C1 918659673 REVLMFJDEUSKBV-QUCCMNQESA-N 438.528 2.292 10 20 IECD O=C(COC(=O)/C=C\c1ccc2c(c1)OCO2)NCc1ccc(N2CCOCC2)c(F)c1 918874416 BGUBRFUFXSPVPE-UTCJRWHESA-N 442.443 2.264 10 20 IECD Cc1nocc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121471 XXPSWPZQZMKTDJ-DYESRHJHSA-N 449.891 2.489 10 20 IECD Cn1nccc1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313929 LFIZUWXMKHYUPG-UHFFFAOYSA-N 443.554 2.028 10 20 IECD CCN(CC)C[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1824582074 RWVLWUJIVQHQSN-TZMCWYRMSA-N 447.561 2.153 10 20 IECD O=Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441705 AVYKTSMWBCXKNH-UHFFFAOYSA-N 436.493 2.171 10 20 IECD C[C@H](Oc1ccccc1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039434 OQTRCIHAKVDFOF-SOGBHIHOSA-N 438.480 2.488 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(CCNC(=O)c3ccccc3F)CC2)cc1F 731284482 WBXLIDUZHYGGMQ-UHFFFAOYSA-N 445.514 2.288 10 20 IECD CNC(=O)c1ccc(CN(C)Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)cc1 732527494 ZURDTJFOBZGIDL-UHFFFAOYSA-N 425.529 2.419 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(N)=O)c2)cc1 740812042 OTDGJEBLHVDUGL-UHFFFAOYSA-N 441.531 2.137 10 20 IECD COCc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 742572540 BXKKFZNUJYHKNM-UHFFFAOYSA-N 426.452 2.007 10 20 IECD CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748042708 MOBXGCPJRLFNEO-RYUDHWBXSA-N 425.532 2.288 10 20 IECD CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 748185788 LIYYQJHFAKPGHA-AZUAARDMSA-N 428.577 2.432 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3c[nH]nc3-c3ccc4c(c3)OCO4)CC2)cc1 751673370 IRGGWNQVKRVEOB-UHFFFAOYSA-N 449.511 2.366 10 20 IECD COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc(C(=O)OC)c1 759595028 PHPAAICHIOVYLB-HOSRBBHYSA-N 443.408 2.255 10 20 IECD COc1cc(N2CCN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 759886565 MXXZFEWRSPWNEJ-UHFFFAOYSA-N 444.488 2.406 10 20 IECD COc1cc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)ccc1OCCN(C)C 761665540 IIOVTRBYPGMERW-UHFFFAOYSA-N 448.501 2.430 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@]4(CCSC4)C3)cc2)C1 769035820 BXRINAQIVQCPAD-KGVIQGDOSA-N 432.590 2.242 10 20 IECD CCOC(=O)Cc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772910104 NAUGZGCYASSBOH-UHFFFAOYSA-N 429.492 2.496 10 20 IECD Cc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cccc1C(=O)N1CCOCC1 773860058 YIEAIFDBINLJIQ-KRWDZBQOSA-N 438.528 2.349 10 20 IECD Cc1ccc(C(=O)Nc2ccc(N3CCN(S(=O)(=O)C(F)F)CC3)cc2)c(O)c1O 780950858 OMNQIGCJDHJURV-UHFFFAOYSA-N 441.456 2.333 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 782783800 PTHMTDRQVLFPED-AWEZNQCLSA-N 428.445 2.256 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)CC2)cc1 784356756 SIIHSBRYLQEINK-YADHBBJMSA-N 427.545 2.175 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2n1 788313086 PQBILGGAVVJNOG-UHFFFAOYSA-N 434.496 2.013 10 20 IECD CCc1nc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 789846032 YXXBXCYHMVWHAM-UHFFFAOYSA-N 434.537 2.081 10 20 IECD CCN1CCN(C[C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 790209114 LGCIAQKJZWDMKK-FQEVSTJZSA-N 444.620 2.443 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 793910930 KRWYYAYMWJCYLD-HDAAZOAOSA-N 431.577 2.382 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)c(O)c1 797389338 BPDZQSPBPLEOBZ-UHFFFAOYSA-N 443.525 2.153 10 20 IECD COc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 803450786 QVXZHEXMPJZAAP-UHFFFAOYSA-N 434.443 2.093 10 20 IECD CCN(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855342 WZQATEDLDPQFBO-UHFFFAOYSA-N 435.572 2.279 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc4nc(C)nn4c3)CC2)cc(OC)c1OC 809897944 OTEMUMKBAWJJLI-UHFFFAOYSA-N 426.477 2.418 10 20 IECD Cc1noc(C)c1S(=O)(=O)NCC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 810075673 RXTUNHHYFAGPNK-UHFFFAOYSA-N 446.529 2.458 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc2cccnc12 815356277 KHQVHDGWXYGNNJ-UHFFFAOYSA-N 438.459 2.474 10 20 IECD CCC[C@@H](C)N1C[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 917521015 KZCSYRHPQGEOBI-UXHICEINSA-N 430.593 2.361 10 20 IECD CCC[C@H](C)N1C[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 917521016 KZCSYRHPQGEOBI-VQTJNVASSA-N 430.593 2.361 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1NC(C)=O 917918645 RKERDXPYHXBSLR-UHFFFAOYSA-N 437.493 2.108 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc(C(N)=O)c3)cc2F)C[C@@H](C)O1 918023383 PPQVBLMDPLHSMQ-CALCHBBNSA-N 442.535 2.286 10 20 IECD CC(C)NC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337880 QQAVUPAXCCCVOF-UHFFFAOYSA-N 444.557 2.381 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2cccc(F)c2)n1 920291484 ZFLNTVCAOCNUCS-UHFFFAOYSA-N 428.489 2.176 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1 1320150712 YZBOKEVIJPSHQT-MSOLQXFVSA-N 449.548 2.156 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(c2cc(C)cc(C)c2)C1=O 1320385320 GWJGESTUMGCXRW-OALUTQOASA-N 440.496 2.358 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC1CCCC1)C2)c1cc(O)nc(O)c1 1777849284 RXAVSCAOANXOPF-VGOFRKELSA-N 449.573 2.296 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1ccncc1F)CCO2 1782005487 JFYXUQSUOJUTGY-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c(C)n1C 1782007875 YVZQLSVPIFSVCV-QFIPXVFZSA-N 447.919 2.464 10 20 IECD CC1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCCC1 1785503398 JIJKPDNIXDHAGJ-NKOINVLESA-N 430.501 2.227 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cnoc2C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992134 VHTQLJQFRBFCMT-FOIQADDNSA-N 449.467 2.387 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2[nH]cc3c2CCC3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994264 FHSHGFAACJEEML-OPAMFIHVSA-N 447.495 2.338 10 20 IECD CCC(=O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811808498 CKDIZKQORKAVHJ-SCLBCKFNSA-N 431.876 2.445 10 20 IECD Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816721475 LVRKJYJCPDGEJP-GFCCVEGCSA-N 425.470 2.192 10 20 IECD CCc1ccnc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1843197267 JHRZJPXXMXSBAU-UHFFFAOYSA-N 431.496 2.254 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2nc3ccccc3[nH]2)C1 1843643814 UCLIFMVLTAGTQZ-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CN(C)C(=O)Cn1ccc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 726698485 WEXNKMCFIGZEJX-UHFFFAOYSA-N 436.463 2.363 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1 727359605 VPIUTEBNBVJYIB-UHFFFAOYSA-N 444.513 2.350 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)CC2)cc1 737138700 LEXQAHFGSBIGER-UHFFFAOYSA-N 438.463 2.092 10 20 IECD CCNC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 737156688 CKNKLBCLOOFMJD-MRXNPFEDSA-N 439.516 2.481 10 20 IECD CNC(=O)CCOc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958299 QIQLPBKYORFHGT-UHFFFAOYSA-N 425.485 2.041 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc21 746036829 APYBCLYCOYKKLZ-UHFFFAOYSA-N 427.480 2.239 10 20 IECD CO[C@@H](C)c1noc(CN2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 750061053 UEMOHDMYJXQURN-SFHVURJKSA-N 444.580 2.009 10 20 IECD O=S(=O)(NCCS(=O)(=O)N(Cc1ccccc1O)C1CCCC1)c1ccccc1 751362952 XMZHNUJBARDSKM-UHFFFAOYSA-N 438.571 2.445 10 20 IECD CN1CCCc2cc(CNC(=O)[C@@H](CCC(N)=O)NC(=O)OCc3ccccc3)ccc21 760139568 SSUOFDPLTUURGI-HXUWFJFHSA-N 438.528 2.246 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N3CCc4c(F)cccc43)CC2)cc(OC)c1OC 763431100 QITBLILAEYJGHT-UHFFFAOYSA-N 443.475 2.089 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 764254632 PLKYHMWVYWAQPQ-IBGZPJMESA-N 426.469 2.254 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1 769690808 XYQCRRNIMALGSN-UHFFFAOYSA-N 433.486 2.017 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]2CCCC[C@H]2N1 769984451 UNOCPPPZVQQYBI-CABCVRRESA-N 435.527 2.138 10 20 IECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 771249293 GOHMSEFEHPABFR-DEOSSOPVSA-N 436.512 2.379 10 20 IECD Cc1nc(S(=O)(=O)N2CCC(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cn1C 773012364 BNODPWKMBPLCBW-OAHLLOKOSA-N 433.578 2.073 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc([S@@](C)=O)c3)CC2)cc1 778267744 FNXJYUQOUSVPEL-HQRUERIFSA-N 427.526 2.276 10 20 IECD C[C@@H](NC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 782717443 RXTKSMWVAKDUJX-QGZVFWFLSA-N 446.573 2.334 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCN(c2ccccc2)CC1 788011306 YLTSZMCMVXRAQD-UHFFFAOYSA-N 438.572 2.459 10 20 IECD CC(C)(C)OC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788939711 VPHCQSGGERPYID-UHFFFAOYSA-N 430.549 2.372 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1csc(-c2ccco2)n1 789812595 NDMVWZFADPJVRE-UHFFFAOYSA-N 444.488 2.311 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 789823021 XUGFMLJFLXBBCJ-IAGOWNOFSA-N 428.508 2.118 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789825486 MHACKCQWJYQGAL-OKILXGFUSA-N 432.496 2.019 10 20 IECD Cn1cc([C@@H]2CSCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 790237020 IXFKHSDOUAMPNP-XLIONFOSSA-N 442.589 2.122 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)NC)c(C)c2)cc1F 795100321 JHDMSAWQDBBOAG-UHFFFAOYSA-N 443.566 2.367 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12 801550044 MBKFQWXCSKFFEF-UHFFFAOYSA-N 427.486 2.246 10 20 IECD COc1ccccc1CCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297466 WVXHKISKMZJKRS-GOSISDBHSA-N 425.529 2.410 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803297828 HQWJRBVSTWKFSH-CTNGQTDRSA-N 436.556 2.486 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@@H]3CC(C)(C)C)CC2)cc1 803750624 MEBSVBJBXHBTMN-HXUWFJFHSA-N 430.593 2.361 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccnc3OCC(F)F)CC2)cc1 804318373 JAFBSADRFLGYAA-UHFFFAOYSA-N 448.470 2.136 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 804708917 UYJLXBNGGCBKKX-KRWDZBQOSA-N 432.565 2.441 10 20 IECD COCc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 806844474 YGDHZUQUEFPMTD-BETUJISGSA-N 436.509 2.297 10 20 IECD C[C@H]1N(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOC1(C)C 807768354 HQHZPSVCFCQEQF-HUUCEWRRSA-N 425.476 2.399 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(CN2CCOCC2)CCCCC1 807856365 RDSKIOFLZGTKGF-UHFFFAOYSA-N 430.593 2.110 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@H](O)c3cccs3)CC2)cc1 811818439 NIWMFTYCILZRSO-WIYYLYMNSA-N 428.558 2.218 10 20 IECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 915906238 UINPXJDHOCULHU-GOSISDBHSA-N 444.532 2.338 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4O)CC3)cc2)C1 918117671 HOPDIFGQPMDFFZ-LJQANCHMSA-N 437.544 2.126 10 20 IECD Cc1oc(CO)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918924826 BMRQSHWTAXRGGZ-ZIAGYGMSSA-N 434.464 2.306 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1)c1ccc(N2CCOCC2)cc1 920923737 TZNDVDIMQAOQQB-MRXNPFEDSA-N 438.484 2.296 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nc(-c2cccs2)no1 1254761030 JHWNUBRQCFKGNJ-ZDUSSCGKSA-N 431.470 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4nnc(C(F)F)n4c3)CC2)cc1 1319420477 AWSAEAWKDHGNMW-UHFFFAOYSA-N 445.426 2.181 10 20 IECD CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1319931494 NEZKVLDATVTTJA-QGZVFWFLSA-N 444.511 2.433 10 20 IECD O=C(NCCN1C(=O)COc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 1320719618 HKMSNYDUOZWJNU-UHFFFAOYSA-N 438.528 2.120 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 1324122057 ZUMUPWLKCBBGRT-HOTGVXAUSA-N 436.505 2.478 10 20 IECD C[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1(F)F 1785399039 WXNNAJLQKLWGAM-QZTJIDSGSA-N 430.835 2.240 10 20 IECD Cc1nc2sccn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1798214765 FOVNNWHWFWODMU-BTTYYORXSA-N 427.486 2.076 10 20 IECD C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CC1(F)F 1808000417 IMDNCEHPXROKQX-YXKFXFPPSA-N 432.427 2.253 10 20 IECD COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)nc1 1810551178 DJNHGIPPPFMALU-UHFFFAOYSA-N 426.473 2.055 10 20 IECD CCC(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717337 BAVJPBILDLIRLL-HXUWFJFHSA-N 438.528 2.378 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1)CCO2 1838852006 MBIYMTUVXZSFAV-JOCHJYFZSA-N 446.887 2.135 10 20 IECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732673642 BJNNAIZAFNMYIB-ZDUSSCGKSA-N 437.484 2.117 10 20 IECD COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 737144237 BTURJRFOZOOOQN-UHFFFAOYSA-N 431.876 2.218 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1 743917960 OGOAOHRERYRQQX-UHFFFAOYSA-N 447.474 2.310 10 20 IECD Cc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1 745692248 SVYSFTNAPKVLLW-SIKLNZKXSA-N 449.555 2.301 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 748061255 ZCWBLZOLAMGGLS-UHFFFAOYSA-N 425.938 2.139 10 20 IECD CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 748344162 XLYFROMGUYZROM-HNNXBMFYSA-N 425.551 2.312 10 20 IECD CN(CC1(O)CCCC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 752662295 SVRQJOLOAFHRJN-UHFFFAOYSA-N 449.485 2.478 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4cc(F)ccc4F)C3=O)cc2)C1 761117627 GRYSFQZSQJWPDT-AUUYWEPGSA-N 428.439 2.460 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 768040434 OHPGLOINNSQZMD-HOTGVXAUSA-N 429.558 2.404 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NCCCSc1nccs1 768100794 YCLWJLYNKNXSCY-UHFFFAOYSA-N 448.570 2.161 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CC(=O)N(C(C)(C)C)C4)n3)CC2)cc1 771058029 SAGIDTNDPHAOQH-INIZCTEOSA-N 441.532 2.084 10 20 IECD COc1ccc(NC(C)=O)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772901517 HSJULKIHYIGJQM-UHFFFAOYSA-N 430.480 2.358 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3ccccc3Cl)CC2)c1O 774819487 NEAFTYLRIFMWEK-UHFFFAOYSA-N 441.893 2.469 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779011500 DZUUMVQVNYKTMG-STQMWFEESA-N 427.523 2.139 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 781446688 DIFWTLNTPJTHJM-UHFFFAOYSA-N 425.485 2.468 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NCc2ccc(N3CCCC3=O)cc2)cc1 784561723 CBAQMXIDSVDYLH-UHFFFAOYSA-N 425.485 2.118 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)cc1 785427910 HFXMHWNSJQOUMZ-UHFFFAOYSA-N 431.496 2.333 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(F)nc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785630876 YDTQZNQSMZPGDL-UHFFFAOYSA-N 431.445 2.315 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3c(F)cccc3Cl)CC2)cc1 786909826 YAGKZTRZVDHOQV-UHFFFAOYSA-N 448.926 2.042 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)nc3)CC2)cc1 787179938 HOXDTSVJLWOCSW-UHFFFAOYSA-N 437.544 2.046 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 787198073 MWMCQKAJCWFDDB-HDICACEKSA-N 440.544 2.456 10 20 IECD O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788379824 ODVBDVQAYXGNTN-NRFANRHFSA-N 434.496 2.402 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789828779 YLITVNXDSNMEQP-ZHALLVOQSA-N 434.556 2.045 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ncccn2)C1 790259227 GYQMEPRFUAFTPY-FQEVSTJZSA-N 436.560 2.211 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)OC4(CCOCC4)C3)CC2)cc1 790643840 RKQZDKHZOABSIU-FQEVSTJZSA-N 446.592 2.187 10 20 IECD CN1CCCc2cc(CNC(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)ccc21 791341562 SKSDBCFPUSRAOH-SFHVURJKSA-N 428.920 2.013 10 20 IECD COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 792934038 KDCIZSBHMDINDW-AUSIDOKSSA-N 439.556 2.354 10 20 IECD Cc1cccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 793733271 LYHNCKVVBCTPBF-KNQAVFIVSA-N 449.555 2.072 10 20 IECD Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793754661 DPIXNHOQIQJVJR-ZFWWWQNUSA-N 435.475 2.292 10 20 IECD CCN(CC)c1ccc(CNc2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1F 796417756 NJHFTGAYPMTLNV-UHFFFAOYSA-N 434.537 2.405 10 20 IECD CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 799537022 ASQBJYCEQGJCLR-QGZVFWFLSA-N 449.617 2.492 10 20 IECD CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807286914 FFQODSNFGPFEES-SFHVURJKSA-N 428.533 2.052 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807386802 JYJNKYWKVIJEOV-UHFFFAOYSA-N 440.681 2.423 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 807860859 BDRDCTGEDBYBND-UHFFFAOYSA-N 434.518 2.296 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@H](C)S1 808855998 NIBMBVVACRKINO-ROUUACIJSA-N 430.618 2.187 10 20 IECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808856369 SRZQTGBQNYGMGZ-GOSISDBHSA-N 430.618 2.189 10 20 IECD O=C(NCc1ncnn1-c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 809867651 PIFFBXYYWMJRFJ-UHFFFAOYSA-N 431.452 2.411 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)Nc3cccc(Cl)c3)cc2)CC1 857494035 HNYKOVIRIXCCIX-UHFFFAOYSA-N 443.935 2.446 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)OCC(=O)c3ccc(O)c(O)c3)CC2)cc1 916608935 XRGUWSVHVPYQJM-UHFFFAOYSA-N 433.482 2.233 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)NC(=O)CCS4)nc12 918983480 YZSJYQDOAJCKHN-UHFFFAOYSA-N 442.453 2.403 10 20 IECD CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920195677 ZKOFZACQINMEPT-UHFFFAOYSA-N 438.528 2.306 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1 1795697811 SDVDATBPNGGYDS-FTVYIWHSSA-N 429.567 2.198 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)C(=O)c1ccc(Cl)cc1 1796600985 NVNHFADFPDGHBF-MUJYYYPQSA-N 429.860 2.281 10 20 IECD CC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CCCCC1 1802082306 DEDKOZZVNYVPGK-WVBGYWIOSA-N 444.528 2.377 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](CNC(=O)C(O)O)[C@@H]2c2cccnc2)cc1 1802923185 OPKGCFWKSCPIBI-UNMCSNQZSA-N 448.523 2.119 10 20 IECD C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CC1(F)F 1814073815 JESGIXGXUOTLJA-ASUYLVSUSA-N 432.427 2.253 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCOC2)[nH]n1 1823479802 QPZIUBXIBUNCLY-ZCGHOXCVSA-N 442.472 2.269 10 20 IECD Cc1ccc(C(=O)C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843442135 BMBSZSUUSDRWCW-UHFFFAOYSA-N 444.491 2.174 10 20 IECD O=C(CCCn1cccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442439 NJSJMAZEILFLEZ-UHFFFAOYSA-N 433.512 2.265 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(F)c1 1845335401 PDKKOYCHKJYCTO-XBXARRHUSA-N 442.443 2.482 10 20 IECD Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCN(CC(=O)NC(C)(C)C)CC1 40060087 XCECNVQYQHOUPG-UHFFFAOYSA-N 429.590 2.238 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3onc(C)c3c2)cc1OC 726766866 PIWCYDSYZSWZKL-UHFFFAOYSA-N 426.476 2.102 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1NS(C)(=O)=O 733648480 SNQGTYPXVQMAQI-INIZCTEOSA-N 432.546 2.455 10 20 IECD COCCN(CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)OC(C)(C)C 734015916 ZRMWHOCFIHQHNM-UHFFFAOYSA-N 439.528 2.287 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(OC(F)F)c1 734176902 FIMVKPNEZYYJFS-KPKJPENVSA-N 438.499 2.047 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)c3cccc(F)c3)CC2)cc1 734655738 TXMRZAWAJWKGDI-QFIPXVFZSA-N 430.524 2.379 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C[C@@H](C)O 741081373 OTJJFRGDODROHI-DLBZAZTESA-N 430.528 2.149 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)NCc2c(O)ccc3c2CCCC3)cc1OC 743718493 DHKUKFBDVXDFHY-UHFFFAOYSA-N 448.541 2.273 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3csc(N(C)C)n3)CC2)cc1 747508053 SQTARXNJSYRQAZ-UHFFFAOYSA-N 432.594 2.229 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 749625340 HWWLCMWIGVRRRC-LJQANCHMSA-N 441.484 2.172 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4nc(C)c(C)s4)CC3)CC2)cc1 754349950 VYZBKXCPRWUMAK-UHFFFAOYSA-N 429.590 2.239 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCNc2ccc(-c3ccccc3)nn2)c1 754472177 QAABWVFKHSFSFZ-UHFFFAOYSA-N 427.486 2.063 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1OC 757657842 YLCGSYAPDNLJRH-UHFFFAOYSA-N 446.478 2.183 10 20 IECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NCc1cccc(Br)c1O 764763282 UFPHKCVLHROSEC-UHFFFAOYSA-N 439.310 2.209 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](c4nccn4C)C3)CC2)cc1 767782602 WLUQBVGLIQIWJW-LJQANCHMSA-N 426.565 2.140 10 20 IECD O=C(Cn1nnc(-c2ccccc2)n1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912575 OUZDFMUNPCAWQO-GOSISDBHSA-N 426.908 2.480 10 20 IECD C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 772055307 DHRGJVHXTPIKII-LLVKDONJSA-N 448.391 2.288 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)N1CCCS1(=O)=O 772676768 GACOTOLSIDPIML-YRNRMSPPSA-N 441.569 2.116 10 20 IECD CC(C)[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS1(=O)=O 772700741 XDDKGUMHYLMTHR-QAPCUYQASA-N 445.532 2.433 10 20 IECD CCCNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c2ccccc2O1 773845375 HZKVHOIINWEIGB-KKSFZXQISA-N 438.528 2.250 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc(OC)c(F)c3)CC2)cc1 778258322 PXBZBFCHOAOASY-KTKRTIGZSA-N 441.503 2.407 10 20 IECD CCCN(C)C[C@H]1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295639 RTGYRLKPPVLNHU-GDCKJWNLSA-N 428.577 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 778395772 SVQZVIIBEDLAJK-PKBUSWEQSA-N 439.556 2.364 10 20 IECD O=C1NC(=O)C2(CCN(Cc3cc(Br)cc(Br)c3O)CC2)N1 780892024 HDOAISLXQOHFMJ-UHFFFAOYSA-N 433.100 2.091 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 782108230 YDZABDDYBLTIPO-OAHLLOKOSA-N 441.484 2.134 10 20 IECD C[C@H]1CCCN(CCCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 787914273 YNKNXWLVOUHJCE-VQTJNVASSA-N 430.593 2.329 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccnn1C 789859773 HQQPXGIYUXICNT-IBGZPJMESA-N 429.590 2.146 10 20 IECD C[C@@H](COc1cccc(F)c1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793785384 QBRDZYOWYVHCGL-KRWDZBQOSA-N 429.492 2.204 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c1 795801456 JVAPOSGKWDQRLU-UHFFFAOYSA-N 449.598 2.095 10 20 IECD COc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCCCC3)cc1)OCC(=O)N2 797445053 WZNRSIJIYQVRGQ-UHFFFAOYSA-N 431.514 2.495 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCC[C@H](N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 803309524 ZFIIKGQMFNLLFE-KNQAVFIVSA-N 428.577 2.177 10 20 IECD CCN(C[C@H]1CCOC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449291 UYCGKJRQAUVERI-OAHLLOKOSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1 806333007 CSXWXFRMIFEXSA-CBQGHPETSA-N 429.609 2.474 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 808345707 GGMPJAXELVQWEU-GOTSBHOMSA-N 444.620 2.374 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)CCn2cnccc2=O)NC(=O)OC(C)(C)C)cc1 815710827 WTXHHXMGEJPPFC-GOSISDBHSA-N 429.521 2.082 10 20 IECD O=C(c1ccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)cc1)N1CCOCC1 915219872 MINUXADVXYGWOV-UHFFFAOYSA-N 430.511 2.478 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)CCC3CCCCC3)CC2)c1 919816723 FKMFSWQTINXXMQ-UHFFFAOYSA-N 437.562 2.409 10 20 IECD O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)NCc1ccc(N2CCOCC2)c(F)c1 1319127077 ODJBGCXHMXYWDT-UHFFFAOYSA-N 428.464 2.245 10 20 IECD Cn1ncc2cc(S(=O)(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cnc21 1320446893 PQZVXLMCQKSXQV-INIZCTEOSA-N 435.937 2.270 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(F)cc1F 1780488138 QGPXMWDJFDSXRS-VGOFRKELSA-N 447.438 2.212 10 20 IECD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)nc1 1782004817 NEJMYRFLBTUPHB-OAQYLSRUSA-N 431.876 2.212 10 20 IECD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)n1cccc1 1807998784 OMJATRIJXGODFB-QLVMHMETSA-N 435.484 2.270 10 20 IECD O=C(Cc1cccs1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815589756 MAKZRLZSAILFOS-NSHDSACASA-N 430.511 2.479 10 20 IECD Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817844193 SQTCRJTYEDVNIL-CYBMUJFWSA-N 443.439 2.017 10 20 IECD Cc1nccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427956 VOPKTQVJSUJUKA-SFHVURJKSA-N 425.489 2.138 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1cc(O)nc(O)c1 1828336005 MHKYESNPDDOFTL-LBPRGKRZSA-N 434.543 2.318 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(F)F)CCO3)cc1 1834917295 DJZYZKFAMRNGDZ-HSZRJFAPSA-N 447.482 2.429 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccnc2Cl)C1 1840969885 FIJNRVNRVPGWHB-FNORWQNLSA-N 429.860 2.382 10 20 IECD CC(C)N1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1848053222 FSMXSJUVEGQUFN-RMSIBTEPSA-N 443.544 2.139 10 20 IECD CSc1cccc(-n2c(C)cc(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)c1 25113674 GPQLJXHFKBTSBR-UHFFFAOYSA-N 437.525 2.446 10 20 IECD CCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 726975480 BVWWGLCHRLXRRV-UHFFFAOYSA-N 438.571 2.189 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3cccc(OCC(N)=O)c3)cc2F)CC1 730115648 WQDWJMZWPREKGS-UHFFFAOYSA-N 429.496 2.153 10 20 IECD O=C(CN1CCC[C@@H](N2CCCC2=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 732210702 DPKCUVAKLBPSOV-MRXNPFEDSA-N 431.492 2.487 10 20 IECD Cc1cc(C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1-c1ccc(Cl)cc1 735823814 SLQCZFDEQCRUEQ-LJQANCHMSA-N 444.963 2.410 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)c1O 740493579 HFQCPLLEOGZZAZ-UHFFFAOYSA-N 449.529 2.041 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(OC)ccc3Cl)CC2)cc1 743433013 VAXLVZIIXODPCY-UHFFFAOYSA-N 446.935 2.234 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(CNS(C)(=O)=O)o1 754018971 YCPFRVRURCWDIV-UHFFFAOYSA-N 431.308 2.459 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3CCS(=O)(=O)CC3)cc2F)C[C@H](C)O1 756059765 XVOWUMCNNPYRJE-GJZGRUSLSA-N 427.542 2.063 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCc4n[nH]cc4C3)cc2F)C[C@@H](C)O1 757819998 QAGVNTKDKGBICB-UXLLHSPISA-N 444.507 2.127 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(CO)n3-c3ccccc3)CC2)cc1 758006543 ZRERBTJDBCXRCL-UHFFFAOYSA-N 439.541 2.209 10 20 IECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NC(=O)Nc1ccc2c(c1)OCCO2 759597473 SFGFQDWPIGOTAJ-QDBLGGKGSA-N 428.397 2.162 10 20 IECD CC1CCN(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 762051627 BVTDRUXMVZNBBT-UHFFFAOYSA-N 426.540 2.290 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)S(=O)(=O)CC4)cc2)C1 764234216 JAUMDBNWHDTZJC-QGZVFWFLSA-N 442.541 2.040 10 20 IECD Cn1cc([C@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 766765217 RGODURKRHFMWBB-WIYYLYMNSA-N 431.512 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCCC[C@@H]4O)CC3)CC2)cc1F 769164514 BNYHVWSTUVBZHF-RTWAWAEBSA-N 434.556 2.434 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1O 772481820 WYHPTARTKINQHF-LJQANCHMSA-N 449.511 2.299 10 20 IECD O=C(NC[C@H](c1ccco1)N1CCCC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 774862020 AJUDXRKFLNCEJP-VQTJNVASSA-N 441.528 2.446 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccco1)N1CCCC1)c1ccc(N2CCOCC2)cc1 774871337 PSOHDOFQCYGXHI-GHTZIAJQSA-N 440.544 2.247 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(F)(F)F)nc2)cc1 777915571 OLUZSYNXSMMDBP-UHFFFAOYSA-N 425.410 2.195 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)CC2)cc1 778250288 YWFFPVFYGVLIPH-UHFFFAOYSA-N 442.501 2.160 10 20 IECD COC(=O)C1(N(C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 778400386 ALFSRYLGXBYCTM-VAWYXSNFSA-N 443.544 2.234 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)c1=O 784106813 NTXKAZOVGAWFDH-UHFFFAOYSA-N 440.500 2.156 10 20 IECD CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 784686165 LGFIUGSMBOKUMN-UHFFFAOYSA-N 449.515 2.013 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)cc2)CC1 787322788 SXUNJVSSMRLEMI-JOCHJYFZSA-N 438.503 2.164 10 20 IECD CCOCc1ccccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787512529 FJGWOTMUJMKPBV-UHFFFAOYSA-N 425.529 2.335 10 20 IECD CCN1CCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 787908154 HJABEKDBCLATNH-UHFFFAOYSA-N 443.636 2.073 10 20 IECD COc1ccccc1CCN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840805 NIWLCEGVUQHJBO-UHFFFAOYSA-N 443.519 2.113 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(OC)cc3O)CC2)cc1 792791736 KPQPJUKNRDDVKM-UHFFFAOYSA-N 428.533 2.421 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1F 803663011 QYMNFKOBRZTVEP-HXUWFJFHSA-N 427.455 2.286 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](CC(=O)NC)c2ccccc2)cc1F 804852590 KQJMLOQVLOGJJH-IBGZPJMESA-N 428.508 2.282 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCOC4(CCCC4)C3)cc2F)CC1 805007658 WCNUWIRSKDZIQO-IBGZPJMESA-N 446.567 2.192 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3C[C@H](C)O[C@H](C)C3)cc2)CC1 805023888 MVVLRKLARRZFNY-BGYRXZFFSA-N 430.593 2.155 10 20 IECD CC(C)(C)OC(=O)N1CC=C(CNC(=O)C(=O)NCCCSc2nccs2)CC1 806282168 RKDOLVMEHWWNGY-UHFFFAOYSA-N 440.591 2.425 10 20 IECD Cc1cccn2cc(CCNC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)nc12 806536800 NKFKWIDKGHSWAA-HXUWFJFHSA-N 436.512 2.215 10 20 IECD CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCN(C2CC2)C1 807769665 UXXVZWLAJKLYCZ-QAPCUYQASA-N 436.503 2.068 10 20 IECD CO[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1(C)C 807769688 UXZXLRYRAJTWQC-IAOVAPTHSA-N 425.476 2.303 10 20 IECD CC[C@H](C)Oc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccn1 808742768 GTWFJBHSAIHFSG-SFHVURJKSA-N 440.544 2.370 10 20 IECD COC[C@@H](C)[C@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 812623295 QLRWURSQVMQPGH-HIFRSBDPSA-N 436.530 2.386 10 20 IECD C[C@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)S1(=O)=O 813085530 FZYQMANYBLBVNS-QLFBSQMISA-N 431.505 2.474 10 20 IECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)n(C)c3=O)c2C)c1 915397872 FFVYMEMWLAYTPL-UHFFFAOYSA-N 441.509 2.103 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cn2)CCO1 916393086 SPOZKRDTDALPLM-LJQANCHMSA-N 439.560 2.485 10 20 IECD CN(C)c1ccc(CNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1 916697608 RNLARDSUSVLZLL-UHFFFAOYSA-N 436.509 2.234 10 20 IECD CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918285090 XHKDDFBGZZNRIQ-UHFFFAOYSA-N 428.464 2.184 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918312029 ZCYWIQCGSKJBOG-UHFFFAOYSA-N 440.544 2.061 10 20 IECD Cc1cc(=O)oc(C)c1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918919764 QKZLVLDVBANDQX-HUUCEWRRSA-N 446.475 2.483 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)c1ccc2c(c1)OCCO2 1254761948 VJMTUENMABYIQZ-INIZCTEOSA-N 443.452 2.123 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@]1(F)Cl 1813154152 XQINSIYZBHYSRH-PFPIKIJQSA-N 434.855 2.132 10 20 IECD Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1813508285 DTCUDJBGPSGWCJ-KSFYIVLOSA-N 436.468 2.352 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)Cc2ccc(Cl)s2)C1 1841940942 RDAQOPGSMBKEOD-UHFFFAOYSA-N 444.003 2.008 10 20 IECD Cc1cncc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1848197080 UFANGZVHVXYSFG-VXKWHMMOSA-N 445.523 2.317 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)cc1 4669409 OWZXCJUQURHKOZ-IBGZPJMESA-N 428.577 2.115 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)c(OC)c3OC)CC2)cc1 727948529 WQOZJBWQHUZNLT-UHFFFAOYSA-N 443.500 2.445 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cccc4c3O[C@H](C)C(=O)N4)CC2)cc1 729303324 NAPXUBDEFKPUDS-QGZVFWFLSA-N 438.528 2.357 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCNC(=O)[C@@H]3c3ccccc3)cc2F)CC1 730135362 WFEKFUDXSZPGGH-QFIPXVFZSA-N 439.535 2.350 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3cc(C(N)=O)c4ccccc43)cc2F)CC1 730192945 SGZNAWQFLDAXDB-UHFFFAOYSA-N 437.519 2.338 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(=O)OC)c3)cc2F)CC1 730391685 RIODVCLQSMZYAC-UHFFFAOYSA-N 442.491 2.009 10 20 IECD CC(C)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 735192650 QOTMMRLORGHACO-UHFFFAOYSA-N 444.507 2.472 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3nc(C(C)(C)C)ns3)cc2F)CC1 737188204 MLIKKPQFSJKTSH-UHFFFAOYSA-N 448.568 2.372 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccn(CC(F)(F)F)n3)CC2)cc1 746391980 UDHBQZGMQNJGCS-UHFFFAOYSA-N 425.411 2.178 10 20 IECD Cc1nnc2ccc(C(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)cn12 749737040 OALOAWBDQPJKTI-UHFFFAOYSA-N 446.490 2.223 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 750296499 JVNNAIQKTWDXMJ-ZZWRYEKASA-N 434.606 2.267 10 20 IECD CCCN(Cc1ccccc1O)C(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 750861874 KGCLAAQRSCEJBB-UHFFFAOYSA-N 448.541 2.474 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN([C@H](C)C(=O)N4CCCC4)CC3)CC2)cc1 755982326 BNMRYFVBYOJGNS-LJQANCHMSA-N 443.592 2.002 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)NC4(C[C@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 756937754 CQARKGDPORRULX-QZTJIDSGSA-N 442.560 2.481 10 20 IECD C[C@H]1CCCN(C(=O)C2CCN(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)CC2)C1 759587903 FSYAMJCVRGUOIV-YERXGYGTSA-N 430.501 2.151 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 759588940 PXULWFGPKCYETA-HYXAFXHYSA-N 430.369 2.362 10 20 IECD Cn1nc2c(c1NC(=O)C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 761973095 MXHCGIXLYANNQL-CYBMUJFWSA-N 433.459 2.234 10 20 IECD COc1ccc([C@H](CCO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764353317 WRVCMLDUOUSINN-KNQAVFIVSA-N 440.544 2.320 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3c3nncn3C)cc2F)C[C@@H](C)O1 767761743 RTGHBOFVJVBJJQ-YRNRMSPPSA-N 430.528 2.021 10 20 IECD C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 767770976 CMVPLGWWOWDQOI-SNVBAGLBSA-N 433.258 2.204 10 20 IECD COC(=O)[C@@H]1C[C@H](C)CCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 775807749 VLOXMUFVFIVOKG-VLIAUNLRSA-N 447.557 2.198 10 20 IECD CCOC(=O)CC1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778239944 XQMNBTXONKOZOB-HJWRWDBZSA-N 443.544 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C)c4ccccc4C3)CC2)cc1 778256648 LKDSQKDGHKGZLW-QXMHVHEDSA-N 434.540 2.379 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3nc(C)cc(C)n3)CC2)c1 782938161 SCYRSISCQDKAJJ-UHFFFAOYSA-N 439.560 2.156 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 785303765 KYYZGENUMDJZJW-SECBINFHSA-N 425.344 2.293 10 20 IECD O=C1CN(c2ccnc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)CCN1 787081264 QXNLNQMHRNWPES-HNNXBMFYSA-N 445.470 2.018 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)cc1 788951552 LXLCIKGLTOGMES-IBGZPJMESA-N 441.528 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)CONC(=N)C(C)(C)NC(=O)OC(C)(C)C)CC2)cc1 789630777 CTNKGJQKOYTGFL-UHFFFAOYSA-N 449.552 2.146 10 20 IECD CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)N(C)Cc2ccccc2O)CC1 790911171 GCEAHEYHOWBWAE-UHFFFAOYSA-N 442.491 2.187 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCc4sccc43)cc2)C1 793734135 QFEQFCQNGTXPEC-VQIMIIECSA-N 440.569 2.260 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1nc(O)c2ccccc2n1)c1ccc(N2CCOCC2)cc1 803302638 SFHRTJLOEOTQGP-INIZCTEOSA-N 449.511 2.008 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC([C@@](C)(O)C(F)(F)F)CC3)ccc21 803686628 FECWVNOCCGLOTM-HXUWFJFHSA-N 427.467 2.237 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(CC(=O)NC4CCCC4)CC3)ccc21 803689520 TXZBZFGGFADRTK-UHFFFAOYSA-N 440.588 2.373 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCC[C@@H](N(C)C)C1 806505801 YNJYHRDHRPZPNA-JKSUJKDBSA-N 426.355 2.492 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 807674258 JEHRNBPCPLESOY-INIZCTEOSA-N 440.519 2.490 10 20 IECD O=C(NCc1cccc(CO)c1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770206 ZVPZZXOXDPAUCZ-KRWDZBQOSA-N 433.455 2.182 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccnc(OC(C)C)c3)CC2)cc1 808795727 XHNGGCGUUKYABH-UHFFFAOYSA-N 426.517 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)cc2F)C[C@H](C)O1 814327694 PVJDRDTUSIROPL-KBPBESRZSA-N 440.475 2.051 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C3=O)[C@@H](C)CCC[C@@H]4C)CC2)cc1 884905207 JUKJKDZUENAAJJ-IRXDYDNUSA-N 428.533 2.091 10 20 IECD Cc1cc(CN2CCN(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)c(O)c(C(C)(C)C)c1 914851048 XLVYHSDFUZSOSB-ROUUACIJSA-N 439.622 2.470 10 20 IECD CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914903917 UVTZHQZHBQWOQS-QGZVFWFLSA-N 428.489 2.335 10 20 IECD COc1ccc(N2CCCN(CC(=O)N(C3CCCC3)[C@H]3CCS(=O)(=O)C3)CC2)cc1 917089736 JTNYJGBPLKVXBV-NRFANRHFSA-N 449.617 2.166 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 917524528 KXNBYZNSHUZIJW-UHFFFAOYSA-N 435.521 2.185 10 20 IECD CCNC(=O)COc1cccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918018412 SRTJEXHPXLZWOY-UHFFFAOYSA-N 440.544 2.380 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(N2CCCC2=O)c1 918311986 YDLGBWVYGHXWOV-UHFFFAOYSA-N 436.512 2.247 10 20 IECD Cc1ccnc(O)c1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1321447798 HBAJRWLROFKUES-GASCZTMLSA-N 431.464 2.322 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cccc3Cl)C[C@@H]21)c1cc(O)nc(O)c1 1787295331 HHYQFTDLKFSTFA-RBOXIYTFSA-N 449.866 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Br)cn1)c1cc(O)nc(O)c1 1798710800 DFGXTYVIUFJCJF-BTTYYORXSA-N 447.289 2.216 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(O)n1 1799371505 DDJRNGLLBJWALO-VBUUOAMHSA-N 447.495 2.140 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469876 RAQKHBKXNJLOGK-FAGZOMQFSA-N 449.486 2.238 10 20 IECD C[C@@H](Cc1ccncc1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039468 UHFOIVSPTPWFLK-NBUZRDOWSA-N 437.496 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)/C(=C\c3ccccc3)NC(C)=O)CC2)cc1 213959976 ZDGZFUHVQJSDIJ-CJLVFECKSA-N 437.496 2.064 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3nc(C)n(C)c3Br)CC2)cc1 328082055 XNBGPMAGUIUWOT-UHFFFAOYSA-N 429.340 2.011 10 20 IECD CCCNC(=O)[C@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)c2ccccc2O1 472787443 IHWCIAHGAUGMMA-JOCHJYFZSA-N 448.523 2.423 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O)c1ccc(N2CCOCC2)cc1 726292970 IGAHZYIFSVWZFE-LBPRGKRZSA-N 438.406 2.459 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1C 728761380 OVOSHKWACQGYQU-UHFFFAOYSA-N 439.512 2.245 10 20 IECD COc1ccc(CN2CC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 734525642 NJEIZNWANGBISH-JOCHJYFZSA-N 438.528 2.132 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(Cn2cccn2)c1 738898020 ZMVLPFFCPFLCNT-UHFFFAOYSA-N 439.541 2.488 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cnc(O)c(Br)c3)CC2)cc1 742057890 VXUVSNIIYJTGEA-UHFFFAOYSA-N 435.322 2.110 10 20 IECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCc1ccc(N2CCOCC2)c(F)c1 742342034 MUFUKSUYVVUOAB-QRFRQXIXSA-N 436.553 2.004 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4ccc(F)cc4)CC3)CC2)cc1 742948513 VQGTXYFIFSARFJ-UHFFFAOYSA-N 441.551 2.488 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n(C2CCOCC2)n1 746382756 YVFMDYJMBVJJPQ-QGZVFWFLSA-N 441.532 2.196 10 20 IECD COc1cccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1O 751310380 ZJKADNOWVOIMNP-UHFFFAOYSA-N 440.543 2.054 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2c(=O)nc(O)c3ccccc32)cc1 757775496 ZOCHCNRXDHUETQ-LJQANCHMSA-N 436.512 2.376 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(Br)nn3C)CC2)cc(OC)c1OC 758033795 HYFXPUTUWIBWGG-UHFFFAOYSA-N 439.310 2.171 10 20 IECD COc1cc(N2CCN(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)cc(OC)c1OC 759100385 AFXWJUKQVWUVIJ-HOTGVXAUSA-N 427.567 2.057 10 20 IECD COc1cc(N2CCN(C(=O)NC3CCC4(CC3)OCCO4)CC2)cc(OC)c1OC 760097736 VIRBUTZGVCEUCF-UHFFFAOYSA-N 435.521 2.230 10 20 IECD COc1ccc([C@@H](CO)N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764351445 MNUSYVOQSBIZDU-SIKLNZKXSA-N 440.544 2.272 10 20 IECD C[C@@H]1OCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H]1C 770022149 AHAWOKTXBQYKJT-STQMWFEESA-N 435.458 2.351 10 20 IECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(C)c1 775031535 AYDPKNFAUCQIAP-UHFFFAOYSA-N 442.535 2.230 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)N(C)C4CCCCC4)CC3)cc2)CC1 775676581 UQQNRKVLXXYJGW-UHFFFAOYSA-N 427.637 2.347 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 778235409 PZQYIZSJYHKFMR-UGKGYDQZSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CC(C)C)C(=O)OC(C)C)CC2)cc1 778277941 SPXOKFVMOFBIGI-ZJVMWOEPSA-N 445.560 2.383 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(C[S@@](C)=O)c3)CC2)cc1 778284777 XFFTYGPNXACHHP-SCKSCLOGSA-N 441.553 2.417 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(CC(C)C)C(=O)[C@@H]3C)CC2)cc1 779518362 AZOMSESNXYLFIJ-FQEVSTJZSA-N 445.608 2.106 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781443257 LXBNVOQBEKLKLD-UHFFFAOYSA-N 447.438 2.185 10 20 IECD CCN(CC)C(=O)CCC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 782824194 BNWGPZYAOQGOLX-UHFFFAOYSA-N 425.551 2.265 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1 785304829 RRSINAZWWCOBNQ-HZPDHXFCSA-N 427.501 2.177 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](c3ccccc3F)c3nccn3C)ccc21 785607934 XWKRCRTZANJWFE-NRFANRHFSA-N 435.503 2.464 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCOCC2)cc1 793744823 WNTHLFORXDLKDU-QFIPXVFZSA-N 442.535 2.006 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 795849012 QTOSEDIBGOWKGB-UHFFFAOYSA-N 446.569 2.479 10 20 IECD CS(=O)(=O)[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 800633208 MOHVOVDLPSQAHH-ODUNQGDFSA-N 444.625 2.375 10 20 IECD CN1CCN(c2ccc(CNCCNS(=O)(=O)c3ccc(F)cc3Cl)cc2)CC1 800894733 IFJDUBHQXDYCIX-UHFFFAOYSA-N 440.972 2.299 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 803133876 DEMHYHDIWWLJLK-IBGZPJMESA-N 442.560 2.442 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccnc(OC2CCOCC2)c1)c1ccc(N(C)C)cc1 805541385 FKRKIMMFNKMZOT-MRXNPFEDSA-N 426.517 2.199 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 840453899 ALJKORPAUZAERI-UHFFFAOYSA-N 446.573 2.115 10 20 IECD Cc1cc(C(=O)N2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c(C)n1-c1ccccn1 917383807 NQBOQBBRCMZDMT-UHFFFAOYSA-N 449.536 2.396 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCN(C)CC3)cc2F)C[C@@H](C)O1 918202914 QFTRAYAIBWWDEK-HDICACEKSA-N 435.588 2.265 10 20 IECD CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284893 UDRSJRRUZLGBDC-UHFFFAOYSA-N 428.464 2.266 10 20 IECD CSc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918463252 KDBMCJBYSKBCLA-MRXNPFEDSA-N 426.542 2.365 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc([N+](=O)[O-])cn3C)cc2F)C[C@@H](C)O1 919027917 UIWNAHDBMFXYQO-ZIAGYGMSSA-N 448.451 2.159 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)COc1ccc2c(C)cc(=O)oc2c1 1325764481 RTWGOUYXZMKXDN-KRWDZBQOSA-N 441.436 2.182 10 20 IECD CC(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1793056089 DTDGUGNLJCNNMI-GMQQQROESA-N 439.512 2.136 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ncccc1C(F)(F)F 1796601384 BGKDSHPTNLZJEZ-CLLJXQQHSA-N 436.390 2.472 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1)c1cc(O)c(O)c(Cl)c1 1801237314 KHNRGVXQOFJUGU-QDMKHBRRSA-N 446.891 2.131 10 20 IECD O=C(Cc1ccc(F)cn1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1810059370 CAFAXPYJUKJFDS-UHFFFAOYSA-N 428.464 2.114 10 20 IECD O=C1CC(C(=O)N2CC[C@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1811813589 SLBIYHNYOPSFCV-YJYMSZOUSA-N 443.887 2.445 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)C(=O)C1CC1 1814813062 TVFIUOQGXMXWEN-LOWQCSRCSA-N 440.456 2.211 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCO2)[nH]n1 1823474807 FYXKTBTUZHEMTP-PRLJZHDASA-N 442.472 2.411 10 20 IECD COC[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195007 HCNQNLCQGWOUGB-NILIMZSLSA-N 447.513 2.168 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2nc3ccccc3o2)C1 1845597679 CRILAXKAQMDRHW-VQHVLOKHSA-N 435.436 2.475 10 20 IECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)sc1C 1847038320 MDFKHVNWXRCTGM-FNORWQNLSA-N 429.498 2.407 10 20 IECD O=C(COc1ccccc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039423 NJSHGCRYMVTUKQ-VQHVLOKHSA-N 442.443 2.238 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@@]2(CCc3ccccc3C2)C1=O 105121312 PHDIXCYSEBGJDP-RUZDIDTESA-N 434.540 2.392 10 20 IECD Cc1cc(C(=O)Cn2c(-c3cnccn3)noc2=O)c(C)n1-c1ccc2c(c1)OCCO2 726118623 FZSQTGXASIOWCT-UHFFFAOYSA-N 433.424 2.355 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C/C2CCOCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 732686926 BYZNODRPPBOOHN-FPYGCLRLSA-N 446.525 2.450 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 732984094 SBEQDGUQLUTRTF-IBGZPJMESA-N 430.593 2.218 10 20 IECD COc1ccc(O)c(CNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)c1 734014907 KYBNRACUIPYPRC-UHFFFAOYSA-N 443.319 2.148 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(-c4nnc(C)n4C)c3)CC2)cc1 746371839 JYUBJTZDDHNUGL-UHFFFAOYSA-N 448.527 2.477 10 20 IECD CN1CCC(O)(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 747412816 UKEHZUYAXNLOMQ-NTCAYCPXSA-N 439.628 2.302 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](CNC(=O)c4ccccc4)C3)nc12 748834708 GKPGSDCZROYVKG-INIZCTEOSA-N 437.500 2.254 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 749256051 FNZLFEUSBSGTTD-SFHVURJKSA-N 445.541 2.044 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(-c4nnco4)ccc3C)CC2)cc1F 754213888 WYWQWEYGMBTJOY-UHFFFAOYSA-N 439.447 2.480 10 20 IECD CCN(C)C(=O)c1cccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758230796 JBDILABHLAYUMW-NRFANRHFSA-N 427.545 2.349 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)CCCNC(=O)C3CCC3)cc2F)CC1 758672382 XPJNGSYARRYWOV-UHFFFAOYSA-N 433.572 2.415 10 20 IECD CCS(=O)(=O)CCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 758713670 HATTXDSNDCGELZ-UHFFFAOYSA-N 437.484 2.118 10 20 IECD COc1cc(N2CCN(C(=O)[C@H](C)NC(=O)C3CCCCC3)CC2)cc(OC)c1OC 759402638 ACIKMOWTBKSAHT-INIZCTEOSA-N 433.549 2.446 10 20 IECD CCOc1ccnc(N2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 767911049 DZAMPCAAUJBGST-UHFFFAOYSA-N 426.565 2.112 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)cc2F)CC1 769156815 UFEKBIQCARFRLO-XZOQPEGZSA-N 447.599 2.145 10 20 IECD CC(C)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1nccs1 770267580 GTNURTRSLFCOJY-ZDUSSCGKSA-N 426.520 2.003 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 774116999 LOPQTUSPCNJLGL-XHDOVSQSSA-N 434.489 2.415 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 774553827 OMNOUJMPAHBVHE-UHFFFAOYSA-N 436.556 2.160 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC4(CCOCC4)C3)CC2)cc1 778290316 UTOLWJHRONQEHA-BQYQJAHWSA-N 427.545 2.319 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSCc3cccc(C(N)=O)n3)cc2F)C[C@@H](C)O1 779837421 POKBFDQMTKPVFX-GASCZTMLSA-N 446.548 2.483 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 781355851 FEFYCNLDQCLHFI-ZDUSSCGKSA-N 427.523 2.283 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781457756 OJNFLNMYKRUPGY-HNNXBMFYSA-N 441.484 2.134 10 20 IECD Cc1cc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c(C)c1CC(=O)O 782249842 OHKNBXQYORRLHP-UHFFFAOYSA-N 426.516 2.411 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 785560779 PHNWHVYLZFRRBV-XMMPIXPASA-N 448.567 2.177 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](NC(N)=O)c3ccccc3C)cc2)CC1 786260539 YJEXLHIVZZKKRC-QFIPXVFZSA-N 437.544 2.079 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 788319123 ARQSFXHHBWVHKK-QHCPKHFHSA-N 437.540 2.347 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(N2CCOCC2)c1 788912143 TTXWSVQVWVJCEA-UHFFFAOYSA-N 436.556 2.364 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](C(F)(F)F)O1 789864809 RXZKVEDWEIWHNX-BBRMVZONSA-N 431.480 2.034 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)CN1CCCC1 790184781 ASXMZFWUVSPUQE-CQSZACIVSA-N 426.355 2.351 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](C)OC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 790360258 MHSAQZMZKZSJHE-GUDVDZBRSA-N 449.567 2.325 10 20 IECD O=C(NCCC1(O)CCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 790691968 UVCNKPDILSBYJG-UHFFFAOYSA-N 428.512 2.047 10 20 IECD CC(C)CN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCC1 793727050 VJPVMFBKNFWLNM-LJQANCHMSA-N 428.577 2.432 10 20 IECD CNS(=O)(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 799995485 LQYNGRJCGYBWEV-HOCLYGCPSA-N 428.986 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)Oc3ccc(C=O)cc3)CC2)cc1 803961547 DPOQZDKXXRNDJU-QGZVFWFLSA-N 426.469 2.167 10 20 IECD CC[C@@H](C)N(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804220130 YFUKROFTWYQTRR-CVEARBPZSA-N 426.508 2.220 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCCCSc3nccs3)CC2)c1 806282628 OKMGMQXJHALKKA-UHFFFAOYSA-N 446.598 2.425 10 20 IECD O=C(NCC1=CCCOC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806508153 UUUHNUNIFNUAMM-UHFFFAOYSA-N 426.496 2.088 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1F 807385929 VHRMBBAFUOOXRH-RUZDIDTESA-N 429.267 2.286 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccnn1C 809793468 FLLYQVMWIFIISM-OALUTQOASA-N 428.533 2.189 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3C[C@H](C)S(=O)(=O)[C@@H](C)C3)cc2F)C[C@@H](C)O1 811864540 CMTGVKLOHGPDSK-FZKCQIBNSA-N 427.542 2.156 10 20 IECD C[C@H](NC(=O)c1cnn(C)c1I)c1ccc(N2CCOCC2)cc1 815115373 YNIHQWAEIPDDAC-LBPRGKRZSA-N 440.285 2.352 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1OC 917759406 QXBXGBFGBQXNHM-UHFFFAOYSA-N 428.488 2.029 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cc2)C1 917833988 FUIXLODUDHDESM-QGZVFWFLSA-N 448.483 2.412 10 20 IECD Cc1cc(C(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccccn1 920037968 YHYRAGQDORPQTR-UHFFFAOYSA-N 443.485 2.106 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ccnnc3)cc2)CCC1 1787318186 UNSCICUGHHTMOS-UHFFFAOYSA-N 441.538 2.085 10 20 IECD COc1nn(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1794926174 CBDWXUNKZXGRPR-CLLJXQQHSA-N 434.880 2.059 10 20 IECD COc1ncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cc1C 1810543006 IDKUSNMOWXKSGP-UHFFFAOYSA-N 440.500 2.363 10 20 IECD Cc1cccc(/C=C/C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1841044935 DHTLQRBBFPSDBT-AMMQDNIMSA-N 435.480 2.437 10 20 IECD O=C(c1onc2ccccc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442652 YAWKNUGAQOMCHV-UHFFFAOYSA-N 443.463 2.438 10 20 IECD O=S(=O)(Nc1nccs1)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 13948171 GASBCHGJNMJFSB-UHFFFAOYSA-N 437.484 2.281 10 20 IECD COc1cccc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1[N+](=O)[O-] 475451193 FBRNKBXCVVHOQJ-UHFFFAOYSA-N 435.487 2.119 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc(OC)ccc3OC)cc2F)CC1 730268935 KTPFPILNVLRZMF-UHFFFAOYSA-N 437.537 2.463 10 20 IECD O=C(c1cc(O)cs1)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 731868437 ZIKPHDKIQXGOQN-UHFFFAOYSA-N 437.362 2.424 10 20 IECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 732595109 MRFCZEQGKRNCKR-RTBURBONSA-N 438.528 2.461 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN(C)[C@H]2CCN(CC(F)(F)F)C2=O)c1 732798921 MJBIRRRBKYCVBV-SFHVURJKSA-N 443.466 2.022 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@]1(O)CCN(Cc2ccccc2)C1 741402676 CDUSXKDFHMSRCK-DEOSSOPVSA-N 442.535 2.099 10 20 IECD Cn1cc(S(=O)(=O)NCCN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cn1 743846996 CQYYRVARSZDMIN-UHFFFAOYSA-N 449.577 2.176 10 20 IECD CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958077 KBNZXMVOVQCCDR-CQSZACIVSA-N 425.485 2.499 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C[C@H]2CCOC2)CC1 749852440 FYJQANBGLYTLNW-QZTJIDSGSA-N 447.535 2.443 10 20 IECD CC(=O)N1CCCc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc21 750358477 BFRGWPNGSGJVSG-UHFFFAOYSA-N 436.512 2.077 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3nnc4ccccn34)cc2F)C[C@H](C)O1 750822361 SBEKMNFGNTZTQR-IRXDYDNUSA-N 440.523 2.230 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4c(cccc4NC(C)=O)C3)CC2)cc1 754012439 HPUWBHIVFMBLSQ-QFIPXVFZSA-N 438.572 2.195 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC(S(C)(=O)=O)CC2)c([N+](=O)[O-])c1Br 760494128 JLOPVVBVBOWUNK-UHFFFAOYSA-N 438.256 2.288 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCc2cccc(Br)c2O)cc1 764745664 MDKPUGCCRADLPX-UHFFFAOYSA-N 442.335 2.203 10 20 IECD Cc1sc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 767726199 DCTRCHIOZXJWHL-CQSZACIVSA-N 438.531 2.145 10 20 IECD CCOc1ccc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c(O)c1 769210796 NIKLEFMHGGGUOW-UHFFFAOYSA-N 448.541 2.459 10 20 IECD C[C@@H](NC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)c1ccc(N(C)C)cc1 773617810 FXVRERFBWQLACS-MRXNPFEDSA-N 441.557 2.290 10 20 IECD O=C(NCCc1c[nH]c2ccccc12)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774619531 VODJDRYWPVTNGW-UHFFFAOYSA-N 438.503 2.243 10 20 IECD CNC(=O)c1cc(C)ccc1NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778289403 LLBQWBUMJMAVEC-KHPPLWFESA-N 436.512 2.207 10 20 IECD C[C@H]1CC[C@@H](C)N1CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 785742137 OHLSUUZXUURZNG-XMTFNYHQSA-N 435.540 2.472 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C2CC2)cc1 787120748 CJZQVWOMHVNLON-JOCHJYFZSA-N 428.577 2.003 10 20 IECD COc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1O 787303592 ILSALSSQWYHCCM-UHFFFAOYSA-N 449.454 2.404 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1OC 787308688 XGHQLHGJQGPCCV-UHFFFAOYSA-N 427.501 2.027 10 20 IECD COC(=O)c1cccc(NC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)n1 787785921 LRQIKMRORMGZQI-UHFFFAOYSA-N 426.454 2.293 10 20 IECD COc1ccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)cc1 789797950 AAHHFIVQNMCGFH-IBGZPJMESA-N 441.503 2.303 10 20 IECD CCC(CC)[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801871 VFKYWQCXSUITRO-GHTZIAJQSA-N 435.540 2.379 10 20 IECD CCC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789950842 RCZPNCRPQVSDJX-KRWDZBQOSA-N 443.466 2.186 10 20 IECD CC[C@H]1CCCC[C@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 789971191 VIAYAQSIIOANSC-FUHWJXTLSA-N 433.549 2.446 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(F)ccc2Br)ccc1O 790408408 YEMNQOGLBWWELK-UHFFFAOYSA-N 439.284 2.003 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1 793733229 LUPMABRNJKCTTN-QFBILLFUSA-N 440.519 2.064 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCOc3ccc(F)cc3F)CC2)cc1 804317902 SATBTKNMHHCHDJ-UHFFFAOYSA-N 433.455 2.254 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1F 804853492 YTUBEOMOLMRTEW-UHFFFAOYSA-N 442.539 2.232 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)cc2Cl)C1 805755403 DAHSYIKSSPXQMG-RDJZCZTQSA-N 446.979 2.320 10 20 IECD CCc1cc(N2CCC(NC(=O)C(=O)N(CC)Cc3ccc(N(C)C)cc3)CC2)ncn1 808446152 IJVCAMGOUVSJMG-UHFFFAOYSA-N 438.576 2.239 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 916673036 XFIRYNCTFVBNQX-UHFFFAOYSA-N 436.509 2.201 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2 918121445 HGZPTVTXKVHRDI-CRAIPNDOSA-N 435.528 2.443 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](C)OCC2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920781115 HMGCNQANPLFGLS-HNNXBMFYSA-N 434.514 2.283 10 20 IECD C[C@H](NC(=O)NCc1ccccc1NS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 1317999459 YDTIWILHJDMJKA-INIZCTEOSA-N 432.546 2.455 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](NC(=O)c1cccs1)C(C)C 1325382545 TYAIPNKJGPIBRF-KSSFIOAISA-N 434.514 2.204 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cnccn3)C2)CC1 1808111973 RMYRFQBTVHEUTD-UHFFFAOYSA-N 446.511 2.114 10 20 IECD Cc1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cs1 1816721244 IDNCNPVKMCSPOG-LLVKDONJSA-N 445.526 2.183 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](N)CN)[nH]n2)cc1 1821157654 OFBUCVDNEUKPST-PZJWPPBQSA-N 449.559 2.409 10 20 IECD COCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823474940 GIQLHXMDOAIXDS-PMGBHYCQSA-N 430.461 2.269 10 20 IECD Cn1ccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708665 LZBMVAQIVHJEJQ-SNVBAGLBSA-N 447.904 2.481 10 20 IECD CCN1CCN(CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 725886956 XBLYJBLOVNJJLD-UHFFFAOYSA-N 428.499 2.186 10 20 IECD Cc1cc(C(=O)COC(=O)Cc2ccccc2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 725939480 RNZOZUFNDDFCIN-UHFFFAOYSA-N 442.493 2.416 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CN3C(=O)CCOc4ccccc43)cc2F)CC1 730193155 XQKMTLFZBTXCRS-UHFFFAOYSA-N 440.519 2.400 10 20 IECD CC[C@@](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)(C(=O)OC)c1ccccc1 732201586 HASLCRRQAOLESW-DEOSSOPVSA-N 443.519 2.347 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 741019348 FWAGTJODMZUSQR-YDHSSHFGSA-N 447.576 2.021 10 20 IECD COc1cccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1O 751304567 CLZAXQAFCPUPNI-UHFFFAOYSA-N 440.543 2.054 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 751373131 RROOGLNDDRBTPE-AWEZNQCLSA-N 428.894 2.368 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 754188003 SPNITXULDOWRRB-UHFFFAOYSA-N 438.528 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C3(CNC(=O)OC(C)(C)C)CC3)CC2)cc1 759651650 XLSSTWOPDZURNY-UHFFFAOYSA-N 447.532 2.192 10 20 IECD COc1cc(N2CCN([C@@H](C)C(=O)Nc3c(C)nn(C)c3C)CC2)cc(OC)c1OC 759872356 IBJBTGHUZBOPBN-INIZCTEOSA-N 431.537 2.212 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 763279564 MLPQCCLCPVNGMA-HRCADAONSA-N 448.541 2.257 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(CC(N)=O)c3)cc2F)C[C@H](C)O1 768516964 IXRDLLCRZFJBBV-HOTGVXAUSA-N 429.492 2.162 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(I)cn1 773272462 CSYQUFNFENBDSE-UHFFFAOYSA-N 438.269 2.316 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@@H](C)[C@H]3C)CC2)cc(OC)c1OC 774754369 JBFRGHRFUDHGQS-JFIYKMOQSA-N 433.549 2.302 10 20 IECD COc1ccccc1NC(=O)CN1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775727288 PNPXELFNYFMZKW-UHFFFAOYSA-N 437.588 2.203 10 20 IECD CCN(Cc1ccc2c(c1)OCO2)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 779219901 PJZNTWXULFEKTI-OAQYLSRUSA-N 427.545 2.429 10 20 IECD C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)OCC(=O)c1ccc(O)c(O)c1 781923144 SGSDZWODVSGMBR-JTQLQIEISA-N 447.387 2.210 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3ccc(C)s3)CC2)cc(OC)c1OC 787016941 RWAYIBZOEXJNJQ-UHFFFAOYSA-N 433.530 2.047 10 20 IECD COc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1OC 787021447 ZXFYXJHPTUOBIZ-MRXNPFEDSA-N 427.501 2.034 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nc(C(C)(C)C)nc3O)cc2)CC1 787322313 OSNXSMKVSUGQRV-UHFFFAOYSA-N 425.533 2.387 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)cc2F)C[C@@H](C)O1 789824276 HQTAYXTXOXUUBL-BBWFWOEESA-N 443.519 2.425 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cnc4n3CCCC4)CC2)cc1 790973355 SGPOJPXIAYKRNV-UHFFFAOYSA-N 426.565 2.240 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC2)cc1 791301285 PEKOXXJRXSNFQU-UHFFFAOYSA-N 431.468 2.267 10 20 IECD Cc1ccccc1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793671691 HINZTWQIHUYROR-GHTZIAJQSA-N 436.556 2.060 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnc(C)c(C(=O)OC)c3)n2)c[nH]1 794017597 QZQNEKUNZYOUSZ-UHFFFAOYSA-N 436.471 2.216 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)CC2)cc1 795120883 JVKGISQKJFITHV-RZUBCFFCSA-N 446.636 2.145 10 20 IECD Cc1cc(C(=O)CN(C)C2C[C@@H]3CC[C@H](C2)N3C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796457025 BESBCDMODLSLKT-YOFSQIOKSA-N 444.601 2.481 10 20 IECD CC(=O)N[C@](C)(C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797607210 IWSRQEFFULAHAG-QFIPXVFZSA-N 431.558 2.166 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2ccc(F)cc2Cl)c1O 802656095 CXUCKIRQXCEYBJ-UHFFFAOYSA-N 433.845 2.170 10 20 IECD O=C(NCCOc1ccc(F)cc1F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804913839 NYQFBTPCQAQDQN-KRWDZBQOSA-N 434.439 2.373 10 20 IECD CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 804975708 RJIHUBNMADTRHK-LSDHHAIUSA-N 446.577 2.400 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1C 815356715 ZRUHDQCMKFBOQO-UHFFFAOYSA-N 431.464 2.243 10 20 IECD Cc1cc(CSc2ccccc2C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)on1 816714495 IXQKWKNLRZMWOP-UHFFFAOYSA-N 443.572 2.159 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 914754758 TZELAGNISIHZSS-UHFFFAOYSA-N 433.530 2.173 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)cc2F)C[C@@H](C)O1 917918352 OLBNQPGTESHHJX-ZIAGYGMSSA-N 449.504 2.363 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920880465 ASNDLRDXGQXNCL-KRWDZBQOSA-N 431.558 2.241 10 20 IECD O=C(O)[C@@H](Cc1cn(-c2ccccc2)nn1)NCc1ccc(N2CCOCC2)c(F)c1 1116780525 QTLOADICJZFUCO-HXUWFJFHSA-N 425.464 2.029 10 20 IECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 1254720910 CBXYZZJKQZPGGJ-ROUUACIJSA-N 430.574 2.386 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(CS(C)(=O)=O)cc3)CC2)cc1 1319699351 ZXEXJFMVSRMCCZ-UHFFFAOYSA-N 438.571 2.141 10 20 IECD CCN(CC)C1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1337363600 GVCKINNKNHMEDX-KHPPLWFESA-N 428.577 2.233 10 20 IECD Cc1ncsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795167390 KOFADSDPIYRJIK-ACHSLPGTSA-N 437.525 2.496 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nc1 1797223190 PQYUXUBMWWEUCM-VBUUOAMHSA-N 447.495 2.135 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ccncc12)c1cc(O)c(O)c(Cl)c1 1797598664 VCAUZDHSXVJJTR-BTTYYORXSA-N 441.875 2.360 10 20 IECD NC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cc1 1800719899 UABQSLINFLVSEZ-MUJYYYPQSA-N 443.887 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@]1(F)Cl)C1=NN(c2ccccc2)C(=O)C1 1802486368 VWEGONVUTHSMGZ-GORYUYKASA-N 432.883 2.342 10 20 IECD Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1805241916 QHZIBHGMJDMGBE-KSSFIOAISA-N 439.497 2.286 10 20 IECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807989297 AAHGBIPQXROJII-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997895 GNZHWQDZHNKOIZ-XHDPSFHLSA-N 426.807 2.039 10 20 IECD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813627574 RYBHJGQXHXCCBE-ULYRPOKDSA-N 440.500 2.024 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C1(O)CCC1 1817842798 OSXWHQKQIWFNNO-IUODEOHRSA-N 429.477 2.073 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)C3=COCC3)sc2C1 1827245167 QDSGZJLUQUOSCV-ZABGRMTBSA-N 443.481 2.190 10 20 IECD CC1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1829686733 MGNDLCYYFPCRHC-NRFANRHFSA-N 438.908 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CSCc3c(C)noc3C)CC2)cc1 23882269 FZVGGWIUUZDDNP-UHFFFAOYSA-N 433.530 2.425 10 20 IECD COc1ccc(C(=O)CNC(=O)CCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437025989 NBXREAFZHQGRDU-UHFFFAOYSA-N 425.485 2.266 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2O1 732477886 HIHDKLDZWGJHNP-OAHLLOKOSA-N 427.476 2.217 10 20 IECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194768 CXYPVRLDOMRANR-OAQYLSRUSA-N 437.606 2.106 10 20 IECD O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccc(S(=O)(=O)NCc2cccs2)cc1 744321824 LNDXGAMMQKYZEA-UHFFFAOYSA-N 445.551 2.223 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730416 PKAPDRCXKFHBOA-UHFFFAOYSA-N 442.588 2.067 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 750253218 JVCAMVVHEWTQEG-UHFFFAOYSA-N 430.480 2.247 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(CCO)[C@@H]3CCc4ccccc43)CC2)cc1 754049319 CRUKFCSLBWFPET-WIOPSUGQSA-N 425.573 2.160 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(-n4nccn4)nc3)CC2)cc(OC)c1OC 759954434 JYELQUYHNFOCOJ-UHFFFAOYSA-N 439.476 2.042 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)N3CCC(C(=O)O)CC3)c2C)cc1 767135829 OJHGIYUTRRZEDT-UHFFFAOYSA-N 427.501 2.498 10 20 IECD CN1CCN(CC(=O)N(C)c2ccc(NCc3ccc(N4CCOCC4)cc3)cc2)CC1 770560982 NPVRHAUKVHWKAZ-UHFFFAOYSA-N 437.588 2.346 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 773744415 RHRFVBCHLVTWSL-BSEYFRJRSA-N 435.480 2.287 10 20 IECD C[C@H](NC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 773988433 KTQXKMHNEBDQGU-HNNXBMFYSA-N 435.521 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](Cn3ccnc3)C(C)(C)C)CC2)cc1 778244349 CQJQDXVHWYWHEH-YUQDSPFASA-N 439.560 2.328 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C(N)=O)sc3C)CC2)cc1 778324780 PAWRUYCOTJVPKC-BQYQJAHWSA-N 428.514 2.008 10 20 IECD COc1nc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)ncc1Br 779527232 DJNUDEJWQJFONE-HYXAFXHYSA-N 435.278 2.021 10 20 IECD COC(=O)c1cn(C2CN(Cc3cc(Br)cc(Br)c3O)C2)nn1 779612805 CJFZCCRVPRCVCP-UHFFFAOYSA-N 446.099 2.352 10 20 IECD CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc21 785294029 JYOLBFVTIHRFAF-CQSZACIVSA-N 439.468 2.302 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCO[C@H]3CCCC[C@@H]3C)cc2F)CC1 787990688 SNEJQMXCUQEIEG-AVRDEDQJSA-N 448.583 2.295 10 20 IECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788324048 QSSDGUHJENVCPE-OAQYLSRUSA-N 436.556 2.233 10 20 IECD Cc1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789826295 PIWAUYBAJKEDIG-CHWSQXEVSA-N 434.537 2.445 10 20 IECD COCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)o1 789842486 DFRVGTGZACKCFG-IBGZPJMESA-N 447.507 2.198 10 20 IECD C[C@@H]1[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC[C@H]1C 793731613 GEEZJHCWCFKZRF-BWPNAZKDSA-N 428.577 2.193 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CN(C)[C@@H]3CCS(=O)(=O)C3)cc2Cl)C1 800572625 ZXZIPJZZRQLRAB-NVXWUHKLSA-N 427.998 2.311 10 20 IECD CC[C@@H](C)N(C)CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448307 NZLYWLYQJAPLHR-OAHLLOKOSA-N 426.508 2.220 10 20 IECD O=C(NCC[C@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451463 LNKATRUJTMLNBF-QGZVFWFLSA-N 425.476 2.448 10 20 IECD Cc1cccc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 803451503 NDJBCMPSHQSQCJ-UHFFFAOYSA-N 432.471 2.435 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@@H](SC)C3)cc2F)CC1 805007006 CKUSFECFXHALSF-ZWKOTPCHSA-N 436.597 2.374 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C1 807101684 AOBLILCXKDJGJY-APWZRJJASA-N 432.565 2.439 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(C(=O)NCc2ccccc2)CC1)c1ccc(N(C)C)cc1 807672922 KGGPGJAGKDWYQS-SFHVURJKSA-N 436.556 2.485 10 20 IECD C[C@@H](NC(=O)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 807678250 VWGWQLRHAVDELY-BEFAXECRSA-N 441.507 2.492 10 20 IECD NC(=O)c1cc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1Cl 918036215 WJCLAUXZEYCQQM-AWEZNQCLSA-N 429.908 2.462 10 20 IECD COc1cccc(CC(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c1 921061929 WSBPVQWBFAJDNA-UHFFFAOYSA-N 438.572 2.107 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 1320641968 QYJVZMNGLQLBAP-BMFZPTHFSA-N 436.505 2.334 10 20 IECD CCC1(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCC1 1785505442 IIHIIZOMFMVZJN-BVBLWJPBSA-N 430.501 2.227 10 20 IECD Cn1cncc1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787457727 UXYCUNUFVSPGMC-UHFFFAOYSA-N 443.554 2.028 10 20 IECD CC(C)(O)CC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313762 CFYMJFRQIBVCHU-UHFFFAOYSA-N 435.571 2.142 10 20 IECD Cc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)s1 1799767407 NDAJAFGECXDIGZ-JJLQDPRZSA-N 437.905 2.033 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(F)nc1 1819692475 XBJBYKKXDGPPMI-AWEZNQCLSA-N 426.408 2.370 10 20 IECD Cn1nncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830734673 BDDYFIRNGDPLTA-INIZCTEOSA-N 447.923 2.427 10 20 IECD CN(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccc(Cl)cc1 1843250786 PBFLDMMTHLIMIX-IBGZPJMESA-N 444.919 2.266 10 20 IECD CCc1cnc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441989 YPJCRTWXHZKQCM-UHFFFAOYSA-N 437.525 2.315 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 734516426 ICYOQELVGBQIPP-UHFFFAOYSA-N 446.573 2.081 10 20 IECD NC(=O)CCn1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 735451418 JXANGYKHKCUZAU-ACCUITESSA-N 449.583 2.440 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)CC2)cc1 742033343 LUWJBCCDUAVUEL-OAHLLOKOSA-N 441.557 2.419 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccnc(N4CCCC4)c3)CC2)cc1 742947999 KQCKOPMBSUELSW-UHFFFAOYSA-N 438.576 2.312 10 20 IECD CC(C)(C)NC(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751061709 YSSCHUFTPLPUJN-UHFFFAOYSA-N 425.532 2.289 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)[C@@]12CCCO2 759323088 RUOLGIRPHVJDSK-XJUOHMSHSA-N 434.556 2.493 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(C)cc(F)c3)CC2)cc(OC)c1OC 759410132 PPHKJQSTUPMSSV-UHFFFAOYSA-N 431.464 2.447 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(Oc2cccnc2)nc1 760889368 CGTVOJIAVVQGQB-UHFFFAOYSA-N 433.468 2.360 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O 768931204 XVVBJCDNVZAYLH-DEOSSOPVSA-N 442.560 2.372 10 20 IECD NS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c(F)c1 769740597 DANMXHPYBQMMLS-UHFFFAOYSA-N 432.521 2.257 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc4c3NC(=O)CO4)cc2F)C[C@H](C)O1 774679611 LLTXFCJVWYWSIF-GJZGRUSLSA-N 443.475 2.465 10 20 IECD CN(CC(C)(CO)CO)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 780994603 UHZVYGFKYPIARQ-NTEUORMPSA-N 428.601 2.179 10 20 IECD COC(=O)c1ccc2[nH]cc(C(=O)COC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2c1 781169635 UJMFVHXSCLRELE-UHFFFAOYSA-N 446.437 2.071 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC[C@@H](N2CCNC2=O)C1 782962041 ZYXCZDWLQQFPDE-QGZVFWFLSA-N 437.491 2.456 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1 787107286 RGYZARLWJPWFPQ-QFIPXVFZSA-N 430.593 2.251 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCc4ccccc43)cc2)C1 788484789 OWYPDEMOGPPNEC-NHCUHLMSSA-N 448.567 2.241 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823168 ZFLPLZWAZBRMLG-GBESFXJTSA-N 448.583 2.436 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789856747 XWKZZTYIHCLSIH-UHFFFAOYSA-N 440.569 2.173 10 20 IECD CCc1[nH]nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1Br 789905215 FKQLDQDUOIBFHB-CYBMUJFWSA-N 434.338 2.366 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)c1 792340800 CMUAIGDDFSNRPS-CYBMUJFWSA-N 425.441 2.260 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)CC2)cc1 795120888 JVKGISQKJFITHV-VWPQPMDRSA-N 446.636 2.145 10 20 IECD COc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1[N+](=O)[O-] 796307581 UTGRZSQKFSPMML-UHFFFAOYSA-N 447.419 2.052 10 20 IECD COc1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(C)c(OC)c1 800614401 SVWUVTFTBNLEOY-UHFFFAOYSA-N 431.464 2.447 10 20 IECD CC[C@@H](CN1CCCC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450494 IYVRRORWZALSRC-INIZCTEOSA-N 438.519 2.364 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cs1 807103442 PZWWBSLXQRJWNH-UHFFFAOYSA-N 429.590 2.041 10 20 IECD CN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1)C(=O)OC(C)(C)C 807287218 HJVWILINYWSPOP-IBGZPJMESA-N 442.560 2.394 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(COC(C)(C)C)on3)CC2)cc1 807887464 QWZFNHAJQSIRTC-UHFFFAOYSA-N 444.532 2.353 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(CC(F)(F)F)CC3)CC2)cc1 916196749 OICJRKREYWNUBH-UHFFFAOYSA-N 443.514 2.097 10 20 IECD CCNC(=O)Cn1c(=CC(=O)C(C)(C)C)sc(=Cc2ccc(N(CC)CC)cc2)c1=O 916219827 NBLCXGHKVRIGDA-UHFFFAOYSA-N 443.613 2.117 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3cccc(C(N)=O)c3)CC2)cc1 918058229 MTUGOMSHOYOVOT-UHFFFAOYSA-N 439.560 2.148 10 20 IECD Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n[nH]1 918671638 GMUQFTXFSNYYTA-KRWDZBQOSA-N 435.532 2.059 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccccc2I)C(=O)NC1=S 920974342 HQHKTNATKGYXNI-JXMROGBWSA-N 429.283 2.486 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OCC(F)(F)F)nc1 1321048998 QKVHIRYZFOKITH-ZDUSSCGKSA-N 428.363 2.338 10 20 IECD CC1=CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785505416 HLPWXOLMQYSPSO-MJZLESEISA-N 442.512 2.393 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4nc[nH]n4)[C@H]3C2)cc1 1787221321 FLIYDFCXJJLYJK-JBACZVJFSA-N 448.527 2.119 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCCO2)c1cc(O)nc(O)c1 1797843503 ARHZJBUUQSMXRV-REPLKXPHSA-N 437.496 2.312 10 20 IECD Cc1ccc(C)c(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1801759652 OAMABTVLSKZCGH-BCDXTJNWSA-N 445.610 2.344 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3cncc23)[nH]n1)c1cc(O)nc(O)c1 1817846285 OWIGTUCPIAZMAB-MRXNPFEDSA-N 447.455 2.483 10 20 IECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1827427160 QFAVPMSSMRJMBD-QGZVFWFLSA-N 427.505 2.082 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnc3[nH]ncc3c2)C1 1844017137 UPTVLEDYQADHMP-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2 437003441 BGCMBCLEUGYZFH-UHFFFAOYSA-N 432.498 2.113 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)NC(=O)NCC(F)(F)F)ccc21 728637849 SVUZXXAMBXRHMC-UHFFFAOYSA-N 429.395 2.449 10 20 IECD CCN(CC)C(=O)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 729325812 DGDSQNWIMCSXLT-UHFFFAOYSA-N 443.569 2.333 10 20 IECD CC[C@H](C)[C@@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734269377 IWUHUOQWYMKMHZ-JXFKEZNVSA-N 430.528 2.149 10 20 IECD CS(=O)(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 746772847 OCGWDMUOJXXOJH-GOSISDBHSA-N 444.557 2.255 10 20 IECD COC(=O)[C@H](C)c1c(C)nn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 747727758 PMUQOXHRUXQUMN-CQSZACIVSA-N 432.496 2.069 10 20 IECD CCc1cccc(NC(=O)CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 748328811 KOYCNIKDRMMNOD-UHFFFAOYSA-N 439.560 2.318 10 20 IECD CNS(=O)(=O)C[C@@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 749852837 OQNWZQAEKIVZKD-IBGZPJMESA-N 447.557 2.077 10 20 IECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)C2=O 756946384 DOJWEPXBPRPESP-KZNAEPCWSA-N 442.560 2.447 10 20 IECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NCc1ccc(CN2CCOCC2)cc1 759588020 GZKIZKDBOGDRHP-NBEHIINDSA-N 440.496 2.191 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1 759590834 ATPQGDLXUCFOCC-VURMDHGXSA-N 430.501 2.295 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3nnc(-c4ccco4)o3)CC2)cc(OC)c1OC 759878987 QKHBJTQRBKUDFW-UHFFFAOYSA-N 443.460 2.116 10 20 IECD COC(=O)[C@@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767883288 IYVLVDKWGPQJRO-QFIPXVFZSA-N 429.492 2.295 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(OC)c(C)cc3O)CC2)cc1 768437581 AIZPOQYODNKMFD-UHFFFAOYSA-N 448.541 2.392 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c(OC)c1 768922377 PJIYNEWZODKMTR-UHFFFAOYSA-N 425.529 2.498 10 20 IECD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(F)c1 770135215 YRDWTFUDNPDCCW-HNNXBMFYSA-N 430.841 2.200 10 20 IECD CN(C)c1nccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 776221512 SDHNKMMQWISKFD-UHFFFAOYSA-N 431.408 2.156 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3CCC(C)CC3)CC2)cc1 778221101 IQGFBWXKCKTTSG-HJWRWDBZSA-N 428.577 2.138 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 779480733 HZRJDKZDDOMELM-UXHICEINSA-N 427.526 2.484 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2)CC1 786258404 DRXATMXLNYOTRC-UHFFFAOYSA-N 430.436 2.098 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 787704852 HCPSAHOWXCTBFJ-RTBURBONSA-N 432.634 2.340 10 20 IECD CC(C)COc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788320298 ORPJIBQCVLJKIX-UHFFFAOYSA-N 425.529 2.491 10 20 IECD C[C@@H](COc1ccc(F)cc1F)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323138 JMJJIPNWBCSLGE-HNNXBMFYSA-N 433.455 2.001 10 20 IECD CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788929428 IAMHMEYENWQQHM-GOSISDBHSA-N 430.549 2.276 10 20 IECD CC1(c2ccccc2)CC(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793735889 ZIAGGMMXWAHJCJ-SFGGNAAOSA-N 448.567 2.241 10 20 IECD Cc1cc(-c2nnc(N3CCC[C@H](NS(C)(=O)=O)C3)n2C)c(C)n1-c1ccccc1 800742290 FPMLQXQIDCXCCA-KRWDZBQOSA-N 428.562 2.408 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)cc1 806845336 KXKOWOALIQBQOK-LJQANCHMSA-N 426.565 2.010 10 20 IECD CCN(CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807768335 HHWGFVIBOFNULH-INIZCTEOSA-N 426.508 2.220 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@@H]1CCOC2(CCC2)C1 808855316 BOSMSHJOHFGHSW-OAQYLSRUSA-N 440.588 2.053 10 20 IECD O=C(NC[C@H]1COC2(CCCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809673305 PNZDYLFANIKUQG-PMACEKPBSA-N 446.544 2.482 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cnn(C[C@H]4CCCO4)c3)CC2)cc1 918196853 HLCJFCAMTPOANF-JOCHJYFZSA-N 442.564 2.405 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309912 GBGNCEKPHAYAKU-UHFFFAOYSA-N 426.473 2.299 10 20 IECD Cc1nccn1-c1ncccc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 919779237 WSPKWJWEXXTEMY-FQEVSTJZSA-N 447.543 2.277 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3CCCC[C@@H]3C)CC2)cc1 1325006057 GAYUZOWOBMIIAA-DUQGCJEPSA-N 428.577 2.281 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1C[C@@H]1F 1781636730 NYIHHWXNWCDGFZ-SUDRFXRBSA-N 426.872 2.237 10 20 IECD Cc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c(C)c1 1784985884 KPAFPQNJGSNGJH-HSZRJFAPSA-N 425.485 2.175 10 20 IECD Cc1csc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1785503272 GKVPRJZOMGJLJR-WTCGPSRQSA-N 444.509 2.330 10 20 IECD CNc1nsnc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1785837178 VTBFYEAPSOLXDH-UHFFFAOYSA-N 440.485 2.448 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(=O)c1ccccc1 1816722095 CPNAFBLQWMOEJX-CYBMUJFWSA-N 438.465 2.058 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncccc1F)CC2)c1cc(O)nc(O)c1 1816724891 BZBLSUAAINMYOA-JTQLQIEISA-N 429.433 2.023 10 20 IECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cc(O)n1 1818051456 NYFJIBJSRWOTJQ-OAHLLOKOSA-N 438.444 2.245 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1 1827428752 HNCRFWRARTWDPQ-WDSOQIARSA-N 431.533 2.277 10 20 IECD CC(C)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837628485 WDKZKEOAPKAMGF-UHFFFAOYSA-N 440.544 2.434 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c(O)c1 1843442326 ALWZJQJDWWNBKO-UHFFFAOYSA-N 448.479 2.011 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3[nH]ccc3n2)C1 1844046877 YTYAJEAQKYLAQP-XVNBXDOJSA-N 434.452 2.210 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2ccoc2C1 1847659148 CEZSJGUUQGWGFK-HLAKTZFNSA-N 438.480 2.417 10 20 IECD C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 15134617 KHUVJZUUBJGNSX-IAGOWNOFSA-N 431.558 2.481 10 20 IECD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)cc1 727249411 ZHGVXRJIYJFEQG-UHFFFAOYSA-N 429.443 2.495 10 20 IECD COc1cc(N(C)CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 741798922 NNXMLKQHDGXKAQ-UHFFFAOYSA-N 444.488 2.406 10 20 IECD O=C(COCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCc1cccnc1 742804788 BMPIFIOIWKBRAB-KRWDZBQOSA-N 448.470 2.101 10 20 IECD Cc1nsc(N2CCN(CC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2)n1 746490067 VYGGUQLIMJUNNN-UHFFFAOYSA-N 447.520 2.383 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747074779 HTPJVOHKZSQXCM-CHWSQXEVSA-N 443.477 2.013 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 749653123 HNWYMUVYXZRVFW-UHFFFAOYSA-N 442.541 2.006 10 20 IECD COC(=O)C[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CCO1 752335368 GCGVBEKPMSHEIY-GOSISDBHSA-N 428.485 2.312 10 20 IECD Cc1cc(C(=O)Cn2nnc3c(cnn3C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 753796326 UVGWIMDWTQHKGN-UHFFFAOYSA-N 428.399 2.417 10 20 IECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 759370126 OJMCPALRBOJJAE-KRWDZBQOSA-N 439.512 2.130 10 20 IECD CN(c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1)S(C)(=O)=O 761278916 MZGZGRQHUTZRHD-UHFFFAOYSA-N 437.905 2.406 10 20 IECD CS(=O)(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 763640215 FCKLJTUZXYRQKJ-INIZCTEOSA-N 449.495 2.261 10 20 IECD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 765596632 UXUCBQCWHAXGEO-HXUWFJFHSA-N 433.549 2.147 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)NCc2cccc(Br)c2O)c1 766208123 VYVBNSLHOMUXQC-UHFFFAOYSA-N 430.276 2.428 10 20 IECD O=C(Nc1ccn(Cc2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 768029727 NLVQDNFFXQCVHP-LJQANCHMSA-N 435.484 2.178 10 20 IECD CSCC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nnc2ccccn12 769636985 AVQNWXSZHHXYJC-CQSZACIVSA-N 435.531 2.031 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2nc(O)nc(O)c2c1 771056808 GWVVUCFATQTAHI-CQSZACIVSA-N 429.864 2.189 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cn(C)nc3C(F)(F)F)CC2)cc1 772944218 AOSADJXUFNNFFN-UHFFFAOYSA-N 425.411 2.125 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 776491144 MNTIZQHRTDTMAI-UHFFFAOYSA-N 431.514 2.277 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccnc3-n3cccn3)CC2)cc1 778231456 COIQEJHEPRJMDD-KTKRTIGZSA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nc(C)c(C)s3)CC2)cc1 778367502 HELOPRBBBXELGC-CMDGGOBGSA-N 428.558 2.332 10 20 IECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780408522 JEEWFQUKHCZYED-UHFFFAOYSA-N 434.474 2.073 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3coc(C4CCOCC4)n3)CC2)cc1 786714254 ZSYVKVRMQCUTGY-UHFFFAOYSA-N 429.473 2.083 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 787703292 AQAGEVBXIUPLOT-SBHAEUEKSA-N 431.577 2.384 10 20 IECD CO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1(C)C 789949718 KHLAUTZHHJMWCG-DLBZAZTESA-N 443.466 2.088 10 20 IECD CNC(=O)C1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 803147989 URBMMCCXZBWPEC-UHFFFAOYSA-N 440.544 2.295 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccncc2OCC(F)(F)F)cc1F 803664847 PWDSWPLCDJHVEZ-UHFFFAOYSA-N 428.386 2.160 10 20 IECD O=C(NC[C@H]1CSCCS1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806468020 RCGMYHYBJNMSON-CJNGLKHVSA-N 445.557 2.338 10 20 IECD CN(c1ccccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O)S(C)(=O)=O 807513296 KKFOXEBWNSDXQN-UHFFFAOYSA-N 446.312 2.350 10 20 IECD O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)cc1 920211646 FRERLSWVGGUSQG-UHFFFAOYSA-N 435.521 2.037 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(COc3ccc(F)cc3)no2)c1 920637049 YAGQLGQMVSAORA-UHFFFAOYSA-N 437.405 2.222 10 20 IECD CN1CCN(c2ccc(CN3CCC(C(=O)NCCCN4CCCC4)CC3)cc2F)CC1 1117639830 RIZPYDOZJUAFHR-UHFFFAOYSA-N 445.627 2.392 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3COc4ccc(F)cc4C3)CC2)cc1 1319790523 FOTAUEOXDBSOKO-KRWDZBQOSA-N 428.460 2.277 10 20 IECD Cn1nncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816038535 TVBSNSQZBADORE-CYBMUJFWSA-N 445.867 2.223 10 20 IECD Nc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cs1 1827425830 ANLOAUCOTPAZBU-HNNXBMFYSA-N 431.518 2.079 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2cnc3ccccn23)C1 1841325136 YKTXVSNQBODMRG-UHFFFAOYSA-N 440.887 2.459 10 20 IECD Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1-c1cccc(Cl)c1 97554724 CWYQCSDYYGOALA-AWEZNQCLSA-N 437.949 2.123 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C4OCCO4)C3)cc2F)C[C@@H](C)O1 728053417 JUBOYPHTABAEDI-SCTDSRPQSA-N 435.540 2.140 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCc4c[nH]nc4C3)cc2F)C[C@@H](C)O1 745621877 IMDGNOYTUQJKOY-BFYDXBDKSA-N 444.507 2.127 10 20 IECD CC(=O)N1CC[C@](C)(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 747091349 LMDABZZRHMACPS-DEOSSOPVSA-N 434.448 2.202 10 20 IECD O=C(COC(=O)c1ccc2nncn2c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 749409729 VATCVYIWUXWSTA-UHFFFAOYSA-N 426.388 2.300 10 20 IECD O=C(CN1CCC(OC[C@H]2CCCCO2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 750064571 MBFYFDHNFJIIAC-OAQYLSRUSA-N 449.567 2.329 10 20 IECD CC[C@H]1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 755994434 HBCZSSRPPLTNHH-XKYMITNMSA-N 447.582 2.465 10 20 IECD CN1CCN(c2ccc(CN[C@@H](Cc3ccc4c(c3)OCCCO4)C(=O)O)cc2)CC1 756390549 VMYMBUNXYVSUGR-NRFANRHFSA-N 425.529 2.385 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(N4CCCC4=O)c3)CC2)cc1 758225789 VEHDPIUYRKRGPG-OAQYLSRUSA-N 425.529 2.384 10 20 IECD CCOc1cccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759410796 VYSKKMBOAYYFOQ-UHFFFAOYSA-N 443.500 2.398 10 20 IECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NC(=O)Nc1ccc2c(c1)OCCO2 759597469 SFGFQDWPIGOTAJ-QBODLPLBSA-N 428.397 2.162 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCS(=O)(=O)C[C@H](C)C3)c2C)cc1 763899614 COBXRIDQISGAAJ-OAHLLOKOSA-N 432.542 2.430 10 20 IECD CCOc1ccc(C(=O)NCC(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1 764321369 VRQCZYHRBBUCKU-UHFFFAOYSA-N 434.876 2.376 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1cccs1)N1CCOCC1 774806398 IIXDVSUKFMANKG-FQEVSTJZSA-N 444.601 2.352 10 20 IECD C[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(N2CCOCC2)cc1 775255009 MUSCLYPUKDJVMU-INIZCTEOSA-N 428.558 2.390 10 20 IECD COCCN(C(=O)/C=C\c1cnn(C)c1)c1ccc(NC(=O)/C=C\c2cnn(C)c2)cc1 776966715 MLJWHPWFVLRYTR-GGXLTUIBSA-N 434.500 2.498 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1 784649431 FUEAMYYBTPTCEJ-UHFFFAOYSA-N 432.546 2.038 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 787709652 YKOXDRUZAHZYPO-RTBURBONSA-N 430.593 2.264 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc(CN(C)C)cc3)CC2)cc(OC)c1OC 788665307 QNEUEMRWBZABHY-UHFFFAOYSA-N 449.573 2.285 10 20 IECD CC(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)on1 789819442 MYPKVXNYAVNXOZ-HUUCEWRRSA-N 432.496 2.483 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)CN3CCCC3)cc2F)C[C@@H](C)O1 789819454 MZQQAEMTHZFMQP-QZTJIDSGSA-N 448.583 2.294 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN3[C@H](C)CCC[C@H]3C)cc2F)C[C@@H](C)O1 789823005 XTTNBAONVXDRSO-MKXGPGLRSA-N 448.583 2.435 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(OC(F)F)cn1 789859256 BKXBKJBTCLYHOJ-UHFFFAOYSA-N 436.484 2.169 10 20 IECD Cc1cc(C(=O)N[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c(C)n1-c1ccccn1 792582691 QGHXRYDQKLFHPZ-JOCHJYFZSA-N 449.559 2.440 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(CS(C)(=O)=O)cc1 793485354 ZGWPXEOVJLSGIA-UHFFFAOYSA-N 445.585 2.351 10 20 IECD CCc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 793735521 XYDYVJMXZJRPRP-OAQYLSRUSA-N 436.556 2.226 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)n1 803659907 WTBJXLBVIAYJRX-QGZVFWFLSA-N 441.507 2.089 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 804318967 WGDODSPQEFEDAQ-MRXNPFEDSA-N 448.564 2.152 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 806846014 ZLMLPRCJYKDSCG-FQEVSTJZSA-N 438.576 2.154 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)c1O 806908051 VPZRUCQFRVMKEQ-UHFFFAOYSA-N 439.443 2.313 10 20 IECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2cc(Br)ccc2O)cn1 807386812 KQSQGLUPCTVNSC-UHFFFAOYSA-N 430.262 2.205 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCN(c4ccccc4F)C3)nc12 811378882 VRUCRFQORPUFOR-ZDUSSCGKSA-N 428.420 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(F)c(S(=O)(=O)NC4CC4)c3)CC2)cc1 914460755 PUAOLDLFIOCOGM-UHFFFAOYSA-N 433.505 2.237 10 20 IECD COCCc1ccc(S(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 914852190 YHVSTLDHWIPYKN-UHFFFAOYSA-N 447.601 2.375 10 20 IECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c([N+](=O)[O-])c1 917086690 MNGOTPBMJOPFPY-UHFFFAOYSA-N 438.481 2.215 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NCCc2ccc(O)c(O)c2)cc1 917371522 BJJDJZHYHVLCSL-IBGZPJMESA-N 446.525 2.203 10 20 IECD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 917929959 KWJUHXDQVAWDHJ-KRWDZBQOSA-N 446.529 2.392 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 918308223 HJAIHMNZWHQQLU-UHFFFAOYSA-N 436.512 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(N4CCOC4=O)c3)CC2)cc1 919196444 NDZCPUFVEHVAQJ-UHFFFAOYSA-N 439.468 2.157 10 20 IECD O=C(Cn1nc2n(c1=O)CCCCC2)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1319206311 GOBZEULNUXDAIN-HNNXBMFYSA-N 435.475 2.158 10 20 IECD CCN1CCN(C(=O)CC2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)CC1 1319823629 RLUPTKAHCCLZFZ-UHFFFAOYSA-N 445.627 2.344 10 20 IECD Cc1cccc(F)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782868441 LIGNCGWFMHVMFZ-UZUQRXQVSA-N 443.475 2.382 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cn2cnnn2)cc1 1796297293 IYCGMRVHWQLNEX-NUZGMZIFSA-N 433.516 2.033 10 20 IECD C/C=C/C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1812537953 YFGNISYAFYIFAC-XIBVMUEHSA-N 431.496 2.456 10 20 IECD Cc1ccc(O)c(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1844883877 VFADOWLAHWMPAM-UHFFFAOYSA-N 432.480 2.311 10 20 IECD O=C(c1cc2cccnc2[nH]1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038027 ZREAHUDDOMVMHG-FNORWQNLSA-N 434.452 2.210 10 20 IECD COc1ccc(N2CCCN(CC(=O)N3CCC(C(=O)N4CCCC4)CC3)CC2)cc1 97476994 BTQFRMZFPFGULK-UHFFFAOYSA-N 428.577 2.068 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc4c(cc3F)CCC(=O)N4)CC2)cc1 726725791 ICFNWVSVHHJDKK-UHFFFAOYSA-N 440.475 2.443 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731858855 OUINEDKGRCRYRS-SFHVURJKSA-N 434.514 2.396 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3nc4c(s3)COCC4)cc2F)C[C@@H](C)O1 735584176 FJWYIQKARWLQTP-BETUJISGSA-N 448.520 2.223 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 735754066 YEAXQWJJGJLWDG-UHFFFAOYSA-N 446.573 2.481 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCCNC(=O)c3ccc(F)cc3)CC2)cc1 742917121 QYXSJIRTPPGKAS-UHFFFAOYSA-N 442.535 2.283 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2NC1=O 745986805 DZRYUMFULBPZFO-INIZCTEOSA-N 426.492 2.373 10 20 IECD CS(=O)(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 749554030 DOUVXHPLMTUCKR-UHFFFAOYSA-N 445.585 2.439 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 752097471 SCFZHVLDLZSMKV-UHFFFAOYSA-N 425.485 2.088 10 20 IECD CN(C)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc2n1 755093004 QEEPDYPKHRLYOF-UHFFFAOYSA-N 438.553 2.466 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(F)cc(F)c3)CC2)cc(OC)c1OC 759408969 GUFXFCZMRWTQBM-UHFFFAOYSA-N 435.427 2.278 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 763654849 IKKMACUEYPSPNH-UHFFFAOYSA-N 446.573 2.163 10 20 IECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2cccc(Br)c2O)C1=O 765727931 RHJLCIHYYULVPK-IBGZPJMESA-N 432.274 2.238 10 20 IECD C[C@H]1CN(c2ccc(CNc3cc(N4CCN(C)C(=O)C4)ncn3)cc2F)C[C@@H](C)O1 768495282 YFUVGZCORMYBHO-IYBDPMFKSA-N 428.512 2.120 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4cc(C)ccc4n3C)CC2)cc1 769640501 GLIVUCRVBCEUBN-ZHACJKMWSA-N 447.539 2.412 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(OC)c(C(=O)N(C)C)c3)c2)CC1 769848153 LRZIRXWSFSXSMG-UHFFFAOYSA-N 446.573 2.340 10 20 IECD CC(C)(C(=O)NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 772894896 BHVKPEJWXFKVRW-UHFFFAOYSA-N 429.492 2.304 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 778298713 RGZYUNYHSODDHQ-SNGWPZLWSA-N 441.532 2.458 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3sccc3C)CC2)cc(OC)c1OC 786803999 LSQZKGKPDADUJI-UHFFFAOYSA-N 433.530 2.047 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCN(c2ccccc2)CC1 788010470 LFJXYSHEAJTEIP-HXUWFJFHSA-N 437.588 2.038 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCC1 789846676 OQZVARWZUZUZCT-UHFFFAOYSA-N 435.540 2.116 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@@H]([C@@H]3CCCO3)C2)cc1)C1CCCCC1 803677354 NEHHDJURRXYNRW-FCHUYYIVSA-N 429.561 2.478 10 20 IECD CCN1CCO[C@H](C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 805473116 KGIKSJXYCWPLDA-VLIAUNLRSA-N 436.464 2.053 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)cc2Cl)C1 805755405 DAHSYIKSSPXQMG-WBVHZDCISA-N 446.979 2.320 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807678848 KRWSJZAGRZMRHD-FUHWJXTLSA-N 431.558 2.299 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCc4cccc(C)c43)CC2)cc1 918251136 ZOVOYPKTNZRUGN-UHFFFAOYSA-N 436.556 2.221 10 20 IECD CCCc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[nH]c(C)c1C(=O)OC 918337805 OJWOWMQBXZNONX-UHFFFAOYSA-N 447.557 2.227 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(S(N)(=O)=O)s3)cc2F)C[C@H](C)O1 918632653 AMGDSAJUHLCLAO-STQMWFEESA-N 441.550 2.007 10 20 IECD C[C@H](NC(=O)c1ccc(CCNS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 920882193 VVPCPNCKEGGSCA-KRWDZBQOSA-N 431.558 2.106 10 20 IECD C[C@H](NC(=O)N1CCCC[C@H]1CCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 920921780 SROVIOIQGDTEAX-PXNSSMCTSA-N 438.594 2.088 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(S(C)(=O)=O)ccc1Cl 1320437078 SINHLXAAJTWGQE-HNNXBMFYSA-N 441.889 2.059 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OCC(F)(F)F)cn1 1320784047 XSCLATASYLQCOL-AWEZNQCLSA-N 428.363 2.338 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 1327669691 RZROSEUVDLTVKZ-ROUUACIJSA-N 441.484 2.385 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1 1799747229 YJQRYMHKGTWDKA-QDMKHBRRSA-N 439.509 2.077 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)ccc1F 1804336076 UZUUBRFDEKWBNS-QDMKHBRRSA-N 435.546 2.246 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnnc(Cl)c2)[nH]n1)c1cc(O)nc(O)c1 1817843952 JYWOXCSHAHSVMI-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1827423740 FBOUALZCVABWHH-CRAIPNDOSA-N 427.505 2.184 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C(=O)OC)[C@@H]3C(=O)OC)ccc21 511318237 CVJIMAYNHQNXDD-YLJYHZDGSA-N 430.501 2.471 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 541992163 QLUXHZMWBOWEET-UHFFFAOYSA-N 439.516 2.454 10 20 IECD NC(=O)c1ccc(N2CCN(Cc3c(O)ccc(C(=O)c4ccccc4)c3O)CC2)nc1 728196929 YRGTYSUDCZXZMA-UHFFFAOYSA-N 432.480 2.145 10 20 IECD CC1CCC(N2C[C@@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2=O)CC1 731325180 ROSLSBVBGSUSEF-SHWNOYPMSA-N 440.588 2.432 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743975008 KSDVCZZLAVCKDC-MRXNPFEDSA-N 446.454 2.371 10 20 IECD CCN(CC)C(=O)CN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748013964 ZRSKWESTAGJZHH-UHFFFAOYSA-N 425.532 2.195 10 20 IECD CC[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOCC1 752954581 GNPLBTYGLKRMQJ-GOSISDBHSA-N 440.491 2.193 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cccc(C(=O)NC4CC4)c3)CC2)cc1F 754039728 DXRPSTWZWKCUDJ-UHFFFAOYSA-N 433.505 2.237 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2cnc3[nH]nnc3c2)NC(=O)OC(C)(C)C)cc1 755423590 OKRFPUKPPORDKC-KRWDZBQOSA-N 425.493 2.415 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccn(Cc2ccccc2)n1 759022354 MJQKWLWFECYLIS-UHFFFAOYSA-N 437.475 2.162 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccncc4)CC3)cc2F)C[C@@H](C)O1 760892126 JBCMKOISGAFSBW-KDURUIRLSA-N 441.551 2.273 10 20 IECD CCN(C)c1ccc([C@@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 765238135 FHXKKZXLMINSMR-LJQANCHMSA-N 431.606 2.340 10 20 IECD CS[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H]1N(C)C 765266618 BEZIURVGLKCLMS-GDBMZVCRSA-N 441.600 2.372 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1O 769317946 XOIQJMBFWMKJLN-UHFFFAOYSA-N 429.868 2.247 10 20 IECD CC1(C)COCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769729272 DMBWYVSRUDUNFO-UHFFFAOYSA-N 435.458 2.352 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 773744422 RHRFVBCHLVTWSL-SHACYNPGSA-N 435.480 2.287 10 20 IECD COc1ccc(S(=O)(=O)N2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 779534360 PUBVFWNDMPLJNL-ONNFQVAWSA-N 432.498 2.043 10 20 IECD COC1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCC1 780763682 MAYPEAINNJICHC-UHFFFAOYSA-N 435.458 2.400 10 20 IECD Cc1nn(C(C)(C)C)c(=O)n1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 783911865 RIKMNTUVUVDMIY-GASCZTMLSA-N 433.528 2.177 10 20 IECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)nn1 786548746 GPUJVIWKMVVVJI-UHFFFAOYSA-N 436.468 2.387 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656126 KRNWEBDMYSRUIM-KXIODPIGSA-N 444.601 2.229 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)N(C)C)cc1 793720292 NNYRAXVJFPHCAF-QHCPKHFHSA-N 438.572 2.209 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[nH]1 796360753 FOOPDEYMHBEASB-UHFFFAOYSA-N 432.388 2.372 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c(O)c1 797389200 UXOIPFDZUVENBA-UHFFFAOYSA-N 435.362 2.255 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12)c1ccc(N2CCOCC2)cc1 803298406 SSGSSFIYQQZOQN-JEDBISTDSA-N 435.615 2.196 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCN(C2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803306057 RQSUBMPUVNUCBC-LJQANCHMSA-N 428.577 2.177 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C[C@@H](C)O)c3ccccc3)CC2)cc1 804318582 OIBQBRJFNOFXKP-UYAOXDASSA-N 439.556 2.451 10 20 IECD CCN1C[C@H](CN(C)C(=O)C(=O)NCCCSc2nccs2)Oc2ccccc21 806277082 PJTAICLXPLTADV-HNNXBMFYSA-N 434.587 2.487 10 20 IECD Cc1cnc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 808482455 OBUYIAZITSCVGD-QGZVFWFLSA-N 441.601 2.477 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN(C2CCC2)C1 813594631 LJDLKGDOAOGMSU-AZUAARDMSA-N 427.593 2.404 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cnn([C@H]4CCOC4)c3)c2C)cc1 816465415 AKYPBBHNDREZOK-KRWDZBQOSA-N 444.513 2.379 10 20 IECD O=C1/C(=C\c2ccc(-n3cncn3)c(F)c2)SC(=S)N1CCCN1CCOCC1 824025930 FCWXYTSRCONWLC-GZTJUZNOSA-N 433.534 2.330 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N3CCN(C(C)=O)CC3)c2C)cc1 857435126 XHFUSXUMTFYNGO-QGZVFWFLSA-N 427.501 2.339 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 918632651 AMGDSAJUHLCLAO-BETUJISGSA-N 441.550 2.007 10 20 IECD C[C@@H](NC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)c1ccc(N2CCOCC2)cc1 920887280 CIFPYVLWTIYEIH-CQSZACIVSA-N 435.484 2.160 10 20 IECD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)oc2ccccc12 1777748183 YKVPVQOREJZBJS-HSZRJFAPSA-N 437.452 2.305 10 20 IECD C[C@H]1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792219115 KDMCEJVMFKBVDQ-CHMWUEAZSA-N 444.528 2.233 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC1CCCC1 1793556294 WUEWYUUJTNAVNU-BTTYYORXSA-N 441.644 2.161 10 20 IECD CN(C)c1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796602442 JPQKYBIPWCRJGG-FNLKRUPLSA-N 438.528 2.443 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCC=C1F)C2 1804340736 ZFSWTDQHVWEGIV-RJAOAUJVSA-N 443.541 2.231 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 56966086 XUIGNTIONQWCCM-UHFFFAOYSA-N 434.518 2.012 10 20 IECD C[C@H]1CN(C(=O)Cc2noc(-c3ccc(NC(=O)C4=S=CC=C4)cc3)n2)C[C@H](C)O1 445398235 RHEVHEUZMHGWQE-KBPBESRZSA-N 426.498 2.131 10 20 IECD CO[C@@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 727036919 AFRJMTDZQGSQPS-QFBILLFUSA-N 438.528 2.351 10 20 IECD CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727143050 ZYKSTKSONBHPSJ-FUHWJXTLSA-N 448.589 2.315 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](NC(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 731033313 RTPKRLIPNBHNFA-SFHVURJKSA-N 432.590 2.387 10 20 IECD Cc1sc(NS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)nc1-c1ccc(F)cc1 740758544 XWKPFJQSBGTOOA-UHFFFAOYSA-N 447.473 2.406 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCCCC2)cc1 742058017 YKYARWAHNULYLM-INIZCTEOSA-N 433.578 2.010 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)Oc3cccc(C(C)=O)c3)nc12 745218502 AXFVHLKIHBMNCN-CYBMUJFWSA-N 427.413 2.325 10 20 IECD COC(=O)[C@@H](O)C1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 749535335 NBINOYHVAHPWPB-QHCPKHFHSA-N 442.512 2.294 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 753157345 ZTDJZHXDNXRFGU-UHFFFAOYSA-N 449.621 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccccc3CN3C(=O)CNC3=O)CC2)cc1F 753840538 OGRAUAVPFYCELV-UHFFFAOYSA-N 441.463 2.240 10 20 IECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1C(=O)NCCCSc1nccs1 759579454 LRCLULXYHMKJHD-MRXNPFEDSA-N 430.559 2.464 10 20 IECD COc1cc(N2CCN(C(=O)c3ccnc(OCCN(C)C)c3)CC2)cc(OC)c1OC 760083604 FRZVYFXLBZIXEV-UHFFFAOYSA-N 444.532 2.010 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)CC2)cc(OC)c1OC 774754374 JBFRGHRFUDHGQS-SOLBZPMBSA-N 433.549 2.302 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3CCc4ccccc43)CC2)cc1 778235623 LDXWXDRNHCIZAG-VAWYXSNFSA-N 448.567 2.469 10 20 IECD O=C(OCCCO)c1cc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1O 785396610 GRYWKJZJKVWFRD-UHFFFAOYSA-N 430.822 2.294 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 787980033 JEPRAQVYKAIBFO-KRWDZBQOSA-N 426.517 2.199 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](c4ccccc4)C3)cc2)C1 793734203 RIVANFZODIPDDO-NHCUHLMSSA-N 434.540 2.021 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnc(C(C)C)nc3)cc2F)CC1 796802502 QEEJBBMVBMALFD-UHFFFAOYSA-N 428.512 2.136 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)c2cccc(O)c2O)C(F)(F)F)CC1 801556796 DVICXOOSIQKYGR-AWEZNQCLSA-N 433.427 2.311 10 20 IECD CC(C)c1nnc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cn12 801741297 FMZJAVXZUMMUNE-UHFFFAOYSA-N 442.545 2.409 10 20 IECD COc1ccc(C(N)=O)cc1S(=O)(=O)NC(=O)c1sccc1-n1c(C)ccc1C 802889050 ZRHMPPHHQZQYIZ-UHFFFAOYSA-N 433.511 2.382 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)c2)CCO1 803132135 WJTLDFVZSJGYNZ-OALUTQOASA-N 438.572 2.467 10 20 IECD Cc1ccc([C@H]2COCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 803302853 CUNRYRSHRNIFBR-YLJYHZDGSA-N 427.501 2.202 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCC3(CC(C)C)CCC3)CC2)cc1 803750012 KEKGBZSWGCPQNJ-UHFFFAOYSA-N 430.593 2.266 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804034590 WHOKIMUIMZJXMZ-GOSISDBHSA-N 427.501 2.237 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3nc4c(s3)CCCC4)CC2)cc1 804086111 JOQJQRJSSYJJGJ-UHFFFAOYSA-N 442.585 2.428 10 20 IECD CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC(CO)CC1 807768299 GRPFYHBTKMNWQS-AQFXKWCLSA-N 439.503 2.383 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 808588343 DGUNPHHQMLKJJP-FQEVSTJZSA-N 438.915 2.254 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c(C)n1-c1ccccn1 816293808 WYYWSZKXMIRZIU-UHFFFAOYSA-N 427.408 2.360 10 20 IECD COc1ccc(/C=C/C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 916676322 GZHXEMNXELGNKY-UXBLZVDNSA-N 430.526 2.268 10 20 IECD CCOc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918464908 DQFSXECDMXSXFY-INIZCTEOSA-N 442.491 2.181 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 1320620541 BBUGSCOCTDICJB-UHFFFAOYSA-N 449.485 2.291 10 20 IECD Cc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1C 1793303999 KUSRLUKNAVRANF-RBVVOMGSSA-N 432.908 2.288 10 20 IECD Cc1nc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cs1 1804284014 WZTVYOCSWVLZNQ-SATNDUHCSA-N 443.525 2.462 10 20 IECD COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1819765166 BBZXCWMHXDNDFE-MRXNPFEDSA-N 438.444 2.239 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1 1831997050 SYXRYNDTMQEBSF-BHIYHBOVSA-N 431.533 2.277 10 20 IECD CCn1c(=O)nc(O)c2c(C(=O)N3CCOc4cc(N(C)C)ccc43)cc(C3CC3)nc21 486550196 PMHOYLYTLZHWFO-UHFFFAOYSA-N 435.484 2.500 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)NC(=O)c3ccc(Cl)cc3)nc12 728719621 PIPABBXZRHAXNG-NSHDSACASA-N 446.847 2.127 10 20 IECD O=C(O)COc1ccc(/C=C2\SC(N3CCOCC3)=NC2=O)cc1Br 742432309 VTVKJGXMUXGYMY-JYRVWZFOSA-N 427.276 2.215 10 20 IECD CC1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2)CC1 742650173 XBROKJZQNSRWKO-WKDRNLAYSA-N 425.529 2.092 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCN3CCc4ccccc4C3)CC2)cc1 743363244 OOQWCLKXCPADNA-UHFFFAOYSA-N 437.588 2.175 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@@H]2c2cccs2)c1 743384672 UBJDDJFLZZPLET-FQEVSTJZSA-N 429.542 2.162 10 20 IECD COc1cccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c1O 745646728 LPVUJWIAQDLOLV-GOSISDBHSA-N 443.500 2.074 10 20 IECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cn2)C[C@@H](C)O1 747017951 UVVQIKUYFOKKNO-IAGOWNOFSA-N 437.544 2.333 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@H]4C[C@H]5CC[C@H]4C5)CC3)cc2)C1 748617246 JUJYYEZHLYYRTO-FKEBYFGASA-N 439.604 2.404 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 749730399 OPQLCQJHWOIFBP-UHFFFAOYSA-N 435.499 2.377 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NCc2ccc(N(C)C)cc2C)c1 752972303 FHTURDBDHQUONM-UHFFFAOYSA-N 439.520 2.396 10 20 IECD CCN1C[C@H](C)N(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@@H]1C 766254803 RXGNXYPWLYNNGS-IRXDYDNUSA-N 432.590 2.339 10 20 IECD O=C1COc2ccc(S(=O)(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)cc2N1 768013250 RLNWFBNRDQHUHS-UHFFFAOYSA-N 442.541 2.350 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1 769665067 XVKCMMDLYIBAEV-UHFFFAOYSA-N 443.525 2.461 10 20 IECD O=C(CN1C(=O)NC2(CCCCCCC2)C1=O)NCc1ccc(N2CCOCC2)c(F)c1 772880114 VDYBBDSUAAXTGS-UHFFFAOYSA-N 446.523 2.313 10 20 IECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)s1 773303284 LDHLIIJFAZZPJU-UHFFFAOYSA-N 445.632 2.083 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773995777 VVWARIIQYWEBOS-HNNXBMFYSA-N 432.546 2.209 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCC3=CCCCC3)CC2)cc(OC)c1OC 774690555 ZPIBUGJSSXSUOE-UHFFFAOYSA-N 431.533 2.368 10 20 IECD CC[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)ccc1O 775523642 LDFVWWAFQQMOBG-NVXWUHKLSA-N 426.355 2.129 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 781448202 NHSRIBPGIKEJNH-UHFFFAOYSA-N 429.448 2.298 10 20 IECD Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295867 JQCXRVAGNNFZMF-OAHLLOKOSA-N 425.485 2.328 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)Cc3ccc(F)cc3)CC2)cc1 785528457 PNVXNMRSOVLEGV-UHFFFAOYSA-N 442.535 2.121 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](c2ccc(F)cc2)O1 788324874 ZBSICTFNZLUCPL-JTSKRJEESA-N 441.503 2.267 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(F)cc3C(=O)N(C)OC)CC2)cc1 789682929 OPSDFESGYYFVKM-UHFFFAOYSA-N 430.480 2.228 10 20 IECD O=C(NCCOC1CCCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793678221 VVIIODIHROBRIQ-OAHLLOKOSA-N 425.476 2.448 10 20 IECD Cc1cc(F)ccc1CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793715814 AXZYQJVLANTEFP-IBGZPJMESA-N 440.519 2.111 10 20 IECD COc1ccc(CNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)c(O)c1 795359046 VNNXAILZCTZWDH-UHFFFAOYSA-N 432.495 2.169 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c(O)c1 797390550 JDQXQXXNKVIYBT-UHFFFAOYSA-N 432.908 2.061 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 803310628 MKNYIAHWUIQLLO-QGZVFWFLSA-N 438.528 2.018 10 20 IECD Cc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n(C)n1 803458702 MFORYMNKVMZSAD-UHFFFAOYSA-N 445.457 2.073 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3CN3CCCCC3)CC2)cc1 804319157 JODPSQISGFCKCS-OAQYLSRUSA-N 428.577 2.257 10 20 IECD NC(=O)CCOc1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 916702352 ZZTLUHLRNCNWRC-UHFFFAOYSA-N 430.480 2.363 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(Cc2cscn2)CC1 919908080 QDBDJYOHYYOWGO-UHFFFAOYSA-N 433.553 2.271 10 20 IECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920923375 POMSJYMFBWIWGQ-KRWDZBQOSA-N 440.544 2.409 10 20 IECD O=C(Nc1ccc(C2(NC(=O)c3cc(C(=O)O)ncn3)CCC2)cc1)c1cc(O)nc(O)c1 1788424265 OPFZTDZJYVLWLC-UHFFFAOYSA-N 449.423 2.043 10 20 IECD COc1cccc(OC)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799562668 JYJHMAJYZAMGLC-QDMKHBRRSA-N 427.457 2.076 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1800259419 QTEXAZXYCHAXJK-BJKLQHCMSA-N 440.500 2.037 10 20 IECD O=C(CCC(=O)N1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712551 KXHHTZWMSCOGAV-MUJYYYPQSA-N 449.935 2.406 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccnc(F)c1 1803840098 KPXITWOBBZWHEF-MGPUTAFESA-N 437.431 2.055 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992814 DJXKBAHFQOMDJR-AOMKIAJQSA-N 435.484 2.168 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCS2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807999778 WHABBLDCZAZUBM-GMBSWORKSA-N 428.514 2.103 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817848414 IKTCVWMJAXUILT-CJNGLKHVSA-N 439.476 2.288 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc2ccnn12 1821398051 SHNQSWCMFYIELO-MRXNPFEDSA-N 447.455 2.483 10 20 IECD CSc1ncccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844582645 GIGFACURSNJFHR-SOFGYWHQSA-N 441.509 2.451 10 20 IECD Cn1ncc2c(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)cccc21 1847036931 AWIYBOBIXRFBHV-VQHVLOKHSA-N 448.479 2.221 10 20 IECD Cc1c(F)ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1N 1847039116 SOQUKXMLOCKOGJ-XBXARRHUSA-N 441.459 2.364 10 20 IECD CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 261463302 MTFNAFYDAZGEAI-UHFFFAOYSA-N 432.420 2.469 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc(OC)c1OC 559462890 RTYMOXVQAVCCLB-UHFFFAOYSA-N 425.485 2.445 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1cccc2c1OCCO2 727251286 QRTAGLMTWHVOMR-UHFFFAOYSA-N 442.482 2.358 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3c(F)cccc3[N+](=O)[O-])cc2F)CC1 730269043 MWEYXWIRUVIHCI-UHFFFAOYSA-N 440.472 2.493 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3CCC(=O)NC3=O)c2C)cc1 733561999 QIPULGDSBJZNHX-UHFFFAOYSA-N 427.457 2.161 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 747394803 UJUNPYCUOPLGNH-YKSBVNFPSA-N 440.588 2.499 10 20 IECD CC(C)Cn1cnc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1 749661555 LIBIBSDZQWQAJV-UHFFFAOYSA-N 430.519 2.439 10 20 IECD CN(Cc1ccccc1)[C@@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 750053669 JCSQIWUAGCYOIK-JOCHJYFZSA-N 440.563 2.485 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)/C=C/c3ccccc3)CC2)cc1F 754028196 OJVGFWTVLJFQEL-MHWRWJLKSA-N 447.532 2.463 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-c4ncco4)c3)cc2)C1 754490350 WAGMTYODFIGERP-GOSISDBHSA-N 447.495 2.298 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)N3CCc4ccccc4C3)CC2)cc1 758209134 IAVXXPSPMXEEBA-SQJMNOBHSA-N 438.616 2.215 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-c2nnc(S)o2)cc1 759537144 GYMSZIFFJWMSST-UHFFFAOYSA-N 444.538 2.190 10 20 IECD COc1ncc(/C=C/C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 773796392 PZOKWVVMXBPXOR-GQCTYLIASA-N 449.490 2.071 10 20 IECD C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)C[C@@H](C)O1 774362875 GPZQPRNBQXKDJX-HZPDHXFCSA-N 427.501 2.004 10 20 IECD COc1ccccc1NC(=O)CN1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 774908076 FRUIMQFRHJSIIE-UHFFFAOYSA-N 430.461 2.074 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(S(N)(=O)=O)cc3C)CC2)cc1 775202901 QCZCMDAQNVHGPG-UHFFFAOYSA-N 432.546 2.073 10 20 IECD C[C@@H](NC(=O)CSCCOc1ccc(S(N)(=O)=O)cc1)c1ccc(N(C)C)cc1 775405218 RVKNPIVSWXFLEI-OAHLLOKOSA-N 437.587 2.389 10 20 IECD C[C@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N(C)C)cc1 776247886 XGZUCHVPIXRFBO-KXBFYZLASA-N 426.517 2.437 10 20 IECD CCOC(=O)C1CCC(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778243389 IRDLAAICZNTHTH-OUKQBFOZSA-N 443.544 2.138 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3ccccc3S(C)(=O)=O)cc2F)CC1 786115341 RIAGVRHXUQZHGY-UHFFFAOYSA-N 433.549 2.230 10 20 IECD Cc1ccc(C(=O)NCCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1F 786662709 KWSPXVFLAPLXQZ-UHFFFAOYSA-N 440.519 2.237 10 20 IECD CC1CCN([C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C(C)C)CC1 787616448 MDCVBVYQBZOHNO-QFIPXVFZSA-N 430.593 2.012 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCN(C)C1CCCCC1 787687815 IKDOTMUISDHVKI-UHFFFAOYSA-N 430.593 2.252 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCN1C1CCCCC1 788311444 VOYCHDGISLHXBI-JOCHJYFZSA-N 428.577 2.053 10 20 IECD C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313083 PPNCMJGUAZBFAS-KDURUIRLSA-N 430.593 2.012 10 20 IECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820966 RIIOKGGIDATESW-LFGUQSLTSA-N 446.567 2.141 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(OC)c(OC)cc2Br)c(O)c1 797388995 KIZAVGYOMLXKHJ-UHFFFAOYSA-N 439.262 2.435 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)CC2)cc1 797652692 OTCSFSFUTBOALK-UHFFFAOYSA-N 433.534 2.085 10 20 IECD C[C@@H](NC(=O)C(=O)NCCc1ccc(F)c(F)c1F)c1ccc(N2CCOCC2)cc1 803312678 ZYWKMCFUGHWKBZ-CQSZACIVSA-N 435.446 2.477 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CN1C1CC1 803451097 DPADPPUHAFNPMK-HOCLYGCPSA-N 436.503 2.114 10 20 IECD CCN(C)C(=O)OC[C@H]1CCCCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 805762203 DZTANVIYZVSNFW-HXUWFJFHSA-N 432.565 2.287 10 20 IECD O=C(CN1CCC[C@@H](c2nc(O)n[nH]2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808777191 GGBLJJJUICHTDY-CYBMUJFWSA-N 431.452 2.104 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)cc2F)C[C@@H](C)O1 808918951 KHMPGXSZENSRHV-ZIAGYGMSSA-N 441.459 2.365 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1 810348718 ZMNRBXSCYXWHHH-LLVKDONJSA-N 443.319 2.319 10 20 IECD COC(=O)Cc1cc(Br)ccc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 811670945 JFASUTOXSWPRLB-UHFFFAOYSA-N 444.259 2.369 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)S1(=O)=O 811864953 QEGZSSMBTUOQDQ-ZIAGYGMSSA-N 449.495 2.259 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2N1 815835430 TUDCJWPJGKNSOY-MRXNPFEDSA-N 442.903 2.122 10 20 IECD C[C@@H](OC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(N)=O 913364033 VSEJISZLVYKZSM-JMUHATKESA-N 429.317 2.067 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(c4ccccc4)CC3)CC2)cc1 913461970 YFEUTFNEUSLJCZ-QXMHVHEDSA-N 434.540 2.249 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 916565429 DNNMIIMKTGUIJI-PWRODBHTSA-N 427.545 2.435 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1Cl 918436752 AZNRMSRHNSZKOA-UHFFFAOYSA-N 432.933 2.247 10 20 IECD Cc1cc(S(=O)(=O)NCCNCc2ccc(N3CCN(C)CC3)c(F)c2)c(C)s1 1319839545 LRXCIJASIMLILM-UHFFFAOYSA-N 440.610 2.324 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cccc(Br)c1O 1343772196 RWLJFZYSZISSAV-UHFFFAOYSA-N 445.247 2.328 10 20 IECD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c[nH]1 1794609887 MZAUCFLCHVZNPO-QDMKHBRRSA-N 448.614 2.424 10 20 IECD CNc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1 1795561272 LQASMLSGJNTLPZ-CCWDJLKJSA-N 445.903 2.310 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)N1C[C@H]2C[C@H]2C1 1798325338 WTEAWWOHXODQFH-ABYAABTBSA-N 433.936 2.343 10 20 IECD Cc1ccc(O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c1 1799769098 MDKHTFGWCYDJOH-HBCWATKFSA-N 446.887 2.282 10 20 IECD COc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(F)c1 1800476924 IPPRLPWVHUABSW-CLLJXQQHSA-N 433.411 2.345 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)C1 1810544255 ZRIGUYCKDXBPMT-UHFFFAOYSA-N 435.484 2.479 10 20 IECD CNC(=O)COc1ccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1OC 726562594 MHZOUEOHUZCIOW-UHFFFAOYSA-N 427.501 2.227 10 20 IECD O=C(CNC(=O)NCc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)c(F)c1 727373079 NTKLOYOUADZXDG-UHFFFAOYSA-N 434.899 2.431 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(CCN2CCOCC2)CC1 729598114 WZLHUSGWZZACCJ-UHFFFAOYSA-N 434.556 2.306 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cc(F)cc4c3OCOC4)CC2)cc1 730060001 HKQCXCRHLZYHQU-HKBQPEDESA-N 448.516 2.298 10 20 IECD Cc1ncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C(C)C)n1 734202001 NIZAIPWOJIRSLC-UHFFFAOYSA-N 430.480 2.357 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N(CC(N)=O)C(C)(C)C3=O)c2C)cc1 735792816 LHDLKSNUVZZWKP-UHFFFAOYSA-N 440.500 2.204 10 20 IECD COC(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738900534 QPVRDVOEBNZILR-UHFFFAOYSA-N 432.502 2.421 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1 743560877 WHSIVFFSMFLCBD-AKIFATBCSA-N 434.540 2.479 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 743719552 GNPIQVMLXGSTKF-UHFFFAOYSA-N 435.571 2.267 10 20 IECD COc1ccc([C@@H](CNC(=O)NCc2cccc(OC)c2O)N2CCOCC2)cc1OC 745291333 XTTQMUHAHYATLS-GOSISDBHSA-N 445.516 2.291 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1c1ccccc1F 753107396 HDGOPFCWCLXPFV-OAQYLSRUSA-N 444.482 2.309 10 20 IECD CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1F 753520146 FDRJTEIFBKSWCS-UHFFFAOYSA-N 433.439 2.390 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)CC2)cc1 754070499 YUZZTBHJQXRLKE-PZJWPPBQSA-N 448.608 2.119 10 20 IECD CC1(C)CN=C(N2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)S1 754570592 QHNAFQSHHFZOIY-UHFFFAOYSA-N 449.596 2.495 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 757874692 SEIWVJBJIMSSKO-UHFFFAOYSA-N 434.500 2.438 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc4scc(C)n4c3=O)CC2)cc(OC)c1OC 759222965 XTCKXYDRERYQGN-UHFFFAOYSA-N 444.513 2.053 10 20 IECD COc1cc(N2CCN(C(=O)COc3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759224826 HIVZZNJVXZVUHQ-UHFFFAOYSA-N 431.445 2.348 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](n3ccnc3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 772748025 YQHYWRWBGACROU-LJQANCHMSA-N 441.557 2.458 10 20 IECD O=C(CN1C(=O)COc2cc(Br)ccc21)OCC(=O)c1ccc(O)c(O)c1 782892802 BKEFCOSLRCDUHM-UHFFFAOYSA-N 436.214 2.012 10 20 IECD NC(=O)c1ccc(F)c(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784765206 NXVWQEMVAAXDHW-OAHLLOKOSA-N 448.882 2.003 10 20 IECD Cc1nc(C)c(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789822530 WXNHGOARSKOYAP-ZIAGYGMSSA-N 448.564 2.488 10 20 IECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789825266 LHAWEPCWMXYNMU-FCGDIQPGSA-N 448.583 2.292 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1Cl 791340735 RPGWNDNSDDCFJN-LJQANCHMSA-N 430.936 2.429 10 20 IECD COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 791535452 XVBIPXPMJYRYDA-GCJKJVERSA-N 436.512 2.206 10 20 IECD CCC1(CC)CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCS1 793730050 BORKSIZDNNBXDV-SFHVURJKSA-N 446.617 2.139 10 20 IECD CCCCN(CC)C(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793825393 AZQBNEVXMVRIOB-UHFFFAOYSA-N 442.539 2.207 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 793911359 AMVUAFXIKOKCNJ-WOJBJXKFSA-N 444.620 2.354 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)O[C@@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 796612287 NQLBLZUGMSBPHF-YDLHNXBPSA-N 449.567 2.325 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](C)O[C@]4(CCCOC4)C3)CC2)cc1 797412483 OOZBVUVXHSIAGU-HYBUGGRVSA-N 446.592 2.187 10 20 IECD O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 806187231 MAMSLCQINAKGHL-INIZCTEOSA-N 441.450 2.333 10 20 IECD CCN(C[C@H]1CCOC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769855 JCHBKGCCEGIBLL-CVEARBPZSA-N 425.476 2.258 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)cc1 808814841 HIWJHDLWIZRDCZ-KRWDZBQOSA-N 448.445 2.309 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3COc4c(F)cc(F)cc4C3)cc2)C1 812011249 YUGGLBTXKKDUAT-CRAIPNDOSA-N 444.482 2.469 10 20 IECD O=C(NCC1CC1)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 918220916 MABPOICVXPQPAF-GOSISDBHSA-N 432.540 2.235 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918462636 DHFITPRVSAAFKD-SFHVURJKSA-N 438.528 2.430 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 919766771 RNAKMKBSDBTASE-QFIPXVFZSA-N 443.569 2.301 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1 919816269 WLESUSPTADGKJJ-UHFFFAOYSA-N 449.504 2.071 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 920342593 AUCFOQQLRZIZPJ-UHFFFAOYSA-N 434.518 2.426 10 20 IECD O=C(CSc1nnc(Cn2cncn2)o1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 921160404 SZSWKJDGUIZXSC-UHFFFAOYSA-N 446.448 2.216 10 20 IECD CCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786238636 UOBQIJGGKSAFCR-MIUNTBIASA-N 449.891 2.209 10 20 IECD CN(C)C(=O)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788672583 UPMLFOCLORDFBV-UHFFFAOYSA-N 447.495 2.002 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@@H](O)C1)CC2)c1cc(O)c(O)c(Cl)c1 1823710797 MHLUAVUGOYMOOR-INTQDDNPSA-N 437.905 2.204 10 20 IECD CC[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1824081106 XYXMFVMCQSGKHG-NHCUHLMSSA-N 440.544 2.170 10 20 IECD O=C([C@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832883154 YRFYQGRFQGSKCE-GGUXULKNSA-N 444.528 2.473 10 20 IECD CC[C@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1842620883 HFXAIJPGEFFPHP-INIZCTEOSA-N 431.583 2.244 10 20 IECD CNS(=O)(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)o2)cc1 13457946 WNUYLSXBIPGUHM-ZSOIEALJSA-N 438.508 2.141 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCn3nnc4ccccc4c3=O)cc2F)C[C@H](C)O1 108287481 LCDMMCMPPUZCNS-HOTGVXAUSA-N 439.491 2.251 10 20 IECD Cn1ccc2c(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cccc21 727037792 JPCLEGQCUHFJNI-QGZVFWFLSA-N 433.512 2.135 10 20 IECD CCNC(=O)COc1ccc(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1OC 728945789 JOVVBGLXMMQATN-AWEZNQCLSA-N 431.489 2.485 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1=O 729627511 MPAQGMQVROAKKJ-GHTZIAJQSA-N 428.577 2.113 10 20 IECD Cn1ccnc1[C@@](O)(CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(F)(F)F 731857998 HWUJVQZBPPSARZ-KXBFYZLASA-N 427.423 2.474 10 20 IECD CC(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 737246585 ZIXOBSNZRSPCNP-UHFFFAOYSA-N 429.542 2.300 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O 753291987 ZJODOEXBUFGHAJ-JOCHJYFZSA-N 437.544 2.251 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccn(-c4ccccc4)n3)CC2)cc1 754006972 FWOMMFPBWRAUDJ-DEOSSOPVSA-N 435.572 2.496 10 20 IECD Cc1oc(S(N)(=O)=O)cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 754194030 YNKZZZDFWMXFMR-UHFFFAOYSA-N 447.435 2.021 10 20 IECD Cc1c(CCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cnn1C 758650239 JURKTVVDWOCPED-UHFFFAOYSA-N 437.523 2.233 10 20 IECD CCOc1cccc(CN2CCN(S(=O)(=O)c3cc(OC)ccc3OC)CC2)c1O 768200877 QJSFDMOYUXLWSO-UHFFFAOYSA-N 436.530 2.315 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCOC4(CCOCC4)CC3)cc2F)CC1 769509863 ULHCRKZUGOQTGR-UHFFFAOYSA-N 434.556 2.449 10 20 IECD CS(=O)(=O)[C@@H]1CCCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 770003196 XJALRQZDRIQDKJ-MRXNPFEDSA-N 440.521 2.300 10 20 IECD Cc1cc(C(=O)CN(C)C[C@H]2CCCC[C@@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778247123 UVUSHSJTZPSBHA-UTKZUKDTSA-N 433.574 2.407 10 20 IECD Cc1cc(C(=O)CN(C)Cc2ncc(Cl)n2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778986059 BCTDMGLDMMPGCK-UHFFFAOYSA-N 449.964 2.443 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F)c1ccc(N2CCOCC2)cc1 782105676 DQWIACZNXCDQGV-GFCCVEGCSA-N 425.411 2.091 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cnc1Br 783310591 WONGNKMAXDTRGJ-UHFFFAOYSA-N 433.306 2.244 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cc1 785443022 LBRLSSIPRBGCJV-GOSISDBHSA-N 428.920 2.334 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(-c4c(C)nn(C)c4C)[nH]n3)cc2)CC1 786262767 PSUUZEMMFCAEMN-UHFFFAOYSA-N 435.532 2.026 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(S(C)(=O)=O)s3)CC2)cc1F 786876987 ZOOBNBBHBOGRHE-UHFFFAOYSA-N 427.523 2.331 10 20 IECD C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309205 CWWQNGSLLDIIEL-INZIPBBXSA-N 443.569 2.096 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@H]1CCc2ccccc2C1 789800337 NZQIOQAGOYNXQT-KRWDZBQOSA-N 425.504 2.200 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789818080 ISIJEUOCCHWQBA-IRXDYDNUSA-N 435.540 2.067 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1cccc2cccnc12 789840663 MEEHKKSYILIBEA-UHFFFAOYSA-N 436.487 2.268 10 20 IECD Cc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789848055 YESMSTDHBIIMIG-UHFFFAOYSA-N 443.519 2.297 10 20 IECD CCN(CC)C[C@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793795482 QMQRQGPERDLADW-JKSUJKDBSA-N 426.508 2.220 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)c1 795300440 YXFDHFVLILPDEU-UHFFFAOYSA-N 426.516 2.355 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)c(OC)cc2Cl)cc1 797432705 OMJRDZGLHLFKJQ-UHFFFAOYSA-N 435.911 2.034 10 20 IECD Cc1cc(-c2nnc(N3CCC4(CC3)NC(=O)N(C)C4=O)n2C)c(C)n1-c1ccccc1 800742396 KFOWBBQFHJPZGE-UHFFFAOYSA-N 433.516 2.410 10 20 IECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCCCSc3nccs3)C2)c1 804084000 ZMOXGHJZMYBGPA-HNNXBMFYSA-N 434.587 2.393 10 20 IECD O=C(NCCc1ccn(-c2ccc(F)cc2)n1)C(=O)NCc1ccc(N2CC=CC2)cc1 807289139 KFMGCBNJWSRPMZ-UHFFFAOYSA-N 433.487 2.363 10 20 IECD CC(C)(O)[C@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770091 YAODGFKNTWHQGT-RHSMWYFYSA-N 425.476 2.135 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)c4nonc34)cc2)C1 814380157 VISPZRZOYYUDMT-ZDUSSCGKSA-N 449.920 2.056 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=N)N3CCN(c4ncccn4)CC3)cc2F)C[C@@H](C)O1 849070633 ZENPOFSJBCRMPD-IAGOWNOFSA-N 427.528 2.076 10 20 IECD Cc1sc2ncn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(=O)c2c1C 917146986 SDBQJIAICCRFCD-UHFFFAOYSA-N 430.505 2.367 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)cc2F)C[C@H](C)O1 917714019 LZKBBKAEXLHNRA-KBPBESRZSA-N 439.509 2.213 10 20 IECD COCCOC(=O)C1=C(C)N(CC2CC2)C(=O)N[C@@H]1c1ccc(N2CCOCC2)cc1 918074279 ZDAWSNUSELQBIX-OAQYLSRUSA-N 429.517 2.463 10 20 IECD COC(=O)c1cc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1OC 918169316 KZRWTVHWCMBUKZ-UHFFFAOYSA-N 431.464 2.457 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(Cn2cccn2)c1 918284535 IUMLCEKZOJSGCF-UHFFFAOYSA-N 437.475 2.162 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc2c(c1)OCCCO2 918440460 REDWALGAEIKYDP-UHFFFAOYSA-N 443.475 2.203 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(F)c(NC(C)=O)c3)CC2)cc1 918461771 LBOSQJBBJIJZCM-UHFFFAOYSA-N 428.464 2.470 10 20 IECD COc1ccc(OC)c(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 919786552 XHVYNYCFFLGLSI-IBGZPJMESA-N 440.544 2.447 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 920211684 KRNURRRNZNEAQE-UHFFFAOYSA-N 433.505 2.033 10 20 IECD CC[S@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427305 WUACNPPDQFMPPN-PMERELPUSA-N 431.514 2.399 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccc(F)cc1)c1cc(O)nc(O)c1 1792813902 QEIIXYFCXINRPS-BJWYYQGGSA-N 429.448 2.353 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803978625 ORXUOJBLVQGREL-AUWWNVLGSA-N 441.459 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1 1814166653 RVYFWEOHGZGWOZ-ZDRZLCEMSA-N 441.459 2.276 10 20 IECD COC(OC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824341736 GNPIVSZWSHBDBS-LKUPDRCFSA-N 448.516 2.055 10 20 IECD Cc1ncccc1CCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440845 DTRKXSRVHXATNC-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847034042 XCQZNKQZKZHCBK-QPJJXVBHSA-N 430.482 2.404 10 20 IECD CCCCN(C(=O)CN1CCCc2cc(OC)ccc21)c1c(N)n(CCC)c(=O)[nH]c1=O 10057076 CFYUKPLONMAWJF-UHFFFAOYSA-N 443.548 2.123 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ncn(Cc4ccccc4)n3)cc2)C1 726698270 BCPHYYNFSGRDCM-IBGZPJMESA-N 433.516 2.350 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCC1(O)CCCCC1 729051496 RSWWZXXACYQCRG-UHFFFAOYSA-N 442.539 2.437 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)nnn1-c1ccc2c(c1)OCCO2 731455841 SIJVHMCLFWLKJB-UHFFFAOYSA-N 435.484 2.114 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 734402046 DPLRBPLXMNLARC-UHFFFAOYSA-N 431.558 2.320 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1 734703277 LLNCVKQHJPWVTK-MRXNPFEDSA-N 449.515 2.107 10 20 IECD CN(CC(=O)Nc1ccc(CN2CCOCC2)cc1)Cc1ccc(N2CCOCC2)cc1 741737366 YTBYGYFIPYUBKS-UHFFFAOYSA-N 438.572 2.426 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1 742499149 WIPSGUHUAZEBKW-UHFFFAOYSA-N 429.542 2.208 10 20 IECD CCn1nc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)ccc1=O 742753640 KYHYRIMDTMMWBG-GOSISDBHSA-N 429.521 2.325 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCCC3)cc2)cc1 742831319 SPRNONQALFUAIT-UHFFFAOYSA-N 429.542 2.474 10 20 IECD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NCc1c(O)ccc2c1CCCC2 745789174 GAXIDWJAZYMEME-UHFFFAOYSA-N 437.544 2.204 10 20 IECD COc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1OCCO 759397921 DNZCSFCJJHVIDQ-UHFFFAOYSA-N 446.500 2.055 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4[nH]nc(C(N)=O)c4c3)cc2)CC1 760898503 UOEMHDJCJAFYSN-UHFFFAOYSA-N 434.500 2.153 10 20 IECD Cc1cc(=O)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 761861676 VKPUUPILUGVWPT-GJZGRUSLSA-N 432.452 2.134 10 20 IECD C[C@H](CC(=O)NCCc1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980816 RRJAVYHGOQGTTH-LJQANCHMSA-N 429.586 2.149 10 20 IECD CC(=O)Nc1ccccc1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 769461381 MDJKNUXKOHQYOP-UHFFFAOYSA-N 443.475 2.023 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(S(=O)(=O)CC)c3)c2)CC1 769848219 MSOCJXTZIXUSHH-UHFFFAOYSA-N 437.587 2.423 10 20 IECD NC(=O)[C@@H]1CCCN1Cc1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771901596 GMQNPLUTOWVVLU-SFHVURJKSA-N 442.903 2.464 10 20 IECD COC[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)OC 778501006 FJZUCGYZLQPOLV-AUWXEVLLSA-N 428.557 2.034 10 20 IECD CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C[C@H]1COc2ccccc2O1 779219395 LYUODGLCOSWZLQ-GGAORHGYSA-N 441.572 2.340 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CCCN3CCN(C)CC3)cc2F)C[C@H](C)O1 779333630 YYVHYPUPWVDABS-OALUTQOASA-N 435.588 2.218 10 20 IECD COc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1OC 780407069 FCSNTRLYWBWDHO-UHFFFAOYSA-N 437.493 2.312 10 20 IECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2ccccc2S(=O)(=O)N(C)C)cc1 780713471 LHCNXFLEABPWQY-UHFFFAOYSA-N 437.587 2.356 10 20 IECD CCOC(=O)[C@@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397630 DEUDDGFEQUNHAI-LLVKDONJSA-N 438.414 2.210 10 20 IECD O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786081308 IUPLYIZZVHSHBT-MRXNPFEDSA-N 436.503 2.116 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)c(C)cc3[N+](=O)[O-])cc2)CC1 786121502 FZMNNIAXLBEFGG-UHFFFAOYSA-N 446.529 2.359 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)C3CN(C(=O)OC(C)(C)C)C3)nc12 786976895 MSFSNRHQRKULCX-LBPRGKRZSA-N 448.476 2.158 10 20 IECD COc1cccc(C[C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788333202 PXNOIQMMOHFBMA-JOCHJYFZSA-N 437.540 2.382 10 20 IECD CC(C)CN1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789819434 MVZDXJHCBDUCGT-NSHGMRRFSA-N 448.583 2.150 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3nccs3)cc2F)C[C@@H](C)O1 789828739 YFDCGQJPIYCAAN-HUUCEWRRSA-N 434.537 2.213 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 790912165 OABJHQUWORDKDE-QZTJIDSGSA-N 442.516 2.166 10 20 IECD CC1CCC(C)(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793726303 SVZSALQSXSHYOV-MZXKRHHESA-N 428.577 2.337 10 20 IECD CCN(CC)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 793792513 HDDZFBWCHAVWKL-OAHLLOKOSA-N 444.498 2.005 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)cc1C 796710460 UIUZBLXZSLZVMR-GOSISDBHSA-N 438.528 2.269 10 20 IECD CN1C(=O)COc2cc(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 799246192 QZLPPNGGFRZFNQ-UHFFFAOYSA-N 428.464 2.464 10 20 IECD C[C@@H](OC(=O)[C@@H](O)c1cccnc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803955508 LVHNBHXOXNUNJC-XCLFUZPHSA-N 430.416 2.461 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1F 804852894 PWNSYDRERXETDS-GOSISDBHSA-N 432.540 2.195 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 804958238 PJCXXFRLYIXZFE-TXEJJXNPSA-N 442.538 2.333 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 805201499 FNOOEBWLAXJPDB-GOSISDBHSA-N 428.920 2.286 10 20 IECD CCN(CC)CCCNC(=O)C1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 809732275 IXWNCMBTOAZTFL-UHFFFAOYSA-N 429.653 2.499 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3ccc(C(F)F)cc3)cc2)CC1 815011018 XEGIREJVZMTLID-UHFFFAOYSA-N 444.525 2.479 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(Cl)nn3)cc2F)C[C@H](C)O1 815437299 IRJYVJBZZUYAOV-STQMWFEESA-N 436.871 2.356 10 20 IECD O=C(Cn1cc(Br)c(O)nc1=O)Nc1c(-c2ccccn2)nc2ccccn12 820006276 QTLMHGXNIMXXKQ-UHFFFAOYSA-N 441.245 2.060 10 20 IECD CC(=O)N1CCC(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 915930964 DQVFQBWJHJIPMN-UHFFFAOYSA-N 428.455 2.352 10 20 IECD CN(C)S(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 916626445 YSUGOXXHHAVVKL-UHFFFAOYSA-N 448.614 2.490 10 20 IECD CS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918104993 ZQLVHMCGOXLUAB-UHFFFAOYSA-N 445.585 2.439 10 20 IECD COCCOc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918117085 GLBCGAKANAAYGE-FQEVSTJZSA-N 440.544 2.413 10 20 IECD CN(Cc1cnn(-c2ccccc2)n1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918122451 KYQUUKKOFGNNLR-LJQANCHMSA-N 447.543 2.311 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)Nc4ccc(C)cn4)CC3)nc12 918187351 CYLRUUVLGDQXIX-UHFFFAOYSA-N 438.488 2.166 10 20 IECD COc1ccc(C(=O)N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1 919791775 JQLPITVYDGNDFD-UHFFFAOYSA-N 438.528 2.199 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1254279386 JFQBWZCYEWAWHY-MQNTZWLQSA-N 431.533 2.137 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1C 1787295312 FCZXDOHYYHWIOU-WDSOQIARSA-N 425.485 2.017 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=CCCS3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243156 UQNISOIDANJOEB-RBOXIYTFSA-N 438.933 2.365 10 20 IECD CC[C@H](NC)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807348097 DOWZXUILQGVBJN-UCLAIMLFSA-N 446.935 2.464 10 20 IECD Cc1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725863 QWZIDFMHHZSOAQ-GFCCVEGCSA-N 425.470 2.192 10 20 IECD COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1824738818 PKCTXRCXKTXMRH-SFHVURJKSA-N 440.500 2.444 10 20 IECD CC(C)c1nc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)co1 1843441411 UGHCXAQFBYWRCE-UHFFFAOYSA-N 435.484 2.408 10 20 IECD O=C(c1cc[nH]c2nccc1-2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039155 UGDUFIZYPDJMIX-HWKANZROSA-N 434.452 2.162 10 20 IECD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1847074488 DFEXJABGWZUULU-OAHLLOKOSA-N 448.520 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](C(C)C)N3CCOCC3)cc2F)CC1 303312877 PLMZUXKDSLCDRM-QFIPXVFZSA-N 435.588 2.124 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccc([N+](=O)[O-])cc3)cc2)C1 731686583 DGPKAHAYCBQXSS-QGZVFWFLSA-N 441.488 2.175 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc([N+](=O)[O-])cc(C)c3C)CC2)cc1 732923302 UWLZSRMCJOVEFI-UHFFFAOYSA-N 448.545 2.321 10 20 IECD CCOC(=O)N1CCC(NC(=O)CCCNCc2ccc(N3CCOCC3)cc2)CC1 733331016 XHFCYXFMNMPONC-UHFFFAOYSA-N 432.565 2.130 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccc(-n4cncn4)c3)CC2)cc1 735516572 QYLWXIFHJJKEFD-UHFFFAOYSA-N 449.559 2.287 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 751318178 KPHDMBWUOWVGGE-CQSZACIVSA-N 440.543 2.225 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)c3ccc(S(N)(=O)=O)cc3)cs2)cc1 751946289 YOETYQBPOCMVTC-UHFFFAOYSA-N 431.495 2.003 10 20 IECD Nc1cccc(C(=O)CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 753470551 DNZCHXJIGRHQCL-UHFFFAOYSA-N 443.475 2.067 10 20 IECD C[C@@H](C(=O)N1CCCC1)N1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 755939645 TWEFLIRFQQTUFD-SFHVURJKSA-N 437.540 2.457 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccnc3Cl)CC2)cc(OC)c1OC 759414395 YZNWXHZZEPMZQB-UHFFFAOYSA-N 434.880 2.048 10 20 IECD CCOC(=O)CSc1cncc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 762633149 JFSNBFFBALXZFI-INIZCTEOSA-N 429.546 2.446 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccccc1C[S@@](C)=O)c1ccc(N2CCOCC2)cc1 762639451 HAXSMBUMBUHIEB-XHDOVSQSSA-N 429.542 2.218 10 20 IECD COc1cc2ncn(CCCC(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c(=O)c2cc1OC 763279277 KFYJJLBETNQBNZ-CQSZACIVSA-N 441.484 2.353 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)cc(Cl)c3)cc2)C1 764249339 OXSQRKKEOPHYLZ-CQSZACIVSA-N 432.883 2.436 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765927388 QRYIZRFDHOSQBH-UHFFFAOYSA-N 436.262 2.377 10 20 IECD CC(C)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccccc1 766919466 DBRNOZKNQSKFIN-UHFFFAOYSA-N 428.508 2.285 10 20 IECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C(F)F 769022303 LFECFVPCWKCTCA-UHFFFAOYSA-N 446.502 2.145 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 770260333 SNRCDZCIJNMKRR-UHFFFAOYSA-N 428.424 2.446 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 771553469 QNEDJMRCZVBSTO-IBGZPJMESA-N 436.512 2.268 10 20 IECD COCc1ccc(S(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 774730743 FDDZTAHOOZQGNT-UHFFFAOYSA-N 433.574 2.332 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N3CCc4ccccc43)CC2)c1O 774839918 GOQVFMWUGNDPPN-UHFFFAOYSA-N 426.473 2.016 10 20 IECD C[C@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 775261191 UBMGNWDYMOPUOI-HNNXBMFYSA-N 426.473 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOc4cc(F)ccc43)CC2)cc1 778286181 WKVZTMOQEYFCEU-HJWRWDBZSA-N 425.460 2.465 10 20 IECD O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1 778924359 UNOLPLWDYLRDRR-AWEZNQCLSA-N 440.905 2.139 10 20 IECD Cc1cc(C(=O)NCC2CN(S(C)(=O)=O)C2)c(C)n1-c1ccc(Br)cc1 779126463 YJEDFUHMXGFHLZ-UHFFFAOYSA-N 440.363 2.478 10 20 IECD Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 781365370 HBWCONNLYLTUOG-HXUWFJFHSA-N 431.512 2.410 10 20 IECD Cc1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c(=O)n1C 785659419 ABIWYFONHFHANI-UHFFFAOYSA-N 431.404 2.307 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(-c2ccccc2)no1 788312313 HKAPMQVXSLZMDL-KRWDZBQOSA-N 449.511 2.109 10 20 IECD CO[C@@H](CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(F)(F)F 789823069 YMJRUOZXKILNNO-AHIWAGSCSA-N 449.445 2.139 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 803135707 PDADZHKDEGOHDX-INIZCTEOSA-N 436.528 2.271 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cc1F 803663125 KBTYORFTWPPANP-UHFFFAOYSA-N 446.910 2.032 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CN4CCC[C@H]4CO3)cc2Cl)C1 804059413 ZXJVVPLQISKKOT-NEWSRXKRSA-N 448.995 2.172 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC34CCOCC4)cc2F)CC1 805007211 HNVSLDLNLVWIRU-NRFANRHFSA-N 446.567 2.049 10 20 IECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCN(Cc2ccccc2)C1=O 806280603 GIEBCHFURWHDIT-MRXNPFEDSA-N 432.571 2.001 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 807617314 MBQYGLNDDSTUHY-HXUWFJFHSA-N 425.529 2.108 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCC(=O)O)cc2)cc1OC 917759132 HXPBWVMKSBUYNZ-UHFFFAOYSA-N 442.515 2.275 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 917930947 ZZVIVMWFUQILTO-SFHVURJKSA-N 445.541 2.044 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC)c2)cc1 918309736 HRSIQJUGVLCSIV-UHFFFAOYSA-N 446.573 2.346 10 20 IECD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2=O 919969940 JTARIWUAFWXPHL-BXKMTCNYSA-N 442.560 2.012 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920925607 KLYMRISTRVYLSG-KRWDZBQOSA-N 438.528 2.397 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2 1782007351 QPQNEZXFCKETFH-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1)CCO2 1785510165 PTDGJFBBWMOSAG-VURDRKPISA-N 442.443 2.099 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccnn2)C3)cc1 1799620916 PPBFCCWYXKFTSY-JHDGKUDLSA-N 445.523 2.401 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1824312910 NOLMDXVTGCHRAE-CRAIPNDOSA-N 427.505 2.184 10 20 IECD CN(C)c1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1844936694 FPYJXMIKGBUAGF-UHFFFAOYSA-N 445.523 2.363 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)n(C)c2ccccc12 565721245 WMQMEBUIWWCAFM-MRXNPFEDSA-N 435.528 2.039 10 20 IECD COc1cccc(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1O 729859236 NDDMDGFWCMOPMV-KRWDZBQOSA-N 449.485 2.169 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)CN(C)Cc3ccccc3O)cc2)C[C@@H](C)O1 731843507 MAMRKJDEMHWFIK-CALCHBBNSA-N 447.557 2.261 10 20 IECD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NCc3ccc(N(C)C)cc3C)CC2)c1 734406313 RHFBEGSCHYSFHP-UHFFFAOYSA-N 444.601 2.138 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)CC2)cc1 742921612 VRVWXACBPBGFRC-HXUWFJFHSA-N 426.492 2.199 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCCN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 743363599 ULOFOHLBTSBVDL-OYRHEFFESA-N 431.625 2.484 10 20 IECD CC[C@H](O)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738618 VVENZRGMLHPNOK-SFHVURJKSA-N 430.528 2.293 10 20 IECD CN(C)c1ccc(CN(CN2C(=O)C[C@H](Cc3cnn(C)c3)C2=O)CC(F)(F)F)cc1 746377704 OMUQQSYIJRKJMN-KRWDZBQOSA-N 437.466 2.426 10 20 IECD CCCc1ccc(-c2nc(NS(=O)(=O)c3cn(C)c(=O)n(C)c3=O)sc2C)cc1 748859482 DDFDJGNATMEUJN-UHFFFAOYSA-N 434.543 2.269 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 750253597 OBGQDXSLOLORIE-UHFFFAOYSA-N 426.517 2.450 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(C)c([N+](=O)[O-])c1 753838907 XSNMSNHPLRAAJF-UHFFFAOYSA-N 438.440 2.321 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(O[C@@H]4CCOC4)c3)cc2F)CC1 754249807 VLMIETOARARWOM-LJQANCHMSA-N 428.508 2.460 10 20 IECD Cc1ccc(S(=O)(=O)NCCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)s1 761927190 FULLZMBLNFNXBX-UHFFFAOYSA-N 443.934 2.158 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 762634933 DHYYPGLOCQBJMS-JJCDCTGGSA-N 430.526 2.417 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@@H]1N1CCN(C)CC1 764352252 SOYIDWWEKMLZFB-UGKGYDQZSA-N 431.650 2.407 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](CC(=O)OC(C)C)C3)CC2)cc1 766914600 DHTBJZSVLJUOQT-UNMCSNQZSA-N 433.593 2.232 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@H](C)O1 769710188 ILASPWMSZGSDGU-KBPBESRZSA-N 447.513 2.265 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)cc1 776038447 YMTGZKPEXPNGHP-UHFFFAOYSA-N 425.457 2.349 10 20 IECD Cc1cc2c(=O)n(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc2cc1F 783919223 AJYWTPBKBWLIEI-UHFFFAOYSA-N 428.439 2.136 10 20 IECD O=C(NCCc1cnn(-c2ccccc2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786119328 DKEDXPOPQSQLNN-JOCHJYFZSA-N 448.523 2.444 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 787974684 NOYDVVXWHQMSJA-NRFANRHFSA-N 425.529 2.321 10 20 IECD CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788930260 QATLEUMFFDKZBO-IBGZPJMESA-N 428.577 2.304 10 20 IECD Cc1ccccc1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832723 CVDOUADZMYVZKE-QGZVFWFLSA-N 427.520 2.459 10 20 IECD CCCN(C[C@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842615 FFQVLRMFHYEAEB-LJQANCHMSA-N 435.540 2.211 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC(CN2CCCC2)CC1 789854449 HTEPAJRYPTULQP-UHFFFAOYSA-N 430.618 2.190 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1cccs1 793733009 KFZTXLZSPIWLIO-AEFFLSMTSA-N 442.585 2.061 10 20 IECD C[C@@H](c1ccc(F)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735836 ZALOVPQXIFXNRA-QFBILLFUSA-N 440.519 2.363 10 20 IECD COC(=O)[C@]1(c2ccccc2)CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 794808991 VESKVVQRMUBPSF-RUZDIDTESA-N 437.540 2.161 10 20 IECD COCCOC(=O)C1=S=c2nc(/C(Cl)=C\c3ccnn3C(C)C)nc(O)c2=C1C 794933035 DUWQYFXMMJFSHS-UKTHLTGXSA-N 436.921 2.227 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@@]4(CCCOC4)C3)CC2)cc1 797412484 OOZBVUVXHSIAGU-RDPSFJRHSA-N 446.592 2.187 10 20 IECD O=C(COC(=O)c1cc2ccccc2c(=O)o1)NCc1ccc(N2CCOCC2)c(F)c1 797481048 URWPPPNZMPZQKY-UHFFFAOYSA-N 440.427 2.242 10 20 IECD Cc1c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc(Br)cc1[N+](=O)[O-] 797535348 LTFSBIFSVJTZNV-UHFFFAOYSA-N 438.234 2.374 10 20 IECD C[C@@H]1COCC[C@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977731 XSJORMYTWGLNBN-MJGOQNOKSA-N 442.539 2.414 10 20 IECD CCc1nsc(N2CCCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 807673717 XWBVJEQJLCMMFK-OAHLLOKOSA-N 430.578 2.083 10 20 IECD Cc1ncc(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768258 GFIYZPRKRZENIS-AWEZNQCLSA-N 438.500 2.497 10 20 IECD CCOC(=O)Nc1scnc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 813420311 KWKUSNNWBUELOE-AWEZNQCLSA-N 431.518 2.343 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCC(=O)Nc3ccc(F)c(F)c3)CC2)cc1 917211211 YWOPPIGXIOCQJI-UHFFFAOYSA-N 432.471 2.240 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(C(N)=O)cc3)cc2F)C[C@@H](C)O1 918991219 YDVIBNHYLJIJIH-GASCZTMLSA-N 443.475 2.011 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(c4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 1318570654 LZQSEUVESDRQHM-SOLBZPMBSA-N 430.528 2.251 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)N(C)OC)cc3)CC2)cc1 1323192681 VNDQIJHFDXKMKT-UHFFFAOYSA-N 433.530 2.230 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnco1)C2)c1cc(O)c(O)c(Cl)c1 1781119783 ZUXLKAABFKGUBH-OXQOHEQNSA-N 435.864 2.181 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1804285189 IAKSMCQSJVLKRV-SEDYWJOHSA-N 426.473 2.054 10 20 IECD COc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n1 1810542841 AZFSGVMZWCFCBI-UHFFFAOYSA-N 426.473 2.055 10 20 IECD CC(C)[C@@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708417 YPQPSGHELYEGEI-MEBBXXQBSA-N 439.921 2.450 10 20 IECD C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1(F)F 1838032376 PREWGQLYALOQTG-HXUWFJFHSA-N 439.459 2.150 10 20 IECD CCc1cnc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1844382527 MDYFSKHUWBKANY-FNORWQNLSA-N 429.498 2.353 10 20 IECD CCS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845398008 OYVXBOXNEPCEFU-UHFFFAOYSA-N 443.569 2.346 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4cccs4)n3N)CC2)cc1 10021976 DNYSJXYZXPBALR-UHFFFAOYSA-N 430.559 2.170 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1 111208592 QKOVFWWYMIECOU-YZOUICBYSA-N 428.533 2.029 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cnn(CC(=O)NCCN(C)C)c3)ccc21 607558140 OSBXSEXJGQJGFF-UHFFFAOYSA-N 440.548 2.031 10 20 IECD COc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1Br 725905142 XATMXKSEXPMZQI-UHFFFAOYSA-N 429.292 2.465 10 20 IECD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)N(C)Cc1ccccc1O 726290284 PGDAGRRURLBONJ-UHFFFAOYSA-N 427.526 2.487 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccc(O)cc3)cc2F)C[C@@H](C)O1 726872315 DYBFHRFQTHTHKE-IYBDPMFKSA-N 429.492 2.120 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1 737008708 IAJXKQFBWGHBDY-UHFFFAOYSA-N 440.548 2.396 10 20 IECD CCc1ocnc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 740268403 WFXMUTQMEUUNIH-UHFFFAOYSA-N 431.470 2.332 10 20 IECD Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCCC1 742247427 DHDAMEHWHSYMRQ-UHFFFAOYSA-N 438.525 2.404 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)cc2F)CC1 742644805 HYQLBWVYEKGKHN-QGZVFWFLSA-N 437.523 2.499 10 20 IECD CC(C)N1C(=O)c2ccc(C(=O)N3CCOc4cc(N(C)C)ccc43)cc2S1(=O)=O 742951987 FGCGFGPCVMAPMK-UHFFFAOYSA-N 429.498 2.345 10 20 IECD CN(C)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1F 752657963 HJYSQYJLINKFNP-UHFFFAOYSA-N 434.946 2.384 10 20 IECD CCOC1CC(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)(N2CCOCC2)C1 767887421 GELAGRLZDVUNDJ-UHFFFAOYSA-N 446.592 2.187 10 20 IECD O=S(=O)(c1ccc(Cl)s1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768443038 XOVXCAODBXYTLT-AWEZNQCLSA-N 430.935 2.039 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3c(F)cccc3F)CC2)cc1 778346025 HXNFKVHEVYLRIY-SQUSKLHYSA-N 445.466 2.028 10 20 IECD COCCN(C(=O)CN(Cc1ccccc1)c1ccc(OC)cc1)[C@@H]1CCS(=O)(=O)C1 781307208 KSPIFPYFLDVWEE-OAQYLSRUSA-N 446.569 2.364 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)cc1C 788328942 TXKMFYCNYVAFOC-UHFFFAOYSA-N 443.475 2.321 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H]3CCO[C@H](C)C3)cc2F)C[C@H](C)O1 789819090 LIDMEJOURNUIQD-VSZNYVQBSA-N 435.540 2.377 10 20 IECD C[C@@H]1CCCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789823697 FCSIPECICMXXOI-NCXUSEDFSA-N 448.583 2.292 10 20 IECD CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844426 SANZEKPSWHJQIJ-LPTQZCDUSA-N 449.567 2.359 10 20 IECD Cc1cnc([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 789848054 YERSXQOQNLLQOQ-ZDUSSCGKSA-N 434.537 2.088 10 20 IECD CN1CCC([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)C2)CC1 789854492 BBXHCZRUPZFLQX-HXUWFJFHSA-N 430.618 2.046 10 20 IECD CCC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716277 BRNLHJAZTQJGBS-DYXWJJEUSA-N 428.577 2.480 10 20 IECD CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451081 YBQJTBUJHOSBCO-SJLPKXTDSA-N 438.519 2.362 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cc1F 804853902 XBPLRHMLPOOBGS-NSHGMRRFSA-N 448.583 2.388 10 20 IECD CC1(C)CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC[C@@H]1O 806507074 HALRHRIRWZRJQQ-FQEVSTJZSA-N 442.539 2.245 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCN(c2ccccc2)C1=O 807292777 YHQAOSNZMXTPBX-JOCHJYFZSA-N 432.524 2.333 10 20 IECD Cc1cccc(O[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807637060 VONHNDKDZLKNDW-IBGZPJMESA-N 425.529 2.374 10 20 IECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1ccc2nc(O)nc(O)c2c1 917912835 XSTKOBRLWZRMBC-UHFFFAOYSA-N 432.527 2.073 10 20 IECD CN(C)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806901927 RVRFCGWUIXXJTR-YWZLYKJASA-N 446.935 2.418 10 20 IECD CCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722558 MHZUGAUEACLAOT-JTQLQIEISA-N 429.458 2.039 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1 1836658045 HGTOMUKWOBOVAK-MOPGFXCFSA-N 429.517 2.151 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2[nH]nc3ncccc23)C1 1843284209 PKLNDYYNGBIJAL-UHFFFAOYSA-N 427.848 2.153 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)n3)C2)cc1 1843358587 JREDTAQWKDIUOF-UHFFFAOYSA-N 447.495 2.426 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2CCCSC2)C1 1847020804 XXPIWLOKHAMBMB-INIZCTEOSA-N 426.542 2.126 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 10907931 MOVRESOGRBHHTK-UHFFFAOYSA-N 431.558 2.402 10 20 IECD CC(C)N1C(=O)c2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3)cc2S1(=O)=O 108807428 CTRSJNZQAQTLOA-UHFFFAOYSA-N 443.525 2.006 10 20 IECD CC(C)n1c(S)nnc1[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 732306333 YRSFYLFLKMFREJ-LBPRGKRZSA-N 439.563 2.245 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)NCc3cc(OC)ccc3O)cc2)CC1 734062909 BNKVXTCMTAJULW-UHFFFAOYSA-N 428.489 2.018 10 20 IECD CC(C)NS(=O)(=O)c1cccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739767843 GPJGXHHUACXXER-UHFFFAOYSA-N 444.557 2.327 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1nnnn1C1CC1 742847690 OOWPDDCEVAVEBS-LCYFTJDESA-N 434.572 2.367 10 20 IECD O=C(CN1CCC[C@@H]1CN1CCOCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744413596 QVZKZDCCPTUIJQ-GOSISDBHSA-N 433.508 2.197 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](Cc4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 746679963 RVJNXHDGCYRVAX-WSTZPKSXSA-N 443.567 2.354 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccccc3N3CCOCC3)CC2)cc1 751304107 RNAPWAQTYMDPNZ-UHFFFAOYSA-N 438.572 2.474 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc4c3oc(=O)n4C)CC2)cc(OC)c1OC 759226255 XBWCNHXIOVQCGB-UHFFFAOYSA-N 427.457 2.120 10 20 IECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1 759299166 ZFXDOEZIPYPSIL-HXOBKFHXSA-N 428.508 2.234 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@H]1CCOC1 764372385 KFKVJVXJGGVXHH-STQMWFEESA-N 435.458 2.256 10 20 IECD O=C(NCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 768915036 SZMJPMSPHGILJN-UHFFFAOYSA-N 426.441 2.093 10 20 IECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)N1CCOc2cc(N(C)C)ccc21 768985175 RCPUTBOEGABNKF-IBGZPJMESA-N 434.537 2.144 10 20 IECD CS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1F 771169652 KDPWRLRIMCEXFS-UHFFFAOYSA-N 427.523 2.276 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccco1)N1CCCC1)c1ccc(N2CCOCC2)cc1 774871344 PSOHDOFQCYGXHI-WIYYLYMNSA-N 440.544 2.247 10 20 IECD CCc1nc(N)nc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 776292650 SAJKFOLQLXJKJD-STQMWFEESA-N 434.541 2.177 10 20 IECD CCOc1cnc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 777575784 LJOOFZMDZGKCAY-UHFFFAOYSA-N 437.479 2.061 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCOC[C@H]2c2noc(-c3ccccc3)n2)c1 779698885 DNPBUAYNCJNGBT-INIZCTEOSA-N 444.469 2.027 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 781535108 FUOQZWQKLWYXNT-UHFFFAOYSA-N 433.411 2.047 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(C4CCOCC4)c3C)cc2)CC1 787328735 UDJAHDXITVSBKF-UHFFFAOYSA-N 425.533 2.142 10 20 IECD CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 788431737 JSAUAXRWHJHDPH-UHFFFAOYSA-N 428.533 2.195 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 789653528 ZDILGMULKGKZCU-HEEFDWFXSA-N 448.523 2.281 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 789862969 IKVFTUKOPZEYMI-UHFFFAOYSA-N 449.533 2.159 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12 789949988 LSOPBWYTSIXDBK-LUVWLHFXSA-N 437.462 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOc4cccc(F)c4C3)CC2)cc1 801475061 FTSDBHJOVPMWFU-MDZDMXLPSA-N 439.487 2.460 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297531 YYWQGLLEUABQEI-ROUUACIJSA-N 441.528 2.293 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(OC)c(F)c3)CC2)cc1 804651105 HNUBPBJEUGNXNO-UHFFFAOYSA-N 429.492 2.241 10 20 IECD Cc1cc(C(=O)OCCn2cc(C(N)=O)nn2)c(C)n1-c1cccc(Br)c1 805941346 XNRBRCKRCLWRIY-UHFFFAOYSA-N 432.278 2.404 10 20 IECD COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457813 RQHATMORLSXXEX-IBGZPJMESA-N 447.429 2.424 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cn(C)nc1-c1ccccc1 806776632 UZNXGYMINRVOLZ-UHFFFAOYSA-N 447.539 2.199 10 20 IECD CS(=O)(=O)c1ccc(N(CCN)Cc2cc(Br)ccc2O)c([N+](=O)[O-])c1 809728707 GCTCVPLNRVOSQA-UHFFFAOYSA-N 444.307 2.432 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)sc1C(C)=O 815575387 QAVXVAKUQDZCBN-NSHDSACASA-N 432.502 2.404 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 917832998 JVCRDQXJQDYJHP-OAHLLOKOSA-N 449.960 2.375 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H](C)O1 918200049 UXEGTASZOCPYMS-IRXDYDNUSA-N 436.572 2.474 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC3CCN(CCN(C)C)CC3)cc2F)C[C@H](C)O1 918205213 JKWFZQAXRAYINN-ROUUACIJSA-N 435.588 2.265 10 20 IECD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 919791247 ZVPFJWNFXYPHGY-UHFFFAOYSA-N 446.573 2.209 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCN(S(=O)(=O)c2ccccc2)CC1 920087599 MZWNFRPQHLZBHQ-UHFFFAOYSA-N 444.601 2.108 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)no1 920787826 XMZRMZBBVGOMPZ-UHFFFAOYSA-N 435.484 2.479 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2cccc(F)c2)cc1O 1321862460 WSHWUKPNLRNCJG-HNNXBMFYSA-N 429.404 2.032 10 20 IECD Cn1nc(-c2ccco2)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1333819934 NGEARYSWBGXNGL-UHFFFAOYSA-N 429.502 2.237 10 20 IECD COc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1-c1ccccc1 1334473562 ZEZVDYBWZODTJH-UHFFFAOYSA-N 440.525 2.046 10 20 IECD O=C(Cc1ccccc1O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782009106 RVWAFXGERPACBK-QFIPXVFZSA-N 446.887 2.143 10 20 IECD O=C(CC1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1786319467 MTTCNHCERRKBTF-AIONWGCTSA-N 444.528 2.377 10 20 IECD O=C(CCc1ccc[nH]1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1787026034 CKHMOBSCMUXGLG-AXHNFQJDSA-N 447.919 2.305 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2ccc(F)cc12)c1cc(O)nc(O)c1 1798141010 FEZOBJFMNUCPRE-BTTYYORXSA-N 425.420 2.074 10 20 IECD O=C(CCc1ccc(O)nn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718826 JMPGDJODWDJYEF-QDMKHBRRSA-N 446.891 2.131 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccn2nccc12 1804289749 RUBUPYLFPGRUJP-BJKLQHCMSA-N 448.479 2.416 10 20 IECD O=C1CC[C@@H](C(=O)N2CCCC3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)C2)CN1 1804978420 TWXCZQYZEINDOH-CQSZACIVSA-N 449.935 2.122 10 20 IECD COC1(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)CCC1 1827404684 MYAVMHKWCHJUPM-LBPRGKRZSA-N 432.502 2.134 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)s3)CC2)CC1)c1cc(O)nc(O)c1 1834985412 DECZUIZPZQCVBD-UHFFFAOYSA-N 448.520 2.192 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H]3C[C@]3(C)NC(=O)NC3=O)ccc21 561238752 WNYPBKFTCAWMNB-HXOBKFHXSA-N 426.517 2.497 10 20 IECD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 727608971 FQIWBEHRZRTXAB-QGZVFWFLSA-N 446.573 2.334 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CSCN3C(=O)C(C)(C)C)CC2)cc1 728151424 CAOXQYZOTXKZNG-FQEVSTJZSA-N 448.633 2.271 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3nnc(C(C)(C)C)s3)cc2F)CC1 730390454 FKYWNMUWNRNKIK-UHFFFAOYSA-N 448.568 2.372 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc2c(c1)CCC2 730570822 LOXRMGIUNWUKGG-SFHVURJKSA-N 444.601 2.271 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](CS(N)(=O)=O)C3)c2C)cc1 733997727 UZCCZDRJGRZGSQ-KRWDZBQOSA-N 447.557 2.064 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)c1O 737278327 IOPJGUNWVNBBHX-UHFFFAOYSA-N 444.507 2.325 10 20 IECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cn1 747750265 NXBNUIXZDLPNED-UHFFFAOYSA-N 433.515 2.339 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@@H]4CCOC4)CC3)cc2)C1 753121459 NOOWLFMDHTVEAP-WOJBJXKFSA-N 444.576 2.115 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)CCc3ccccc3)CC2)cc1 753306732 LDONLBGBRYSWMQ-MBWOQUJGSA-N 437.540 2.010 10 20 IECD COc1cc(Cl)cc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1O 761184596 NTTKECULLAWQNK-UHFFFAOYSA-N 441.893 2.469 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(N(C)C)cc1 773857686 NHALIUHOWRDQFX-MRXNPFEDSA-N 444.557 2.353 10 20 IECD O=C(Cc1csc(N2CCOCC2)n1)NCc1ccc(N2CCC(CO)CC2)cc1 773980605 XYUCXRKUKSZDHW-UHFFFAOYSA-N 430.574 2.047 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 775258986 DHPNLDMMJGJAAV-KRWDZBQOSA-N 446.573 2.029 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 776906140 PIFNQALWMIRJIM-VQIMIIECSA-N 445.564 2.054 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H](c1ccc(C)cc1)n1cncn1 785440772 CELPBKSYVQPZAA-VXKWHMMOSA-N 434.544 2.453 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1 786754005 URGIEMPGOUQLMK-UHFFFAOYSA-N 431.558 2.210 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cc(F)ccc3F)cc2F)CC1 787041570 SKPPADOHZWTKSN-UHFFFAOYSA-N 434.462 2.178 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCSc3nccs3)cn2)C[C@@H](C)O1 787198004 MBSRSOXIQOREOB-GASCZTMLSA-N 449.602 2.067 10 20 IECD COc1c(C)cc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 788311030 OVIVCZWSNDORQH-UHFFFAOYSA-N 425.529 2.423 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 788312612 KXMJPSHOUVMFHH-FQEVSTJZSA-N 425.504 2.370 10 20 IECD C[C@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789798100 BNLQLFFOCUAYNX-DEOSSOPVSA-N 425.504 2.469 10 20 IECD CO[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 789798906 FRAHGYBWUKXGKW-HXUWFJFHSA-N 449.910 2.436 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccnc1 789847736 SYUDKNHKZZMWDT-HXUWFJFHSA-N 442.535 2.354 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 789862544 VOUMLIVLWAKWGL-UHFFFAOYSA-N 438.597 2.200 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](OCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 803306182 SSKVLXXJUKESKT-QAPCUYQASA-N 443.466 2.270 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@H]([C@H]3CCCO3)C2)cc1)C1CCCCC1 803677357 NEHHDJURRXYNRW-YADHBBJMSA-N 429.561 2.478 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687807 HHPBVMIEWKFQRX-MRXNPFEDSA-N 430.549 2.058 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1 807292397 PXGSBTQAWOAFHD-WOJBJXKFSA-N 441.553 2.092 10 20 IECD C[C@H]1c2cccn2CCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856524 VKMPJIYVJDCXFO-IBGZPJMESA-N 435.572 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccccc4-n4ccnn4)n3)CC2)cc1 809465468 WJCJJZRIOQVLQP-UHFFFAOYSA-N 445.483 2.217 10 20 IECD COCCN1C(=O)/C(=C(\C)Nc2cccc3c2C(=O)c2ccccc2C3=O)C(=O)NC1=S 814334936 KINKQPREDFTURN-SFQUDFHCSA-N 449.488 2.038 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC4(CC3)OCCCO4)cc2F)C[C@@H](C)O1 815156450 IBEIKOQIPBMPFJ-HDICACEKSA-N 435.540 2.285 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)c4cccc(C)c4)CC3)nc12 917096869 GRCFQEFKXRUBRU-UHFFFAOYSA-N 437.500 2.268 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 918039644 OPVDKYYOCXSKQK-UHFFFAOYSA-N 437.500 2.491 10 20 IECD CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 918305853 MURKKKIMOINKMI-UHFFFAOYSA-N 446.573 2.379 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\c3ccc(OC)c(OC)c3)nc12 918847551 HWVGBCXXVBXXJJ-VURMDHGXSA-N 427.413 2.385 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3ccc4ccccc4n3)CC2)c1 919815555 NTSCDEIZQJCRIO-UHFFFAOYSA-N 426.498 2.274 10 20 IECD O=C(NCCNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919919329 OAOBEAYWMMEHNQ-UHFFFAOYSA-N 432.471 2.155 10 20 IECD CN1CCN(c2ccc(CNCCCN3C(=O)NC4(CCCCC4)C3=O)cc2F)CC1 1116017718 YJTZBNRAFWGFGD-UHFFFAOYSA-N 431.556 2.312 10 20 IECD COc1cc(N2CCN(C(=O)NCCC(=O)N3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 1122091091 UYLDAZLPVLDZBE-QGZVFWFLSA-N 448.564 2.193 10 20 IECD CCS(=O)(=O)c1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1319427985 XIFXHORKZVXDQD-UHFFFAOYSA-N 435.521 2.184 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C 1320692646 NLRPGSDGTZVVAU-CVEARBPZSA-N 436.505 2.478 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc2c(O)cccc12 1796604111 HZYKDKWQHZAIRW-QDMKHBRRSA-N 434.452 2.312 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)cc1)C2)c1cc(O)c(O)c(Cl)c1 1799768839 AJFPMBLUTYBVKF-ZSBFGKGUSA-N 434.851 2.407 10 20 IECD O=C(c1c[nH]c2nccc-2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038855 KQSFIAKJRZHUME-HWKANZROSA-N 434.452 2.162 10 20 IECD C[C@@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N2CCOCC2)cc1 109189613 HLKWKPMMWKFWFW-MRXNPFEDSA-N 429.542 2.455 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N3CCC[C@@H](NC(C)=O)C3)ccc21 728640629 YAIGYULFOTYNAK-LJQANCHMSA-N 429.517 2.188 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1=O 729628700 XTVYLYXXBLDHAD-KAGYGMCKSA-N 428.577 2.033 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 746792411 DHPHSGWDQTYNSB-INIZCTEOSA-N 425.485 2.434 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(C)c1 754213517 SVJCPWJNYVZDOU-UHFFFAOYSA-N 445.491 2.455 10 20 IECD C[C@@H]1C[C@H](NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c2c(O)ccc(F)c21 756442449 QCIZWXCEHKYVSI-WBVHZDCISA-N 434.537 2.216 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(N4CCCC4=O)c3)CC2)cc1 758225787 VEHDPIUYRKRGPG-NRFANRHFSA-N 425.529 2.384 10 20 IECD COC(=O)C12CCC(C(=O)N3CCN(c4cc(OC)c(OC)c(OC)c4)CC3)(CC1)C2 759144326 CESNYJQOEFLZRJ-UHFFFAOYSA-N 432.517 2.485 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1OC 759164502 UORHLSNULLWEKX-UHFFFAOYSA-N 445.475 2.174 10 20 IECD COc1cc(N2CCN(CC(=O)N[C@H]3CCOc4ccccc43)CC2)cc(OC)c1OC 759885674 FIYZUHXWIXYDEG-IBGZPJMESA-N 441.528 2.474 10 20 IECD COCCN(CC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc(OC)c(OC)c1 760858268 VHOQKBWSIWCNRZ-UHFFFAOYSA-N 446.895 2.424 10 20 IECD O=C(CCCOc1ccc2c(c1)OCO2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 764940522 RPYIEFCSLXZMGQ-UHFFFAOYSA-N 446.525 2.126 10 20 IECD O=[N+]([O-])c1cc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)ccc1N1CCCCC1 769501933 FWYHDFLIIPAJGR-UHFFFAOYSA-N 449.533 2.221 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 774804633 AMXKTELZGZPJHG-KRWDZBQOSA-N 449.502 2.393 10 20 IECD COCCN(C(=O)/C=C/c1scnc1C)c1c(O)nc(=O)n(Cc2ccccc2)c1N 776731530 NYTXUZUKWPVQGW-CMDGGOBGSA-N 441.513 2.037 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccccc4OC)CC3)CC2)cc1 779215116 GMLCUQVKZDGCPQ-JOCHJYFZSA-N 440.588 2.009 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@](C)(O)c3ccccc3)CC2)cc1 779346583 PAFBNCDLEKYJSL-AYZYJWAHSA-N 437.540 2.314 10 20 IECD COc1cccc(CNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c1O 780794110 OMSJJFVVCYZJME-UHFFFAOYSA-N 425.406 2.173 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@](OC)(C(F)(F)F)C3)CC2)cc1 781978792 SMCOXTRHRXQGKO-ICSRJNTNSA-N 431.499 2.221 10 20 IECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 784691440 DWPYOEJCZZEMJN-UHFFFAOYSA-N 425.485 2.266 10 20 IECD Cn1ccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 785601465 VFOUPGYQYJVUIK-OAQYLSRUSA-N 449.580 2.495 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc([N+](=O)[O-])cc(C)c3C)cc2)CC1 786122231 NTMCIQKZLIEPAC-UHFFFAOYSA-N 446.529 2.359 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(c4c(F)cccc4F)=NO3)cc2)CC1 786657523 ZDSWEQGTPGEKMS-NRFANRHFSA-N 442.466 2.443 10 20 IECD C[C@@H](NC(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 788324919 ZUUOFAAMAOOGFZ-LJQANCHMSA-N 438.572 2.385 10 20 IECD C[C@H](O)C[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820938 RABFBGFHKWDCGC-FAJBIJEISA-N 435.540 2.208 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCCC4)C3)cc2F)C[C@H](C)O1 789827456 SULSSCVUMRFWKQ-ROUUACIJSA-N 447.551 2.475 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1C 797389751 WTLLWHQPZLVQER-UHFFFAOYSA-N 435.502 2.116 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c(O)c1 797390093 NINMVSIBWGKTEE-UHFFFAOYSA-N 440.544 2.495 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCN1C(=O)OC(C)(C)C 803664348 LDEHUZHXELKTLG-GOEBONIOSA-N 436.528 2.412 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(c4ccc(Cl)cn4)CC3)ccc21 803686756 PHOLZHOHABFKOM-UHFFFAOYSA-N 427.936 2.082 10 20 IECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C12CCC2 805010072 SZCLCZLOGZOUAV-SFTDATJTSA-N 446.567 2.048 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc(OC)c1OC 806928390 UAMKOHPSOWEVBP-GVDBMIGSSA-N 433.549 2.302 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(C[C@H]2CCOC2)CC1 807102592 JKZLMBGJSBQYRU-OAQYLSRUSA-N 442.604 2.252 10 20 IECD COc1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)c(O)c1 807546299 SAPPJDUWPFFMKI-UHFFFAOYSA-N 427.910 2.140 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807671179 LVUSYGCJZYGFPC-INIZCTEOSA-N 427.501 2.334 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1=CCN(C)CC1 807771239 TYVQVGANLBOGJJ-RDJZCZTQSA-N 436.503 2.140 10 20 IECD O=C(COC(=O)c1cnc2[nH]c(O)nc2c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808633926 INAOMMQMTVZLHQ-UHFFFAOYSA-N 442.387 2.234 10 20 IECD COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284389 DSQUPFGTKSBICK-UHFFFAOYSA-N 449.866 2.357 10 20 IECD C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C[C@@H](C)O1 918443504 CNIQKZJALIQKIU-HZPDHXFCSA-N 425.485 2.239 10 20 IECD COC(=O)[C@@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c2ccccc2O1 918456579 SSZSQUWBJSWTHN-NRFANRHFSA-N 437.496 2.211 10 20 IECD COC(=O)N(C)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 920187933 JGQCWWTYSUKGHP-UHFFFAOYSA-N 440.500 2.323 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920887028 XHBKYFPBNNECIJ-OAHLLOKOSA-N 435.521 2.452 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCCCC2)[nH]n1)c1cc(O)nc(O)c1 1817844588 FSFWREGNFVCSML-QGZVFWFLSA-N 442.520 2.398 10 20 IECD CC(C)n1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817845174 DONZQHZLXOGBFK-AWEZNQCLSA-N 440.464 2.008 10 20 IECD CO/C=C(\C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1819550445 UOTODDJOZKAHMK-AJKMFMQHSA-N 445.497 2.436 10 20 IECD CC[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1824081105 XYXMFVMCQSGKHG-LEWJYISDSA-N 440.544 2.170 10 20 IECD O=C([C@@H]1Cc2ccccc2N1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442801 XYIJPUJGJDVJCH-FQEVSTJZSA-N 443.507 2.020 10 20 IECD O=C(c1[nH]nc2ncccc12)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501249 RLSWAAJDQUALOG-UHFFFAOYSA-N 427.848 2.153 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 726240291 VDONNLAIKXGOOO-PCCBWWKXSA-N 431.625 2.483 10 20 IECD CC1CCC(NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)CC1 728397765 WMZRUAHDKQIIJH-UHFFFAOYSA-N 433.572 2.414 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc1 734214229 USTBEYBSFKQUPN-PMACEKPBSA-N 445.608 2.154 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](CN4CCCC4)C3)cc2F)C[C@@H](C)O1 739926972 PYSPCSRZIMUGBD-ZVDOUQERSA-N 432.584 2.473 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 742071092 FTAVJPDIQHZLAF-KRWDZBQOSA-N 447.605 2.256 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742499212 XVBGWMMFFHSSAR-CZAYHTPWSA-N 425.529 2.188 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3c(F)cc(F)cc3F)cc2)C1 743895275 KOFFNPTXNLGILK-ZDUSSCGKSA-N 434.418 2.061 10 20 IECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 752911223 ZWZGONSJNLOMLA-RTWAWAEBSA-N 445.608 2.248 10 20 IECD C[C@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1cc2c(cc1O)CCCC2 756442313 OHMZARLNVWXEAQ-SFHVURJKSA-N 444.601 2.469 10 20 IECD O=C([C@@H](Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCC1 764979532 FZLAPVVNRCMXEX-JOCHJYFZSA-N 427.520 2.222 10 20 IECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc21 765924933 BKFHJJBJVHGWJJ-UHFFFAOYSA-N 432.274 2.319 10 20 IECD COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 768073211 DGNAIVPCUSJVEN-UHFFFAOYSA-N 447.557 2.126 10 20 IECD CC(C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2ccncc2)no1 769749675 SAUNCLRTTFGAFU-INIZCTEOSA-N 431.474 2.336 10 20 IECD CCOc1ccc(NC(=O)c2ccc(C)c(O)c2O)cc1S(=O)(=O)N1CCOCC1 770465761 IHFIAOIIJKVGTP-UHFFFAOYSA-N 436.486 2.078 10 20 IECD CCCOc1ncccc1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778243787 AAEJVZBKEPPWQX-KHPPLWFESA-N 438.528 2.400 10 20 IECD CCN1CC[C@H](N(C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 778287453 MQCDTHDQOOKCJS-PSVQYUNKSA-N 428.577 2.231 10 20 IECD Cc1cc(C(=O)N2CCOC[C@H]2c2noc(-c3cnn(C)c3)n2)c(C)n1-c1ccccn1 779841200 CHZIBZBTFYDZLI-SFHVURJKSA-N 433.472 2.486 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)c2)CC1 781046991 LTJRAJJFAOOTEF-UHFFFAOYSA-N 442.541 2.048 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 781446624 CMGQZSPFPDCXFM-UHFFFAOYSA-N 441.484 2.168 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 786497235 NGBRRGXOHYGHTN-KBPBESRZSA-N 434.537 2.179 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)N1CCN(C)CC1 786624238 CJUIEOGZXRVAIQ-JOCHJYFZSA-N 444.620 2.442 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)cc1F 787485211 KDUUNFXYVWCAGR-UHFFFAOYSA-N 430.528 2.390 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)cc1 788010971 SVZNHIRNFSPXIY-UHFFFAOYSA-N 437.588 2.087 10 20 IECD CN(C)Cc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 788461481 SYZWDMRQZDDPMR-NRFANRHFSA-N 425.529 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ncccc3Br)CC2)cc1 796099459 OQRRFWQAMRAGOF-UHFFFAOYSA-N 434.290 2.358 10 20 IECD CCn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C(F)(F)F)n1 797834523 KBUFSMZBZAGXIW-UHFFFAOYSA-N 430.452 2.087 10 20 IECD CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 805006725 COVIBLBEYGLLTJ-NHCUHLMSSA-N 448.583 2.246 10 20 IECD O=C(CN1CC[C@H](C(=O)N2CCCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805811307 OZJYYDHBYKOZGA-INIZCTEOSA-N 431.492 2.345 10 20 IECD CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)[C@H]2C1 808357399 GDYNVOAOVDNMJX-PMVMPFDFSA-N 428.577 2.342 10 20 IECD CCOC(=O)[C@H]1CCCc2sc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)nc21 817497101 RMQVSNGLERGXFJ-NSHDSACASA-N 439.515 2.456 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(C)(C)O 818584776 XWOFROQWYYEXKY-QGZVFWFLSA-N 437.474 2.381 10 20 IECD CN(C)C(=O)COc1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 916688489 VLMXZAIVXSYJHR-UHFFFAOYSA-N 430.480 2.451 10 20 IECD C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 994378698 RJHSTZHDLJZSBL-VSPBXKBYSA-N 425.489 2.097 10 20 IECD COc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccn1 1323973297 GHLQFHZYJZARCT-GJZGRUSLSA-N 431.464 2.316 10 20 IECD COC(=O)CCNC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1324759906 VLYSBQXLVXBQGS-UHFFFAOYSA-N 428.508 2.483 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798600612 BBARNVGTVVFECK-MHEUCROKSA-N 437.924 2.308 10 20 IECD COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1C 1804340150 JLYQSETYGZZXIA-QDMKHBRRSA-N 447.582 2.116 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998808 GCMTUCCAJVWNDO-DXDKRLHISA-N 438.509 2.083 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1cc(O)nc(O)c1 1817846220 LAMNACSYBABSGT-AWEZNQCLSA-N 426.408 2.370 10 20 IECD Nc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)s1 1827426266 QQRUFPVAUMKVDP-CQSZACIVSA-N 431.518 2.079 10 20 IECD Cc1cncc(CCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843441410 UCTQZKQOWLIOPP-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCCC[C@@H]3C3OCCO3)CC2)cc1 732443667 KACCSCHWLXVMNY-OAQYLSRUSA-N 432.565 2.144 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN([C@@H]4CCCN(C)C4)CC3)cc2F)C[C@@H](C)O1 734660021 JMNKMWKDWQEFHR-SFHLNBCPSA-N 447.599 2.361 10 20 IECD O=C(NCc1cscn1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 747886338 CYUAARSXPQOUQV-UHFFFAOYSA-N 434.455 2.488 10 20 IECD CS(=O)(=O)Nc1ccc(F)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749406208 MUAOIQUDSFJQPI-UHFFFAOYSA-N 439.484 2.227 10 20 IECD COc1ccc(N2CCN(C(=O)C[C@@](O)(c3nccn3C)C(F)(F)F)CC2)cc1F 753739894 WIFQKFNAWRAWSD-GOSISDBHSA-N 430.402 2.057 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)Oc4ccc(OC)cc43)CC2)cc1 754047138 BGPZINQMCZGIMI-QUCCMNQESA-N 427.545 2.474 10 20 IECD CCC1CCC(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)(C(=O)OC)CC1 754064414 PTMNGELZWCPUQR-MMPATGFWSA-N 433.593 2.280 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1cnn(C)c1 764348764 BUAAZZQDOPKUME-LBPRGKRZSA-N 445.457 2.326 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(Cl)c3)ccc21 767454057 LVAIJTBUJJORMN-UHFFFAOYSA-N 445.906 2.440 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@]1(CCO)CCOC1 773057253 COKKLYGBTGTIAH-RMHQSFGDSA-N 426.585 2.387 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@]4(CCS(=O)(=O)C4)C3)cc2)CC1 776041068 JCRONBHWQJNYKA-DENIHFKCSA-N 435.590 2.458 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1F 776434943 RYPZTINZVIKHJW-UHFFFAOYSA-N 432.451 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(CN(C)C(C)C)CC3)CC2)cc1 778244465 DZCQUQMLJYPCFS-KTKRTIGZSA-N 442.604 2.479 10 20 IECD Cc1cc(C(=O)CN(C)C[C@@H]2CCCC[C@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778247028 UVUSHSJTZPSBHA-LAUBAEHRSA-N 433.574 2.407 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CC(C)C)C3CCN(C)CC3)CC2)cc1 778275007 DZQIWUAZQIGJKP-KTKRTIGZSA-N 442.604 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(c4cccs4)CC3)CC2)cc1 778325132 JRTDENPOOYZLGY-HJWRWDBZSA-N 440.569 2.310 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CCO)c2ccccc2Br)c1 782061448 JXZIVIVGUUPZOQ-OAHLLOKOSA-N 443.319 2.380 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCC[C@H]3C[C@H]4CC[C@H]3C4)CC2)cc1 785529771 XSYBGFWXKVBYCI-ACRUOGEOSA-N 442.604 2.266 10 20 IECD C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 787368206 WAHMJUZZQGGABQ-QGZVFWFLSA-N 439.512 2.006 10 20 IECD COCCOc1ncccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 787983369 ODXSUTKNFSHJNE-UHFFFAOYSA-N 440.544 2.372 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cc([C@H]4CCCO4)nn3C)CC2)cc1 788720842 RVIMZXVUFVPTGI-HXUWFJFHSA-N 428.537 2.224 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCN(CC(F)(F)F)C3)CC2)cc(OC)c1OC 791703634 HUMALEXBAXKWFD-AWEZNQCLSA-N 431.455 2.245 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(-n4cncn4)cc3)C3CC3)nc12 801972602 VQSQZSYGWACBHC-UHFFFAOYSA-N 433.472 2.357 10 20 IECD COc1ccccc1N1CCC(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803423754 DLZISWOELYYSDS-UHFFFAOYSA-N 436.556 2.479 10 20 IECD COCCN1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676179 AHZVPWGDRMUUAH-QFIPXVFZSA-N 430.593 2.299 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(CS(C)(=O)=O)ccc1OC 807007026 YQSTZWGBLORXLS-UHFFFAOYSA-N 434.514 2.323 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676618 HSWKIMKFOTWORI-FRQCXROJSA-N 448.564 2.070 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)CCCOCc3ccccc3)cc2)C1 809810607 FVQALIGSWFNZRV-NRFANRHFSA-N 445.585 2.415 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(CO)(c4ccccc4)CC3)CC2)cc1 814646133 BIGJKFQKJJRJAI-DEOSSOPVSA-N 439.600 2.204 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC4(CC3)OCCCO4)cc2F)C[C@@H](C)O1 815156451 IBEIKOQIPBMPFJ-QZTJIDSGSA-N 435.540 2.285 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1 914455031 HIKSFJNJFWNYNI-UHFFFAOYSA-N 440.525 2.372 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917387241 YCYITOXNUNBVCH-INIZCTEOSA-N 449.598 2.232 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(OCc2ccccc2)cn1 1339043530 JFZUJHIOKDVLKO-KRWDZBQOSA-N 437.452 2.371 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994031 DQYLORLSDKXZSX-IERDGZPVSA-N 434.452 2.227 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccc4ccnn34)CC2)C1 1810554303 KWRKIKLPDKQLFZ-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813698040 IBNOKKTYIDNQIA-MGSHXDRLSA-N 446.598 2.160 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146060 RGPQWXNFLFFQQP-GOSISDBHSA-N 448.483 2.174 10 20 IECD O=C(c1ccc(Br)c(O)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250534 JLISEMRXCFWZRH-UHFFFAOYSA-N 448.273 2.092 10 20 IECD C[C@@H]1CCc2c(C(=O)N3CCCC34CN(C(=O)C3=NN(c5ccccc5)C(=O)C3)C4)n[nH]c21 1843727486 CCGYIYRPUSSUMJ-OAHLLOKOSA-N 446.511 2.069 10 20 IECD CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 572635235 MXEUAHCGJNFTEY-UHFFFAOYSA-N 447.498 2.313 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(c3ncnc4sccc34)CC2)n(C)c2ccccc12 575777333 VNSHBTHAQLLRBK-UHFFFAOYSA-N 448.552 2.456 10 20 IECD C[C@H](NC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 732243076 MBZFJHOGUSSHTI-KRWDZBQOSA-N 446.573 2.479 10 20 IECD C[C@H](CS(C)(=O)=O)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732673641 BJNNAIZAFNMYIB-CYBMUJFWSA-N 437.484 2.117 10 20 IECD Cc1cc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)nn1C 749290930 GCIMHLFFJMYUEN-UHFFFAOYSA-N 431.430 2.395 10 20 IECD COc1ccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(C)c1 759409587 LZBHUNRIFXFAHY-UHFFFAOYSA-N 443.500 2.317 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](N2CCCC2=O)C1 761115539 SZFFNAKRGMXKNL-NVXWUHKLSA-N 431.492 2.486 10 20 IECD COc1cc(Cl)cc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 761207865 VIMNDKODFFMUPT-QGZVFWFLSA-N 433.940 2.439 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(Br)cn1 772928972 MVNIXHDYNADFBK-UHFFFAOYSA-N 437.269 2.075 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3(C(=O)OC)CC3)cc2)cc1 776277473 PWEVTRNTPALFTA-UHFFFAOYSA-N 438.527 2.454 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccnc3-n3ccnc3C)CC2)cc1 778241648 CVRJNJRPDDEFFR-KTKRTIGZSA-N 446.511 2.428 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CCCO)Cc3ccccc3)CC2)cc1 778389816 RCTVBWUVMLOSLI-SEYXRHQNSA-N 437.540 2.311 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](Cc3ccccc3)C(=O)O)cc2F)CC1 780568018 CEEITBRISKGOJO-FQEVSTJZSA-N 428.508 2.463 10 20 IECD COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 781539855 QNTYSTMTDXHYPQ-UHFFFAOYSA-N 426.347 2.201 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1F 787277696 KWFQNARVXBUVDI-UHFFFAOYSA-N 428.386 2.160 10 20 IECD CCOCCCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H](C)C1 788911478 OAQVZUZEMLYCMM-SIKLNZKXSA-N 430.593 2.156 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)cc1 788976349 XGGMRNYOXLDSQB-VQTJNVASSA-N 429.517 2.093 10 20 IECD CC(C)(C)CCN1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789859369 CGGISCURRGFRQR-UHFFFAOYSA-N 432.634 2.436 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC1CCN(c2nccs2)CC1 789868145 MDUCNXSYWVEMNX-UHFFFAOYSA-N 445.614 2.098 10 20 IECD O=C(COC(=O)[C@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41)NCc1ccc(N2CCOCC2)c(F)c1 796317109 HLAGKXRGCBUFDY-PDJSORNXSA-N 440.515 2.216 10 20 IECD Cc1cc(C(=O)CN2C[C@H](N3CCCC3)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796427508 DHXWITJVZLLPIN-OXQOHEQNSA-N 444.601 2.483 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 803132638 LCEBTPYIRUYRPR-SFHVURJKSA-N 432.565 2.474 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 807103948 YKFWJRTUTGEWOC-SJLPKXTDSA-N 432.565 2.439 10 20 IECD CCNC(=O)C(C)(C)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 808792798 PNHHZHJKVMKVPZ-UHFFFAOYSA-N 428.533 2.153 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCCC1 813669291 DXKBEVMLTFTUSE-UHFFFAOYSA-N 438.590 2.438 10 20 IECD CN(Cc1ccccc1O)C(=O)CCc1nc2cc(S(=O)(=O)N(C)C)ccc2n1C 917310037 HCBZKWSZTNFAQS-UHFFFAOYSA-N 430.530 2.120 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCN1Cc1ccccc1 919973436 UJVUQQCETMDZKK-QFIPXVFZSA-N 427.570 2.202 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1Cc1cccnc1 1116669574 VAGAHXAXAAEFDM-OALUTQOASA-N 427.501 2.138 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@@H]31)C2)c1cc(O)nc(O)c1 1796137785 PMKWQALWNXLYTE-RZDUQXNZSA-N 443.544 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1796312525 MVZOKJLPLVALTJ-NUZGMZIFSA-N 445.523 2.445 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccoc1)C2)c1cc(O)c(O)c(Cl)c1 1799767273 IYEJBIQBFSSURR-SGLKITHBSA-N 432.860 2.261 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(C3CC3)on2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992167 LKDINFSSUWQLDJ-VFNWGFHPSA-N 449.467 2.387 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)ccn1 1807996092 XSYMCLPHFWNVNO-UWJYYQICSA-N 433.468 2.225 10 20 IECD CC[C@H](C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839432620 SDTKYZBEXWRCRS-QKKBWIMNSA-N 440.924 2.257 10 20 IECD CN(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(Cl)cc1 1845842546 CKLOSVGLRBMELR-LJQANCHMSA-N 444.919 2.266 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3(NC(=O)OC(C)(C)C)CCCC3)nc12 729745361 CYQHKBHHQMXITG-UHFFFAOYSA-N 448.476 2.492 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccnc3N3CCOCC3)cc2)CC1 731131879 TWHQACRNXNLVKC-UHFFFAOYSA-N 437.544 2.409 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)c1 748860798 ZYUIEHWNECCQCR-OAHLLOKOSA-N 431.514 2.046 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1F 753110394 XIGGXTUNXDOWPK-HXUWFJFHSA-N 430.455 2.184 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Nc4ccccn4)CC3)CC2)cc1 754081713 NZNRUJBQLUOOJF-QFIPXVFZSA-N 425.577 2.150 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N3CCc4ccc(C)cc43)CC2)cc(OC)c1OC 759410346 RJHUFHLMWRJTNK-UHFFFAOYSA-N 439.512 2.259 10 20 IECD CCN1CCN(c2ccc(NC(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)cc2)CC1 759589392 RYSTVUNCNVUISE-WMZJFQQLSA-N 425.485 2.435 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CSCCN2Cc2ccccc2)c1 760557111 UVTRAMVCEPBCKF-KRWDZBQOSA-N 435.571 2.111 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1cccc(Br)c1O 765730462 VRJYJTLAMHJHBI-UHFFFAOYSA-N 430.262 2.275 10 20 IECD CCCCCCn1cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c(O)nc1=O 769651645 HUVFVHBMFXPILR-ZDUSSCGKSA-N 425.507 2.283 10 20 IECD O=C(N[C@H]1CC[C@H](O)CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770097163 MZAMMQKYYIRXII-NNUKFRKNSA-N 435.458 2.135 10 20 IECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 771597271 NKEJISDGPUAPPN-XMMPIXPASA-N 437.496 2.363 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1 775286570 XTEMYYCOTQATGJ-UHFFFAOYSA-N 429.476 2.132 10 20 IECD CC(=O)N1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C(C)(C)C1 775583194 BKSORBZCQLXYIU-UHFFFAOYSA-N 437.543 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)=O)c(C)nc3C)CC2)cc1 777109561 RQYYDIYZXUQXCM-UHFFFAOYSA-N 425.485 2.415 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN3Cc4ccccc4C3)CC2)cc1 778246895 RIBDGARENRUWJM-ZHACJKMWSA-N 434.540 2.032 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 778287925 BQPKRYLDOSAAJP-MAISERNUSA-N 427.545 2.220 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc(C(N)=O)c3OC)CC2)cc1 782707000 QUQUTCBGIDQLNH-UHFFFAOYSA-N 441.532 2.137 10 20 IECD Cc1ccc(CNC(=O)C2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785421206 CFMDYYHUICELJH-UHFFFAOYSA-N 436.556 2.232 10 20 IECD CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788070160 IYNAZEWGENXWFX-OXJNMPFZSA-N 440.544 2.322 10 20 IECD Cc1cnc([C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)s1 789798921 FYBXUXVPYGRDRR-GOSISDBHSA-N 432.521 2.311 10 20 IECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1 789819430 MSFCEWXZHCOPRA-CALCHBBNSA-N 428.508 2.418 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@@H](c4cccs4)C3)CC2)cc1 804316791 JOROMVVZXBLSCS-LJQANCHMSA-N 429.542 2.442 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(C)ccn3)CC2)cc1F 804852457 AWTSLGHWOAACJV-UHFFFAOYSA-N 427.524 2.340 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cccnc3)cc2F)CC1 805007915 UPSWJBXNISDBBM-NRFANRHFSA-N 439.535 2.343 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCO1 807768794 BPQDAOMUPPKSGL-JCGIZDLHSA-N 425.476 2.447 10 20 IECD Cc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nnn1-c1ccn(C)n1 814412264 BEMKKWGHEGEFLI-AWEZNQCLSA-N 431.447 2.309 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)COc3ccc4ccc(=O)oc4c3)cc2)C1 917831900 DOYOARZIFNWHRT-SFHVURJKSA-N 435.480 2.190 10 20 IECD CCOC(=O)CC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918118311 YICPFJMRFXCOBR-IBGZPJMESA-N 430.549 2.263 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 1116669789 ZFVAAZHQOMTEHD-AWEZNQCLSA-N 449.529 2.372 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-n4cccn4)c(F)c3)nc12 1318353261 MGZQBNNFOGYVHS-UHFFFAOYSA-N 425.376 2.293 10 20 IECD Cc1cc(C(=O)CN2CCN(C(C)(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1319513692 ZNWLFVNTMRPRCA-UHFFFAOYSA-N 432.590 2.340 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1ccccc1)N1CCCCC1=O 1323860038 OFLUGAHGESYTLJ-PGRDOPGGSA-N 440.496 2.442 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3[nH]cc4c3CCC4)C2)C1 1780002352 OXJXHLXZVABDEJ-QFIPXVFZSA-N 445.903 2.325 10 20 IECD CC(C)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1783426201 HIZZOTFDSXOOER-DEOSSOPVSA-N 439.512 2.302 10 20 IECD C[C@H](NC=O)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788674219 WQBNQZAREPAQOX-INIZCTEOSA-N 447.495 2.048 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cc[nH]n3)C2)CC1 1806230274 NHFZOMZLESUKQC-UHFFFAOYSA-N 434.500 2.047 10 20 IECD COC1(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CCC1 1817848685 XEFHZSVKXMPDFU-OAHLLOKOSA-N 429.477 2.481 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(S(N)(=O)=O)cc2)cc1 111208497 AVSGZLSIOLUZQY-FQEVSTJZSA-N 431.558 2.150 10 20 IECD COc1cccc(CNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)c1O 727763030 ZRJMXTKPIVGEBM-UHFFFAOYSA-N 443.319 2.100 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2I)c1 734073017 ZVCLBYOIILJSPA-UHFFFAOYSA-N 426.210 2.260 10 20 IECD C[S@](=O)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 735045524 HSWNWQSDVFNBID-JIWMQAFSSA-N 447.401 2.145 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2)n[nH]1 737157615 KUKDRMWULYMKDC-OAHLLOKOSA-N 434.500 2.433 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1C 737181653 BILTXPUIFWQWBG-CYBMUJFWSA-N 435.502 2.287 10 20 IECD CN1CCCc2cc(CNC(=O)NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc21 746983006 LGZGRZKICWFTFN-IBGZPJMESA-N 438.528 2.193 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 748527471 IBBDGRKXERBBQQ-FQEVSTJZSA-N 431.558 2.482 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](O)CC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 751756121 NMBPWPFYRFOGAS-GOSISDBHSA-N 436.530 2.265 10 20 IECD CCCc1cnc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 756154813 XYKSLQIPTNAMFQ-UHFFFAOYSA-N 448.545 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CN(C)C(=O)OCc3ccccc3)cc2)CC1 756763100 QSLFWDNGKLYBPZ-UHFFFAOYSA-N 438.528 2.240 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1S(C)(=O)=O 758983903 ULEIFSVLDNPWBC-INIZCTEOSA-N 445.541 2.051 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@@H](C)CC3(C)OCCO3)CC2)cc(OC)c1OC 760127996 GVIYSXNVDSYFSM-INIZCTEOSA-N 437.537 2.333 10 20 IECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761982913 NYCIUMUTMYRTEI-OAHLLOKOSA-N 441.937 2.297 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 764247286 KBAMGJQWJVGHJU-OAHLLOKOSA-N 432.546 2.084 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 764252005 DUTQULMPCGXDSS-MRXNPFEDSA-N 446.573 2.427 10 20 IECD O=C1COc2ncc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc2N1 770664884 NIXMEDFGHUWATP-UHFFFAOYSA-N 436.390 2.198 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CNC(=O)CC(C)(C)C)n3)CC2)cc1 771083896 UIYVTSWIGAYKFR-UHFFFAOYSA-N 429.521 2.022 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)N1CCSCC1 773739392 GTRZNQYABNOPOC-LBPRGKRZSA-N 442.584 2.258 10 20 IECD C[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 773829073 ZBJIAVPLCVVZJK-CHWSQXEVSA-N 427.523 2.282 10 20 IECD COc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N(C)C)cc1OC 774856605 DSYATRJHWOIELH-FQEVSTJZSA-N 442.560 2.114 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCCc4nc(O)ccc43)CC2)cc1 778224144 RJJQIEQCESJXOB-GMGKOPGTSA-N 436.512 2.194 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1NC(C)=O 780407205 IWBZMZJWVIDBQI-UHFFFAOYSA-N 446.529 2.123 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)cc2)CC1 787320166 SJPZHSFCVSQQJU-YYDVJCTNSA-N 430.593 2.105 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCCO)CC3)cc2F)C[C@@H](C)O1 789821483 TURYRONAOXXHKY-CALCHBBNSA-N 435.540 2.067 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CC[C@@H]3CCCCN3C)cc2F)C[C@@H](C)O1 789824311 IACKAEPPIAWFTH-NSHGMRRFSA-N 448.583 2.388 10 20 IECD C[C@@](O)(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 789856229 QXPDKTXPGOSPFY-HSZRJFAPSA-N 427.570 2.270 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn(C(C)(C)C)nn3)cc2F)C[C@@H](C)O1 791636716 GJXGSPPDHKWKLS-HUUCEWRRSA-N 447.511 2.259 10 20 IECD Cc1cc(=O)c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1-c1ccccc1 792572412 JIKAXNQKRNPRIE-UHFFFAOYSA-N 434.496 2.422 10 20 IECD C[C@H]1CN(C(=O)C(C)(C)C)C[C@@H](C)N1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795123161 PVJMDGBKXVVXAF-HDICACEKSA-N 448.583 2.246 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H]1Oc1ccccc1 803687341 CAOAEJYNLXTWKK-WWNPGLIZSA-N 437.540 2.426 10 20 IECD CCn1cc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 804975822 BDKRHUUNRMNKJY-UHFFFAOYSA-N 438.511 2.158 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)C2CC2)cc1 806088248 PMOVQASILKVUHN-YADHBBJMSA-N 428.577 2.003 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCOC2=O)c1 807387078 YAGATIWELBQJIK-UHFFFAOYSA-N 434.246 2.366 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)CC1(C)OCCO1 807425080 KUJVYCMYIXCABH-ZDUSSCGKSA-N 443.338 2.409 10 20 IECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1ccc(N2CCN(C)CC2)cc1 809719773 OJNLIIQFDFAUCR-OAQYLSRUSA-N 446.592 2.423 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 813590290 KBWLNSKEBCKFQS-BFYDXBDKSA-N 427.542 2.015 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(c4ccccc4)C3=O)cc2)C1 814587904 DCWLZNYLQZOJAC-SIKLNZKXSA-N 434.540 2.448 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(F)cc(F)c1F 815397426 VIRJTVWMZDAVAL-UHFFFAOYSA-N 425.382 2.459 10 20 IECD Cc1nc(-c2ccccc2NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 918309634 CUDCQMXFWATCRK-UHFFFAOYSA-N 435.484 2.479 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2NC1=O 920927648 ZWYTVQRKKLTGEL-CABCVRRESA-N 438.484 2.059 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSCCN3CCOCC3)cc2F)C[C@@H](C)O1 1319579571 UMMAKLRKTKDIHD-CALCHBBNSA-N 425.570 2.121 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3cccnc3)cc2)C1 1338887568 MPCJYFRTDTXQQK-GMAHTHKFSA-N 435.572 2.454 10 20 IECD C[C@@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782599215 XQRJMVUIISLDGL-TUVUNVSASA-N 443.500 2.092 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1occc1Br)c1cc(O)nc(O)c1 1797008268 CTRCKTHVLUKACE-ZSBIGDGJSA-N 436.262 2.414 10 20 IECD COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1804283601 HHVWRGMYMIQLMZ-XFLCEESOSA-N 439.468 2.172 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291160 DZOLVCLQWNAQJA-HIXUMGDSSA-N 443.544 2.328 10 20 IECD O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992405 YAFRCSZGBCOWKS-WZONZLPQSA-N 432.480 2.450 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cccc(F)n1 1810754413 QWGQZRGFWTXDRF-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnoc2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146503 MMAFWYGHGMBXIF-GOSISDBHSA-N 447.455 2.497 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCCc2cccnc2)C1 1846672507 YLFBBSOFGUDIOG-UHFFFAOYSA-N 445.523 2.401 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCC(F)(F)C2)=NN1c1ccccc1 1847220817 RDLYCIKUFGRBCC-JLSDUUJJSA-N 430.455 2.417 10 20 IECD Cc1cc(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1-c1cccc(Cl)c1 97554726 CWYQCSDYYGOALA-CQSZACIVSA-N 437.949 2.123 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)n(C)c2ccccc12 472806852 OZANBMXRPGJMGW-UHFFFAOYSA-N 434.496 2.214 10 20 IECD Cc1nc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)cn1C 727113216 PZEBMPHMOCKOBD-CYBMUJFWSA-N 438.575 2.378 10 20 IECD C[C@@H](NC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOCC1)c1ccccc1 733370115 VFRIPWNCEJYBRY-MRXNPFEDSA-N 447.557 2.394 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3cc(OC)ccc3O)c(C)c2)CC1 734072560 GVXOPUAEYMXRFY-UHFFFAOYSA-N 426.517 2.106 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3c(F)cccc3F)cc2)C1 734659900 IQQVLLFEYYUWFI-BEFAXECRSA-N 432.471 2.199 10 20 IECD CCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 735828557 YXDILDUKLPHLBB-UHFFFAOYSA-N 431.558 2.124 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)CCOc2ccccc2)cc1)C1=S=CC=C1 744300536 QLUICSUFKXNXJV-UHFFFAOYSA-N 430.507 2.041 10 20 IECD O=C(NCCN1CCSCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068854 XUFHJRPJIZLLHJ-UHFFFAOYSA-N 427.573 2.033 10 20 IECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)CCNS(=O)(=O)c2ccccc2)cc1 763323344 HQARQMICFPOXQO-UHFFFAOYSA-N 437.587 2.025 10 20 IECD CCc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1S(C)(=O)=O 765646967 APLZRJROSCWFRJ-IBGZPJMESA-N 443.569 2.284 10 20 IECD CNC(=O)Cn1nc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1C 767971744 SCRWZBHPEHGANJ-CQSZACIVSA-N 436.463 2.329 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCc4cc(O)ccc4C3)CC2)cc1 768837822 VLJNFDRZURCGFK-CTDFXDFQSA-N 435.524 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCc4cc(O)ccc4C3)CC2)cc1 768837824 VLJNFDRZURCGFK-JPMGXVIASA-N 435.524 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4nnc(C(C)C)o4)n3)CC2)cc1 771058113 SQOISOOSOZKFJK-UHFFFAOYSA-N 440.504 2.261 10 20 IECD CCOC(=O)[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 774022728 HRAMKDWSSKZGFW-LVMGUKCRSA-N 442.584 2.160 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 779480730 HZRJDKZDDOMELM-PMACEKPBSA-N 427.526 2.484 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn(C)c1=O 781969939 MQRRYLAJOFVYPX-AWEZNQCLSA-N 434.443 2.019 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CSc3nnc4ccccn34)cc2F)CC1 782660088 ZFUFXESJMQGMEW-UHFFFAOYSA-N 428.537 2.419 10 20 IECD CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793716315 BZDQWBSMHQBINS-QWFCFKBJSA-N 446.617 2.185 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 795112162 FVDFIVMMAOCPSB-UHFFFAOYSA-N 440.468 2.191 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)cc1 804739415 FULMCVINCFZCMI-UHFFFAOYSA-N 430.593 2.252 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1F 804851983 VUFIHOGEBMVZLQ-YADHBBJMSA-N 448.583 2.172 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3nc(C4CC4)cs3)CC2)cc1 806833640 YNGNGAODMZIGNI-UHFFFAOYSA-N 443.573 2.296 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 806844643 PZMIPFKWYBVJNE-IBGZPJMESA-N 426.565 2.008 10 20 IECD Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1=O 806958017 DTDYPLXFIKCENL-UHFFFAOYSA-N 439.443 2.053 10 20 IECD CCCN(CC(C)(C)O)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771566 VWPYAOFTPAVJOU-HNNXBMFYSA-N 427.492 2.383 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2cnccn2)CC1 862377832 VCDUNBSUDFWUGX-MRXNPFEDSA-N 441.491 2.401 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(N2CCOCC2)c1 918439942 YYTMGUNCLPJDMU-UHFFFAOYSA-N 440.569 2.331 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccnc2N2CCOCC2)cc1 919793955 AJJQQNKMLSQTNQ-UHFFFAOYSA-N 425.533 2.362 10 20 IECD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCCC2)cc1 920344310 JTVQWCUJHJLBCO-UHFFFAOYSA-N 432.502 2.180 10 20 IECD CC(C)O[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779171248 MPGWFCZSWJVICL-RNODOKPDSA-N 426.897 2.008 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806019 HAZULPNLNMMHBQ-JNNRSPCRSA-N 445.903 2.237 10 20 IECD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc(O)c(O)c3O)n[nH]2)COC1 1823477461 UFYIHBFLFDCVGS-PMGBHYCQSA-N 442.472 2.269 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499665 SLPDQEZJFDCZHC-MJCKAROISA-N 435.575 2.308 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCNC(=O)CC3CCCCC3)cc2)C1 726103848 VNPWSNKRQHGSTM-FQEVSTJZSA-N 443.592 2.274 10 20 IECD COc1cccc(CNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1O 729548892 RZYYPFWLFMJDNX-UHFFFAOYSA-N 442.516 2.396 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@@H]3Oc4ccccc4NC3=O)cc2F)CC1 730193087 DJSSSDPIFQUANF-NRFANRHFSA-N 426.492 2.374 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)c1 734072726 PNEAVZKGTNXVNL-UHFFFAOYSA-N 443.525 2.153 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccnc(C(=O)N(C)C)c3)CC2)cc1 741072313 SYCUOHAUFLLWIN-UHFFFAOYSA-N 440.548 2.126 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1 747572468 WOBHHDIXWIOIDD-UHFFFAOYSA-N 440.548 2.396 10 20 IECD CCOC(Cn1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1)OCC 748551116 MKROXRDJRIUBHO-HZPDHXFCSA-N 449.527 2.360 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(F)c3C)CC2)cc(OC)c1OC 759413447 PYSQZIHZPNEINA-UHFFFAOYSA-N 431.464 2.447 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC(C)(C)CCN3CCN(C)CC3)cc2F)CC1 771320265 PWQXHNHLJJDUTM-UHFFFAOYSA-N 448.631 2.183 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)CC2)cc(OC)c1OC 774754377 JBFRGHRFUDHGQS-XYJFISCASA-N 433.549 2.302 10 20 IECD CS(=O)(=O)N1CCCN(Cc2cc(Br)cc(Br)c2O)CC1 775647806 AOYQHWJCBCXJBW-UHFFFAOYSA-N 442.173 2.385 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](c4n[nH]c(C)n4)C3)CC2)cc1 776100867 CQEFUJVZIWJIGP-LJQANCHMSA-N 441.580 2.223 10 20 IECD Cc1cc(C(=O)CN(C)CC2(N(C)C)CCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782644430 PPXSODFEMROUPI-UHFFFAOYSA-N 432.590 2.340 10 20 IECD COC(=O)COc1ccc(N(C)Cc2nc(=O)c3c(C)c(C(=O)OC)sc3[nH]2)cc1 784557537 JUKSBEVMHOXKFH-UHFFFAOYSA-N 431.470 2.268 10 20 IECD COc1cc(C)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 788312084 CHYCXEGSGFZEGI-UHFFFAOYSA-N 441.528 2.124 10 20 IECD Cc1ccn(C[C@](C)(O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)c1 790801730 RRFNDMJQEGYHPR-AOMKIAJQSA-N 435.471 2.294 10 20 IECD Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793754094 ANMGLECVCGREBZ-ZDUSSCGKSA-N 435.475 2.292 10 20 IECD O=S(=O)(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccsc1 795804148 QIGULQYEBRIMQH-UHFFFAOYSA-N 433.534 2.482 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC(F)F)c(F)c2)cc1 797432652 MPAXSDACKWCBGL-UHFFFAOYSA-N 425.410 2.104 10 20 IECD CN(C)S(=O)(=O)c1ccc(Cl)c(NS(=O)(=O)c2cccc3nsnc23)c1 799185044 ZJJDQHGJFXLIJU-UHFFFAOYSA-N 432.936 2.396 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCS(=O)(=O)Cc1ccccc1 803139060 SDOLVMDPNHDWMT-UHFFFAOYSA-N 445.585 2.221 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(Cn2cncn2)cc1 918438438 OWNXERGVOYRFLE-UHFFFAOYSA-N 436.541 2.135 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)CC2)cc1 1335132836 IERYUJJHJCGRDO-UHFFFAOYSA-N 429.542 2.370 10 20 IECD O=C(CCc1cccnc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002018 PVCUNXJDIZCBJC-QFIPXVFZSA-N 445.903 2.223 10 20 IECD COC1(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)CCC1 1784869668 HPMRHBGCZBDOBT-OAQYLSRUSA-N 438.908 2.154 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cccc(Cl)c1 1789523288 MSANBWQAFAPNNZ-JQFCIGGWSA-N 431.876 2.053 10 20 IECD Cc1cccc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790149697 JRQGNVZNJKBITJ-SZMVWBNQSA-N 425.485 2.017 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc2ncnn2c1 1800718290 TUCRXDFHJKGGKX-QDMKHBRRSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc2ccnn2c1 1804289278 AOZZLELFZHXKJC-HIVYQHRXSA-N 448.479 2.416 10 20 IECD Cc1nc(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1810870041 QIBQFQVPJSBFKE-BEFAXECRSA-N 437.456 2.126 10 20 IECD CCC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1821910316 UKNYIKVRFTUFIF-RCQQVGEISA-N 428.445 2.211 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCO2)[nH]n1 1823475655 FYXKTBTUZHEMTP-FUZMGVLZSA-N 442.472 2.411 10 20 IECD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1824312913 NOLMDXVTGCHRAE-YJBOKZPZSA-N 427.505 2.184 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2C[C@@H](O)C2)CC1 1832875819 BKCVVIWKQTXYCG-XZBNEWPCSA-N 444.528 2.207 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cnc1C 1842153900 PDPQOBPIDAODDU-UHFFFAOYSA-N 431.496 2.308 10 20 IECD O=C(c1cc2ccccc2o1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847053999 BTHORKOTNMDVNE-UHFFFAOYSA-N 429.523 2.110 10 20 IECD COc1cccc(OCc2nnc(SCC(=O)NCc3ccc(N(C)C)cc3)n2N)c1 27858650 WOTDRMASXDOQJT-UHFFFAOYSA-N 442.545 2.054 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)NN1C(=O)N[C@@](C)(CCc2ccccc2)C1=O 28623658 MNWWQRQGQTVTKK-DEOSSOPVSA-N 436.512 2.422 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4cc(C)on4)CC3)cc2F)CC1 303325892 SGZSGGQCFZPRPH-UHFFFAOYSA-N 444.555 2.291 10 20 IECD O=c1n(Cc2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)nc2ccccn12 614796097 ZEFPAAFFHKPVIG-UHFFFAOYSA-N 438.494 2.350 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1 727090779 ZURDDEZYUAOBDU-UHFFFAOYSA-N 447.337 2.055 10 20 IECD Cn1c(S)nnc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 731438399 HYVBXJSQMJHDQY-FLIBITNWSA-N 439.613 2.463 10 20 IECD CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 746757573 OYWUVCLUDCBHJS-IFMALSPDSA-N 445.608 2.031 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CCCC4)cc3)cn2)C[C@@H](C)O1 747570217 HQQUOKDDCRMOTN-QZTJIDSGSA-N 440.548 2.441 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(F)c4ncccc34)c2)CC1 748673079 IYLNTLCKEMYOKG-UHFFFAOYSA-N 435.502 2.410 10 20 IECD C[C@H](OC(=O)c1ccc(C(N)=O)cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 748888879 FHRNGCGYUYUGOZ-LBPRGKRZSA-N 443.415 2.140 10 20 IECD CC(=O)NC1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751060629 MMUPADURAPKNQS-UHFFFAOYSA-N 437.543 2.432 10 20 IECD COC(=O)C[C@@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 752335317 DOGRBMHHEFXVRB-GDBMZVCRSA-N 436.464 2.053 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1cccc2nonc12 753918982 QCAKBBZXNWCEEH-UHFFFAOYSA-N 426.443 2.123 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(CCNC(C)=O)cc3)CC2)cc1F 754040801 YAOCSTZMQVWGMC-UHFFFAOYSA-N 435.521 2.024 10 20 IECD Fc1cc(CNC(=S)NC[C@H]2CCCCO2)ccc1N1CCN(c2ncccn2)CC1 758208613 HMBYDDCZZTWSTD-GOSISDBHSA-N 444.580 2.476 10 20 IECD CNC(=O)c1cccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 760094832 OEEKLHLYJWGXJG-UHFFFAOYSA-N 442.516 2.104 10 20 IECD COC(=O)c1nccc2c(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cccc12 766780896 AIPCWTSIGHCFHV-UHFFFAOYSA-N 441.509 2.337 10 20 IECD CCN1CCOC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 769080146 YURXGKKPTJLSSJ-IFXJQAMLSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](Cc3ccccc3)N(C)C)CC2)cc1 774917215 GFMBLHRQUYFRAX-QFIPXVFZSA-N 438.572 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CC(=O)OC(C)(C)C)C(C)C)CC2)cc1 778407893 QVIBZRHGGJTQSD-VAWYXSNFSA-N 445.560 2.479 10 20 IECD Cc1cc(C(=O)COC(=O)c2cccc(C(N)=O)n2)c(C)n1-c1ccc2c(c1)OCCO2 781727541 YCUQBCXGKVKDRM-UHFFFAOYSA-N 435.436 2.399 10 20 IECD C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)OCC(=O)c1ccc(O)c(O)c1 783085422 UZZJPTIOPYCNKT-MRVPVSSYSA-N 428.260 2.466 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 788333287 RHVWDSFBXOUNPI-JTHBVZDNSA-N 437.540 2.424 10 20 IECD Cc1cc(F)cc(-n2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)nn2)c1 788744216 ZOWGGOQYGUMYSM-QGZVFWFLSA-N 436.491 2.347 10 20 IECD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792238305 OSFRTBCEBMTUDA-XMSQKQJNSA-N 433.936 2.048 10 20 IECD CCCCN(CC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801596724 LWYJENQHHUDEIO-UXHICEINSA-N 438.590 2.189 10 20 IECD COc1cc(N2CCN(C(=O)[C@@]3(O)CCc4ccccc4C3)CC2)cc(OC)c1OC 803105442 NRVFQZJCQJIZLK-XMMPIXPASA-N 426.513 2.281 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)OCCCO2)c1ccc(N2CCOCC2)cc1 803307193 YDFNGBGYALJZDK-QGZVFWFLSA-N 439.512 2.178 10 20 IECD C[C@H](O)C[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 803311324 UFNLVYNBGFEUIV-NNMXDRDESA-N 439.556 2.371 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 804707910 INHLMUVTDQYLEK-SFHVURJKSA-N 432.565 2.474 10 20 IECD CCc1nsc(N2CCN(C(=O)C(=O)NCc3ccc(N(CC)CC)c(F)c3)CC2)n1 804852280 GABJXWUGKLCCDB-UHFFFAOYSA-N 448.568 2.051 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](CCNC(C)=O)C3)cc2F)CC1 806750544 UVJTZKZRAVCJHP-IBGZPJMESA-N 433.572 2.415 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccc(N(C)C)cc1 807676641 IBGHIMCYBQARKG-MRXNPFEDSA-N 425.489 2.187 10 20 IECD COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NCc1cccc(OC)c1O 810051276 YAYWVZNKRCWOMQ-UHFFFAOYSA-N 444.303 2.357 10 20 IECD Cn1nnc(Br)c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 810630500 KEWGAAAZYLBYAQ-LBPRGKRZSA-N 428.718 2.331 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCC4=O)cc2)C1 814379584 HXDXEAIDNXLIJB-SFHVURJKSA-N 441.553 2.386 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4nccs4)CC3)cc2F)C[C@@H](C)O1 917026895 RTGUGUYGEUXRNJ-CALCHBBNSA-N 447.580 2.334 10 20 IECD O=C(COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)c(F)c1 918861128 FWBFCQWFUMOHLV-YWEYNIOJSA-N 443.431 2.443 10 20 IECD COc1cccc([C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)c1 919805325 NAPKUKPYTAIFCM-LJQANCHMSA-N 433.530 2.339 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCCN2C(=O)NC(C)(C)C2=O)cc1 921193067 HGNLQOOGPOOCDR-IBGZPJMESA-N 430.549 2.371 10 20 IECD CC[C@@H](C)[C@@H](N)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314044 YKZWYFFVCVYKMG-FZKQIMNGSA-N 448.614 2.354 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCN(C)C)cc1 1795436005 BELBYAJTWMPFHE-RUMRUAAYSA-N 438.572 2.249 10 20 IECD CC(C)O[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934631 MWIOZXPHFHSCQD-ZAWLATJESA-N 426.517 2.231 10 20 IECD N[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cccnc1 1800715516 RGBNQXIMJPXSBL-KYHPRHEASA-N 444.919 2.488 10 20 IECD O=C(c1ccncc1O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428498 RKEUPHZGEONCHJ-QGZVFWFLSA-N 426.473 2.141 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)[C@H]4CCCN4C)CC3)ccc21 483930823 XFONYWSZDDLTDG-JOCHJYFZSA-N 426.561 2.283 10 20 IECD Cc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1C[C@H]1CCCO1 727176637 NIVGYDSYSXITCS-CCAPLTMGSA-N 443.616 2.034 10 20 IECD CCCN(CC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1)Cc1ccccc1O 727830729 KCQQEDVWTAHZIQ-UHFFFAOYSA-N 425.529 2.393 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cccc4c3O[C@@H](C)C(=O)N4)CC2)cc1 729303323 NAPXUBDEFKPUDS-KRWDZBQOSA-N 438.528 2.357 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 729324897 KTEHDTHDPLCTDC-TXEJJXNPSA-N 427.523 2.078 10 20 IECD COc1cccc(CNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c1O 729861293 KHOKYHBYRKZZBX-UHFFFAOYSA-N 427.486 2.190 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C(=O)OC)Oc3ccccc32)cc1F 731408644 ALLHVKDXZJNTAR-HXUWFJFHSA-N 443.475 2.255 10 20 IECD COC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738905258 LTTZRQRNVYKSJX-UHFFFAOYSA-N 432.502 2.421 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(F)c1 738928822 SKQYMAYJGIREPY-UHFFFAOYSA-N 435.477 2.169 10 20 IECD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NCc3ccccc3O)c2)CC1 748345693 IHOWCIJLECSHTH-UHFFFAOYSA-N 437.949 2.302 10 20 IECD Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 758457405 OSTXAYGDJBPPBS-QGZVFWFLSA-N 446.529 2.392 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(S(C)(=O)=O)cc(C)c3C)CC2)cc1 758800040 SPDKSGJSFBFCLJ-UHFFFAOYSA-N 445.585 2.268 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCNC(=O)C3CCC3)cc2F)C[C@@H](C)O1 759999515 ONPBIEIGOGMZTJ-HDICACEKSA-N 448.583 2.294 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4cc(F)ccc4F)C3=O)cc2)C1 761117630 GRYSFQZSQJWPDT-KUHUBIRLSA-N 428.439 2.460 10 20 IECD COC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCCC1 761956127 BQDDLYCTJWIHDZ-CALCHBBNSA-N 435.540 2.473 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(OCC(F)F)n1 765328596 WEVOMAWRKAVVDV-UHFFFAOYSA-N 440.472 2.282 10 20 IECD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916487 RHMBRIGCDHZMBV-RCCFBDPRSA-N 433.936 2.301 10 20 IECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc1Cl 769894440 ZDAUVSZLJANGFO-UHFFFAOYSA-N 438.859 2.407 10 20 IECD CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)O1 774773829 ZEHRGWSMCAUOPD-QZTJIDSGSA-N 440.491 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc(OC)c(F)c3)CC2)cc1 778258324 PXBZBFCHOAOASY-MDZDMXLPSA-N 441.503 2.407 10 20 IECD COC[C@@H](C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 778528694 GSQLGFLJXINGDX-OAGGEKHMSA-N 447.511 2.098 10 20 IECD O=C(Nc1ccnn1CC1CC1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765787 BYLFRCACFRMRKQ-QGZVFWFLSA-N 431.924 2.371 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCC[C@@H]3C[C@H]4CC[C@H]3C4)CC2)cc1 785529772 XSYBGFWXKVBYCI-PCCBWWKXSA-N 442.604 2.266 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1 786664110 WIEQPUVBKFPTFX-UHFFFAOYSA-N 428.508 2.143 10 20 IECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]1n1ccnc1 789855921 LMVSBCJAAIWBDZ-YLJYHZDGSA-N 427.574 2.162 10 20 IECD CC(C)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789956544 WIVVITYIJAYNSW-SFHVURJKSA-N 443.466 2.042 10 20 IECD C[C@]1(C2CC2)NC(=O)N(c2cccc(NS(=O)(=O)c3cccc4nonc34)c2)C1=O 790084483 YIEUZKKNLWWCGK-LJQANCHMSA-N 427.442 2.249 10 20 IECD CC(C)[C@@H](NCc1cc(Br)ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 793247584 RDDMTRMGEDAQJQ-GOSISDBHSA-N 436.354 2.465 10 20 IECD Cc1ccc(OC[C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 793794730 STFUMITXVIDNGG-IBGZPJMESA-N 425.529 2.374 10 20 IECD COc1cc(N2CCN(C(=O)C3CCC(NC(=O)C4CC4)CC3)CC2)cc(OC)c1OC 793813355 BIYSBGOFERDTAB-UHFFFAOYSA-N 445.560 2.446 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(S(C)(=O)=O)s2)cc1F 804852252 DYQJSUBILSGWFK-UHFFFAOYSA-N 441.550 2.070 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1Br 806831120 QWYDJAWTQGAUNU-UHFFFAOYSA-N 433.306 2.130 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ncnc3ccsc23)CC1)c1ccc(N(C)C)cc1 807676419 GBWLSBGQYYUORJ-OAHLLOKOSA-N 438.557 2.283 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Oc4ncccc4C)CC3)CC2)cc1 809994082 YFHQTFVTEOONJQ-JOCHJYFZSA-N 440.588 2.425 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2cnccn2)CC1 862377831 VCDUNBSUDFWUGX-INIZCTEOSA-N 441.491 2.401 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 918058516 QGIGLJVCRCNBHO-MRXNPFEDSA-N 432.546 2.326 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 918305100 ARAWZKUXFZNOOH-UHFFFAOYSA-N 425.457 2.346 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)S(=O)(=O)c1ccc(F)cc1 918373429 ZHRLBFKOZUDLHT-DOTOQJQBSA-N 447.532 2.006 10 20 IECD CN1CC(=O)N(c2cccc(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c2)C1=O 918457480 UYMKSZXBHBICJT-UHFFFAOYSA-N 449.511 2.281 10 20 IECD O=C(COC(=O)c1cnn(-c2ccccc2)c1)NCc1ccc(N2CCOCC2)c(F)c1 918908625 IWPIWYCDCWWJKZ-UHFFFAOYSA-N 438.459 2.321 10 20 IECD CN(CCCNC(=O)COC(=O)c1ccccc1N=Nc1ccc(O)cc1)S(C)(=O)=O 918950921 CCZOOMUHMBHEOH-UHFFFAOYSA-N 448.501 2.362 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CSCCS3)cc2F)C[C@@H](C)O1 918985613 DKWUYPXWNQNLNO-IYOUNJFTSA-N 442.578 2.447 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)N1CCc2sccc2C1 1116570873 MDECKJPFXQPKLO-INIZCTEOSA-N 446.525 2.115 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1C[C@@H]3CC[C@H]1C3)C2)c1cc(O)nc(O)c1 1777850418 BEZRRKWBKPLEST-UYLJANOPSA-N 443.544 2.447 10 20 IECD CCn1nc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)cc1C 1779717512 SPCFTULHJKRWTN-NRFANRHFSA-N 448.907 2.033 10 20 IECD O=C(C[C@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004000 RGHBCJSIQHGDHC-QVKFZJNVSA-N 438.908 2.154 10 20 IECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2 1796600958 LFFNKLCHRJUCQR-QNFZCTPRSA-N 425.407 2.477 10 20 IECD CC/C=C(\C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813707758 CUEUBOVXVUJZLJ-ALIJUJOJSA-N 446.598 2.304 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=COCC2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818147625 AQCMXABONSIHGT-IBGZPJMESA-N 448.483 2.499 10 20 IECD O=C(Cn1nccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1820989572 YZSDXWYATKVCJZ-CQSZACIVSA-N 445.867 2.072 10 20 IECD O=C(Cc1cnc[nH]1)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823710451 DTPJGOZPKRUAKU-JTQLQIEISA-N 447.904 2.399 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(F)F)C3)C2)cc1 1839348611 ZCYJCVBVRRNSNU-HSZRJFAPSA-N 447.482 2.429 10 20 IECD Cc1ccccc1OCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441844 FOPHGEBYCUWFMM-UHFFFAOYSA-N 446.507 2.370 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3c(c2)COC3)C1 1843753920 DGJMHWOGFLVTOT-UHFFFAOYSA-N 444.491 2.327 10 20 IECD Cc1cc(C(=O)CN2C(=O)C(=O)N(CC(C)C)C2=O)c(C)n1-c1ccc2c(c1)OCCO2 22162571 DRUOEVPTBIOCLS-UHFFFAOYSA-N 439.468 2.495 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)CN1CCOCC1 303886194 YZKFCTYZUVLYAZ-INIZCTEOSA-N 444.498 2.310 10 20 IECD Cc1c(CNC(=O)N2CCN(S(=O)(=O)c3cccnc3)CC2)n(C)c2ccccc12 472277274 MVFJMJBCDGYTPS-UHFFFAOYSA-N 427.530 2.098 10 20 IECD COCCOc1ccccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 676207137 XHZIMVDKHIELSL-UHFFFAOYSA-N 434.543 2.227 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(OCCN(C)C)c3)CC2)cc1 726725760 GJTWBLOMVGQAML-UHFFFAOYSA-N 440.544 2.359 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(F)c(S(C)(=O)=O)c(F)c3)ccc21 727618264 WAQCCXNXGKJIDL-UHFFFAOYSA-N 437.468 2.006 10 20 IECD NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 729322523 FJMXNLMZGAZXHP-UHFFFAOYSA-N 449.476 2.181 10 20 IECD NC(=O)[C@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1)Cc1ccccc1Cl 731757151 UVSVYSSNGLRPJC-SFHVURJKSA-N 430.936 2.320 10 20 IECD CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2ccc(N3CCCCC3)cc2)C(=O)C1 741212000 LJKSREARPTWNSW-UHFFFAOYSA-N 430.549 2.372 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 743872894 FEGVNDWDECOOMA-DOMZBBRYSA-N 433.368 2.011 10 20 IECD COc1ccc(C[C@@H](CO)CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1O 745778362 BCZQQTRKVAERIQ-PKOBYXMFSA-N 443.544 2.449 10 20 IECD CCOc1cc(/C=C2/SC(N3CCOCC3)=NC2=O)ccc1O[C@H](C)C(=O)N(C)C 747147948 JKAPPZLKUCSUMR-QFGUUYLXSA-N 433.530 2.243 10 20 IECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccccc3)c(CC(=O)OC)s2)cn1 747763460 FWZHPCYMPNUQRR-UHFFFAOYSA-N 436.515 2.169 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 749642372 HGXVCCZJFBSBCT-CYBMUJFWSA-N 435.502 2.368 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 751229562 YIUKOZUJCZPLJA-UHFFFAOYSA-N 447.532 2.174 10 20 IECD C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)NC(=O)NCC(F)(F)F 751930943 LLQFBWYFPSXWSM-VIFPVBQESA-N 430.408 2.250 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 754080956 HCLRPWPWNPFJCN-FPOVZHCZSA-N 440.592 2.053 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NCCCSc3nccs3)CC2)C1 759602466 VLWXOIFCBBXUAG-IRXDYDNUSA-N 439.651 2.457 10 20 IECD COc1cc(N2CCN(C(=O)[C@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc(OC)c1OC 760083197 CVWZJDMKNLUYHP-SVMVAKDDSA-N 449.592 2.495 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)c2)CC1 769848944 SQQOBPUXDUNNBX-UHFFFAOYSA-N 448.501 2.309 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O 773769194 QLXYUCKIRNOOME-WSVYEEACSA-N 449.866 2.405 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4ccc(C)cc4[nH]3)CC2)cc1 778292885 AHINSVQEWICJRG-MDZDMXLPSA-N 433.512 2.401 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCCN1CCN(C)CC1 778951844 XLKLEEOMLSEUBN-SFHVURJKSA-N 448.567 2.358 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]4CN(C)CC[C@H]43)CC2)cc1 779329964 HRZMYZISLWPFBP-NZQKXSOJSA-N 429.609 2.333 10 20 IECD COCCn1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 784326403 XPZOXZXOSNDBHI-AWEZNQCLSA-N 447.447 2.489 10 20 IECD CCO[C@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 788783808 VMMJVHUIXYIWQU-REWPJTCUSA-N 436.572 2.333 10 20 IECD C[C@@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nccs1 789841203 UEUXTCVADRVVEK-AWEZNQCLSA-N 434.537 2.122 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3Cc3ccccc3)cc2)C1 793716749 FDUWYXYAGASCPS-JTHBVZDNSA-N 448.567 2.238 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1nc(C)cs1 793721178 QHVVADPRBDQGBZ-SJLPKXTDSA-N 443.573 2.037 10 20 IECD CC[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734334 SCTQNNQCEHRVLY-CTNGQTDRSA-N 437.544 2.009 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@]2(CCOC2)O1 794307743 DNFWVJTWJHPWKK-BFUOFWGJSA-N 438.527 2.275 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)cc1F 803662902 IZJHHJLJJQXIHY-UHFFFAOYSA-N 440.519 2.177 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCN(C(=O)N2CCCC2)C1 806463891 XFOMLRWGZSXSGR-NRFANRHFSA-N 443.592 2.375 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3[nH]cnc3C(=O)c3ccccc3)CC2)cc1 806847348 NYIZAALFNWKOGI-UHFFFAOYSA-N 433.512 2.201 10 20 IECD CC(C)OCCCNC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807672782 HWORSBYZHWYTKH-SFHVURJKSA-N 446.592 2.100 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807839313 KWYPTRRMEJYWJS-UHFFFAOYSA-N 431.297 2.496 10 20 IECD C[C@H](Oc1ccc2c(c1)CCC2)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338147 VHTNHSMIOSESGI-KRWDZBQOSA-N 428.554 2.494 10 20 IECD Cc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121221 KHYBTFALKJKPQK-DYESRHJHSA-N 449.891 2.489 10 20 IECD C[C@H](CN)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877628 VSSMJMSGQOOALV-VYMYXMEBSA-N 431.533 2.031 10 20 IECD CCOC(=O)CN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C(C)C 110985049 XEAMLVHOGWATAC-UHFFFAOYSA-N 435.546 2.198 10 20 IECD COc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1-n1nnnc1C1CC1 531009453 FSVOSLCRYSZTFL-UHFFFAOYSA-N 429.487 2.354 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCc4nc(C)ncc4C3)cc2F)CC1 730114298 IWYJXIJSLBINKP-IBGZPJMESA-N 426.540 2.423 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2F)CC1 730194984 VCRRWPHHMVYBMX-QRQLOZEOSA-N 444.551 2.148 10 20 IECD CC1CCN(c2ccc(CNC(=O)NC3CCN(CCS(C)(=O)=O)CC3)cc2)CC1 731685068 QVGXLBNTXIAFNT-UHFFFAOYSA-N 436.622 2.231 10 20 IECD CS(=O)(=O)CCN1CCC(NC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 731761253 AZZOMTVFEYSMNU-UHFFFAOYSA-N 435.546 2.206 10 20 IECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1c[nH]c2ccccc2c1=O 731858287 JUNOPACIUKZKCK-KRWDZBQOSA-N 435.480 2.171 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)cc2F)CC1 734213467 BMMVDZBKGKXKDS-RBUKOAKNSA-N 433.572 2.414 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)cc2F)C[C@@H](C)O1 737107629 NJNIQNQJSHGXLF-XBEXLBAHSA-N 447.532 2.432 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)ccc3NC(=O)N(C)C)nc12 745036457 UWZOVBMYOUYKIY-UHFFFAOYSA-N 441.444 2.371 10 20 IECD CCO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 745692479 WBUXHARLVRPVLG-NVXWUHKLSA-N 444.536 2.210 10 20 IECD Cn1ccc(N2CCC[C@@H](NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)C2=O)n1 745882803 JSAWFBZKZGUJGH-QZTJIDSGSA-N 427.505 2.012 10 20 IECD O=C(Cn1cc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)cn1)N1CCOCC1 747569867 GXTVGKHOBZGOFM-UHFFFAOYSA-N 439.472 2.275 10 20 IECD CNS(=O)(=O)c1csc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 748698063 IQQSFNRAMZVTRN-BETUJISGSA-N 441.550 2.339 10 20 IECD CCOC(=O)NCCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 751898140 ZDWHXPHNUIGARI-UHFFFAOYSA-N 438.436 2.470 10 20 IECD CC1([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)OCCO1 753121970 PGIDZEGDQNLSTL-RTBURBONSA-N 430.549 2.073 10 20 IECD CCc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCOCC1 753639806 DYNNVOQSSDXHDG-HNNXBMFYSA-N 448.541 2.042 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN(C)c2ccc(S(C)(=O)=O)cc2)c1 754745925 GPAGDILEIZJUKW-UHFFFAOYSA-N 432.542 2.467 10 20 IECD COCCc1noc(CN(C)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 758698940 ADJFVSUHPKZLSE-HUUCEWRRSA-N 435.500 2.353 10 20 IECD COC(=O)c1ccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759878839 OTJQCHVGNFTTGR-UHFFFAOYSA-N 443.500 2.260 10 20 IECD CCOC(=O)C(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 762882763 NZZPOICSRLJZSX-GJZGRUSLSA-N 438.496 2.188 10 20 IECD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCc1cccc(Br)c1O 765748048 UMUPNEBIFFPQFR-UHFFFAOYSA-N 437.250 2.179 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@]3(CO)CCc4ccccc43)cc2F)C[C@@H](C)O1 766249166 HOOMNSSATNQHRQ-ATLLOTDBSA-N 441.547 2.479 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3c3nncn3C)cc2F)C[C@@H](C)O1 767761739 RTGHBOFVJVBJJQ-QINHECLXSA-N 430.528 2.021 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO 769042494 UZMVYGRNLJGEIG-ISKFKSNPSA-N 438.572 2.205 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1 769665919 DVRYWPPGNAWSKG-UHFFFAOYSA-N 431.392 2.308 10 20 IECD NS(=O)(=O)c1cccc2c(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)nccc12 770555044 RNLMZRIJRKKSHH-MRXNPFEDSA-N 441.509 2.409 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cnc(OCC(F)(F)F)cn3)no2)c1 771715472 ZTEACDULQJSXQK-UHFFFAOYSA-N 431.352 2.212 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cnn(Cc4nnc5n4CCCC5)c3)CC2)cc1 772636498 RYARFHIKBJFJLW-UHFFFAOYSA-N 436.520 2.222 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(Cc3ccccc3)C3CC3)cc2)C1 774383022 AXFCQYUOSBADCK-HXUWFJFHSA-N 434.540 2.196 10 20 IECD C[C@H](NCC(=O)NCc1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 775258512 CNCZTMAEEBBWIG-SFHVURJKSA-N 436.556 2.382 10 20 IECD CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCN(CC)CC3)c(F)c1)CC2 776137815 ZVYKCVVXZLVEEB-YADHBBJMSA-N 448.583 2.429 10 20 IECD Cn1cc(-c2ncccc2NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 786278655 YTZUYRIIMHOVTH-GOSISDBHSA-N 435.484 2.334 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCCN3CCC[C@H](C)C3)CC2)cc1 787913622 WTYNSSXDPDRDHL-IBGZPJMESA-N 430.593 2.409 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 788932034 LMGRMMNXVLEQHT-KRWDZBQOSA-N 430.549 2.371 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 789812869 PILRSVWUEUNYLS-UHFFFAOYSA-N 429.492 2.254 10 20 IECD CN(C)c1ccc([C@H](CNS(=O)(=O)C[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795250267 ZLIGJYIBWWYCMX-QAPCUYQASA-N 427.567 2.274 10 20 IECD C[C@H]1COC(C)(C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449325 VYBAWKPQWDXINE-AWEZNQCLSA-N 425.476 2.399 10 20 IECD COc1cccc2c1OC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2 804674825 MKKNJCCPUCJMNO-RBUKOAKNSA-N 440.496 2.028 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)nc1 807097183 LNQKDMBLWKXLIQ-UHFFFAOYSA-N 437.544 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](O)c3ccc(Cl)cc3F)CC2)cc1 811370755 LPVYQSADNJZIIE-FQEVSTJZSA-N 436.867 2.413 10 20 IECD COc1ccc(N2CCCN(c3nnc(C(=O)NC(C)C)n3C[C@@H]3CCOC3)CC2)cc1 812423698 XBTKMONCHXIZFQ-SFHVURJKSA-N 442.564 2.178 10 20 IECD CON(C)C(=O)C1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 813042809 UNMIGBDDOHFMJI-IYBDPMFKSA-N 436.528 2.381 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1C 917757958 CVXCGGWBERJERD-UHFFFAOYSA-N 428.488 2.021 10 20 IECD COC(=O)c1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918007382 YAQCGEQFPHZTNZ-HXUWFJFHSA-N 438.528 2.217 10 20 IECD CN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918439093 RTXVQGPXZUQUCI-UHFFFAOYSA-N 426.542 2.197 10 20 IECD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 918443290 DGLJXVDGCOYQJG-UHFFFAOYSA-N 445.541 2.472 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3F)cc2)C1 918462554 CHWCVWFPRLXCGR-AWEZNQCLSA-N 432.883 2.436 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 919792375 ZVUDRVAILPCNML-QGZVFWFLSA-N 446.573 2.334 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 1318142096 YDROPIJOZQYBLN-ZHALLVOQSA-N 446.567 2.046 10 20 IECD CCOc1ccc(N2CCN(C(=O)CNC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 1319626014 RNANCEVPPRTHCP-UHFFFAOYSA-N 441.488 2.142 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 1323789718 MIPQXAIKBIOHIY-SFHVURJKSA-N 444.557 2.080 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc([S@@](C)=O)cc3)CC2)cc1 1337366971 YJCLDAIAQIFKBM-FNFBAFLYSA-N 427.526 2.276 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cnc4c(c3)c(O)nc(=O)n4C3CC3)CC2)cc1 1341407678 YZTVEHXGZWGXOB-UHFFFAOYSA-N 435.484 2.193 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)o1 1784699627 RTYZGWUWLBHWOJ-MXGZIJRMSA-N 442.468 2.012 10 20 IECD COC(=O)C1(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)CC1 1788429021 MKCLJQUSJDEBHA-UHFFFAOYSA-N 425.441 2.194 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2cncc2c1 1798171086 KVUUOFOIXYHFDP-YBXVHQAYSA-N 448.479 2.416 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C(=O)C1CC1 1814807971 AECGWGFLPIMRNM-SFHVURJKSA-N 448.483 2.174 10 20 IECD CNCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826890177 DBDKAZWWRWZEOU-LHUXKHBRSA-N 445.560 2.436 10 20 IECD O=C(c1ccnc(Cl)n1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428106 HVMFQGKHAKXONR-MRXNPFEDSA-N 445.907 2.483 10 20 IECD CO[C@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccccc1 1843441761 CWHLLKNHMUWSDE-QFIPXVFZSA-N 446.507 2.370 10 20 IECD CC(C)(C)c1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)ccn1 1848316361 RHVBKRUZBUWXIR-GJZGRUSLSA-N 446.598 2.055 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(OC)ccc3OC)CC2)cc1 12068977 UAXJVJODFHARNY-UHFFFAOYSA-N 449.573 2.203 10 20 IECD Cc1cccc2c(=O)n(CCC(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)cnc12 26233383 GRYHQCUKFRCPMY-UHFFFAOYSA-N 436.512 2.363 10 20 IECD CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 303854445 LHFLVVMANKFLTM-SFHVURJKSA-N 434.556 2.481 10 20 IECD CC(C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)N1CCOCC1 435816124 BUDFOCXFXBCDBX-XMMPIXPASA-N 440.588 2.407 10 20 IECD Cc1cc(C(=O)CN2CCN(CC(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 727239163 IDUNGEVKEJMHKT-UHFFFAOYSA-N 432.590 2.198 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 728980160 WUVGQYUAXOCRQN-YOEHRIQHSA-N 434.514 2.349 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Sc3nnnn3C3CC3)cc2F)CC1 730235175 MEIFVMSWIUCRRU-CQSZACIVSA-N 433.557 2.086 10 20 IECD COC(=O)CN(CC(=O)N1CCN(Cc2ccccc2)CC1)Cc1cc(Cl)ccc1O 732202882 HPDLNNFDPOIEDE-UHFFFAOYSA-N 445.947 2.365 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(N4CCCCC4)CC3)CC2)cc1 743359820 XYUJRRUKROGHLE-UHFFFAOYSA-N 429.609 2.477 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 750361595 UUAWCDCBUGJFMW-UHFFFAOYSA-N 440.891 2.012 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](C4(C)OCCO4)C3)CC2)cc1 753094602 MNCFKUXUGWJKBV-HXUWFJFHSA-N 446.592 2.392 10 20 IECD COc1cc(N2CCN(C(=O)c3c(C)oc4ncnc(O)c34)CC2)cc(OC)c1OC 760085412 QVBRDYNDZNSJNV-UHFFFAOYSA-N 428.445 2.225 10 20 IECD COC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 768931343 VDLLEHFBURMNDG-FQEVSTJZSA-N 438.528 2.217 10 20 IECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c1O 769508319 WXAQHWMAEKFHDM-UHFFFAOYSA-N 440.468 2.396 10 20 IECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771055391 CAXSKYUMCGFXOJ-OAHLLOKOSA-N 440.953 2.018 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1cccc(Br)c1O 775207714 XGXWFZPBRLKOPS-UHFFFAOYSA-N 428.308 2.110 10 20 IECD CN(C)C1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCCC1 775224030 VAZLYCWCXROZFG-UHFFFAOYSA-N 434.556 2.049 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 778298707 RGZYUNYHSODDHQ-OFAQMXQXSA-N 441.532 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 778391266 VEJACWWUYNFDAX-AWWPTUBISA-N 445.585 2.071 10 20 IECD COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778417921 CQWVAVONNWBNGM-WVXISZLESA-N 443.544 2.138 10 20 IECD CCOc1ccc(NC(=O)CN2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 779531675 DFKHGANLWKEFNV-WMZJFQQLSA-N 425.485 2.293 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H](O)C1CCCCC1 783571803 HLVPSJXUPCJBCC-OAQYLSRUSA-N 427.524 2.500 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CN(C)C(=O)c4ccccc43)CC2)cc(OC)c1OC 784798975 RZPKRIBCZVYVAM-LJQANCHMSA-N 439.512 2.230 10 20 IECD COC(=O)c1cncc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 788631513 RPOWYSDHTPUQIP-MRXNPFEDSA-N 439.921 2.170 10 20 IECD C[C@H]1CN(C[C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H](C)O1 788934609 WMVQAVNMDRYCCV-XQBPLPMBSA-N 428.577 2.003 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCc3cn(CCOC)nc32)cc1 788973979 BMZATSBHSAAEOP-FQEVSTJZSA-N 427.549 2.186 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@H](C)O3)ccc1O 790408449 ZQLCJADPOSWNOB-VIFPVBQESA-N 432.907 2.078 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1 801174760 UXKPPSPNIFVZSZ-CYBMUJFWSA-N 438.477 2.052 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 803663163 RYLNSYXWOPGJGE-UHFFFAOYSA-N 428.508 2.255 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1F 804851876 RDYHCYZNIVMTQL-INIZCTEOSA-N 431.487 2.217 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(F)cc3C)cc2F)CC1 805007233 IFJRMCGDXAVFQE-UHFFFAOYSA-N 444.526 2.390 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 806281434 YDCZDFLTBDPMRF-KRWDZBQOSA-N 446.598 2.091 10 20 IECD Cc1ccc(C(=O)NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)s1 807098855 DBLWAUVHANIYKY-UHFFFAOYSA-N 442.585 2.468 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387569 OHDNSMVCPWZCEZ-UHFFFAOYSA-N 436.306 2.350 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1Cl 807387570 OHEACZMSQPSASG-UHFFFAOYSA-N 426.654 2.162 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807450455 JODZACRZALQBAM-PMACEKPBSA-N 437.588 2.257 10 20 IECD CC(C)(CCCO)CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807505428 LBBZECQVOFNSNJ-HNNXBMFYSA-N 427.492 2.288 10 20 IECD CCCN1CC[C@H](CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770377 LFQMGRFAVJJROH-SJORKVTESA-N 438.519 2.221 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1 809456566 TUOHONHIBRNZBJ-IBGZPJMESA-N 447.601 2.043 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cn(C)nc3C3CC3)cc2F)C[C@H](C)O1 812957545 VYIFXKHIBISPNU-KBPBESRZSA-N 429.496 2.305 10 20 IECD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917929927 JFHFYXLXXCZLDX-MRXNPFEDSA-N 432.502 2.083 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920881760 REXCDOVHIAHGQT-MRXNPFEDSA-N 433.530 2.196 10 20 IECD CCN(CC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC)c(OC)c1 921062307 VZNDKRMAKMGINH-UHFFFAOYSA-N 441.528 2.319 10 20 IECD CC(C)=CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799202869 OFVCTANRNOCNGJ-FEJSZKPUSA-N 438.528 2.115 10 20 IECD CC/C=C(\C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813707761 CUEUBOVXVUJZLJ-ZCAHEHFZSA-N 446.598 2.304 10 20 IECD O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815471481 QYGPLZFGOPPOAI-ZDUSSCGKSA-N 427.486 2.136 10 20 IECD O=C1CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)N1 1816970237 BUCCZLJUJNVUCM-GXTWGEPZSA-N 447.879 2.059 10 20 IECD COC(=O)c1ccc(OC[C@H](O)CN2CCCN(c3ccc(OC)cc3)CC2)c(OC)c1 226821939 GQLXXUICLSTEAU-HXUWFJFHSA-N 444.528 2.442 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1N(C)S(=O)(=O)c1cccc2nsnc12 530651823 KTFFSXUOPYOAOC-UHFFFAOYSA-N 432.527 2.297 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](N(C)C(=O)OC(C)(C)C)C3)nc12 725812010 JAJTYYDFQPNIHX-HNNXBMFYSA-N 433.509 2.443 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3CCC[C@H](CNS(N)(=O)=O)C3)c2C)c1 730571890 XEAKZKBIEZXXAA-LJQANCHMSA-N 432.590 2.399 10 20 IECD C[C@H]1CS(=O)(=O)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 739744417 HHSARDXXRVVGBY-GVIGZQTCSA-N 444.625 2.375 10 20 IECD Cn1nc2c(cc1=O)CN(C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 745800144 OWQNYCINLKMGHL-UHFFFAOYSA-N 433.459 2.118 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 749731531 RAJWJVURVLPWJD-UHFFFAOYSA-N 438.487 2.450 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](c3cccc(F)c3)N(C)C)CC2)cc1 758187986 WNAOKKPXDXNPKA-ISKFKSNPSA-N 430.568 2.210 10 20 IECD COCCc1noc(CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 758698938 ADJFVSUHPKZLSE-GASCZTMLSA-N 435.500 2.353 10 20 IECD O=C([C@H]1CN(S(=O)(=O)c2cccc3nonc23)c2ccccc2O1)N1CCCCC1 765036477 HGSHXBCANGMSLG-QGZVFWFLSA-N 428.470 2.192 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1C(=O)N(C)C 765932188 YGCFVHWHXGNNPI-UHFFFAOYSA-N 434.290 2.420 10 20 IECD Cc1cc(C(=O)CN2CCS[C@H]3COCC[C@H]32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767909987 DHCXTEBSCINKOD-CTNGQTDRSA-N 449.598 2.131 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)n1 769026602 XYTXRHUJHZIFCK-UHFFFAOYSA-N 437.544 2.186 10 20 IECD CN(C)C(=O)c1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 772911291 SQDWVACAHWKARK-UHFFFAOYSA-N 432.471 2.232 10 20 IECD COc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC 774673863 ZMKLHZVJKVQLAL-SFHVURJKSA-N 428.485 2.233 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 774861345 ZGETVVQXIFGHGA-UHFFFAOYSA-N 438.519 2.362 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 776308611 QRLGZRUSWVAKCQ-UHFFFAOYSA-N 444.463 2.337 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCNC(=O)c1ccc(C)c(F)c1 786664186 XNAFXMMBANJXOG-UHFFFAOYSA-N 428.508 2.095 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NCC3CN(S(C)(=O)=O)C3)cc2Cl)C1 799976181 IZLSMOVSKOSZGO-AWEZNQCLSA-N 428.986 2.267 10 20 IECD COCCn1c(Cn2nc(C)cc2C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802433872 XJFKSTRJCFDDGR-UHFFFAOYSA-N 443.527 2.260 10 20 IECD CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662321 ISWIQPDBVNJFIS-FQEVSTJZSA-N 441.551 2.416 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H](N4CCCC4)CC3)CC2)cc1 804318687 QZDXDJMQTWCZIL-FQEVSTJZSA-N 428.577 2.257 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N(C)Cc3ccccc3)CC2)cc1 804318952 WDYUPQXARSZIFX-LJQANCHMSA-N 438.572 2.417 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2COC(=O)NC2CCCCC2)c1 804878268 UAWFURAQQSQIAJ-INIZCTEOSA-N 439.534 2.427 10 20 IECD CO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)n1 805024132 BEDFGLJQQYAPBQ-INIZCTEOSA-N 429.521 2.288 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 806277225 UINGUYYFGUKMEV-IRXDYDNUSA-N 435.571 2.093 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 806278117 NESHCPYBHBZNPO-MRXNPFEDSA-N 432.571 2.049 10 20 IECD Cn1cc([C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c2ccc(F)cc2)cn1 807291510 XKRKCVCTKNYJTI-QFIPXVFZSA-N 433.487 2.457 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1 807292394 PXGSBTQAWOAFHD-UXHICEINSA-N 441.553 2.092 10 20 IECD CON(CC1CCOCC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770088 YANRGMGNBIEKAO-INIZCTEOSA-N 441.475 2.190 10 20 IECD CCOC(=O)NCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 915027053 JBSBECHUCBVPOB-ZDUSSCGKSA-N 438.436 2.468 10 20 IECD CC(=O)N1CCN(C(=O)[C@H](OC(=O)c2sc3nc(C)cc(C)c3c2N)C(C)C)CC1 924234783 XSWLCJIRKWORKB-QGZVFWFLSA-N 432.546 2.367 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](CO)C3CCCCC3)CC2)cc1 1117735367 XRIHZPBXEQTJRW-SGWGQVFISA-N 429.561 2.205 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c1 1255664808 AJUPYKXKEMFHOD-UHFFFAOYSA-N 448.936 2.012 10 20 IECD C=C(Oc1ccccc1O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1796882543 ZDPPDXWLOYEIMF-MUJYYYPQSA-N 425.441 2.043 10 20 IECD CCc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932468 BEZBFSNVZZSOBB-ACHSLPGTSA-N 435.484 2.282 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1796932505 FPADQRZUSKMCKS-FNLKRUPLSA-N 431.496 2.435 10 20 IECD Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1803799106 FNTYVPCDNABTKX-IIBYNOLFSA-N 433.468 2.225 10 20 IECD Cc1ncc(C(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)[nH]1 1806278292 QOJHTZJVSJECKL-UHFFFAOYSA-N 448.527 2.356 10 20 IECD Cc1[nH]nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816229937 NIYKVEAKERJTDV-GFCCVEGCSA-N 429.412 2.006 10 20 IECD COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(Cl)c1 1841911837 CHTBVNYIGIGMFS-UHFFFAOYSA-N 431.876 2.215 10 20 IECD O=C([C@H]1CCc2ccoc2C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034712 NUNUZKWXCHNHLD-UABRLCRWSA-N 438.480 2.418 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCCc4ccccc43)cc2)C1 731403164 DYXFTVAIAVMGTN-CPJSRVTESA-N 436.556 2.412 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 732984518 BIDAFDVJYAZGPU-XMMPIXPASA-N 449.599 2.134 10 20 IECD C[C@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 733364882 WQIJHULEMINXIK-LJQANCHMSA-N 435.458 2.258 10 20 IECD COCCN(CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C)CC(=O)N(C)C 735870329 SSVYHYPONUEJQZ-UHFFFAOYSA-N 429.517 2.085 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3csc(-c4cnn(C)c4)n3)CC2)cc1 742921154 YYFPISQMXVFKRA-UHFFFAOYSA-N 426.546 2.104 10 20 IECD COC(=O)c1cc(CN(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)oc1C 742940784 XUKSZFMBFYKOAZ-UHFFFAOYSA-N 444.532 2.347 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 743717821 RQTLWOLBVOEZIS-QGZVFWFLSA-N 446.573 2.328 10 20 IECD COCCNC(=O)Cn1cc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 747570753 KBWSOQPXDSSRGB-UHFFFAOYSA-N 427.461 2.179 10 20 IECD O=C(NCCCOC[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748043546 XTXJDQIAFLTTFN-CQSZACIVSA-N 440.543 2.428 10 20 IECD CNS(=O)(=O)[C@@H]1CCN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)C1 749589487 IGBKBFDDUQJYPJ-RTBURBONSA-N 441.513 2.357 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2C(=O)OC)OCO3)cc1F 753827857 IQFUOXWDWNSZFS-UHFFFAOYSA-N 445.447 2.442 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(C)c([N+](=O)[O-])c1 753833317 IFRNMIWWVNJMEZ-UHFFFAOYSA-N 428.445 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(CNS(C)(=O)=O)cc3)CC2)cc1F 753883042 JZKGIHXGOKLJKT-UHFFFAOYSA-N 436.509 2.238 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccco3)C[C@@H]3CCCO3)CC2)cc1 754019763 WOJAKEOFLHMHNB-QPPBQGQZSA-N 429.561 2.452 10 20 IECD COCCOC(=O)c1sc2[nH]c(CN(C)c3ccc4c(c3)OCO4)nc(=O)c2c1C 756647326 ZYSSSPIYJNNZJB-UHFFFAOYSA-N 431.470 2.461 10 20 IECD Cc1c(CCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1C 758603724 MSGKTIMVEXDKCE-HOTGVXAUSA-N 446.523 2.273 10 20 IECD COC(=O)c1cn(C2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)nn1 759220018 BIYIXLNWHFIFKC-UHFFFAOYSA-N 444.561 2.165 10 20 IECD COc1cc(N2CCN(C(=O)CC3(N4CCOCC4)CCCC3)CC2)cc(OC)c1OC 759220170 IQODYBQERQQBRE-UHFFFAOYSA-N 447.576 2.396 10 20 IECD CC(C)(C)OC(=O)NCCN(CCO)C(=O)NCc1ccc(N2CCSCC2)cc1 768248041 IESFSXWJQXZKKI-UHFFFAOYSA-N 438.594 2.268 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3SCCS3)cc2F)C[C@@H](C)O1 768585333 ZDIULWOXKWHLDE-CHWSQXEVSA-N 428.551 2.405 10 20 IECD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775647662 XLJDWYIEDKZARY-SZPZYZBQSA-N 427.637 2.061 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1[N+](=O)[O-] 777671108 VTNZTRDRQICBBQ-UHFFFAOYSA-N 438.447 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(O)CCCc4ccccc43)CC2)cc1 778296224 VPGOHVXGZQVBFV-WUZNFDRSSA-N 449.551 2.240 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)F)CC3)cc2F)C[C@H](C)O1 778310897 JSTKCZRAXGXLPT-GJZGRUSLSA-N 429.483 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCC(=O)OC(C)(C)C)CC2)cc1 778323697 JRNLZLWCPDDMQQ-KHPPLWFESA-N 431.533 2.090 10 20 IECD CO[C@@]1(C(F)(F)F)CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 781976271 FJCZKAIETAUPFF-IBGZPJMESA-N 433.446 2.322 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c([N+](=O)[O-])ccc(C)c3C)cc2)CC1 786121595 IFUYDAJJEIMMQF-UHFFFAOYSA-N 446.529 2.359 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN(C(=O)C(C)(C)C)C3)cc2)CC1 786659045 GMUSGUVCKYIXGP-FQEVSTJZSA-N 428.577 2.256 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 789862540 VKKDVKWWBVMDNR-GOSISDBHSA-N 449.642 2.417 10 20 IECD O=S(=O)(CCC(F)(F)F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 790163844 IUHXJHYMUAJAOY-UHFFFAOYSA-N 447.458 2.314 10 20 IECD O=C(NCc1ccn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793664685 MKMLSRHWVOCLDP-OAQYLSRUSA-N 434.496 2.402 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1nc(-c2ccccc2[N+](=O)[O-])oc1=O 794617089 SKWDQIQUZZSXCR-UHFFFAOYSA-N 425.445 2.338 10 20 IECD CO[C@H](C)CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 800830814 JHBRTORQGXOAQT-CYBMUJFWSA-N 443.503 2.481 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(N2CCOCC2)cc1 803298196 RBZISNCOTRMLSR-GOSISDBHSA-N 442.585 2.106 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1 807291591 KUZMOOHGYCMIQD-UHFFFAOYSA-N 440.588 2.030 10 20 IECD CCCN1CC[C@H](CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770375 LFQMGRFAVJJROH-IAGOWNOFSA-N 438.519 2.221 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCN(C(=O)c2cccnc2)CC1 918138296 JGJYWIOMFLCTHD-UHFFFAOYSA-N 426.492 2.226 10 20 IECD O=C(COC(=O)CN1CCS(=O)(=O)CC1)Nc1ccc(N=Nc2ccccc2)cc1 919137502 VCJIXKCDOITIRV-UHFFFAOYSA-N 430.486 2.314 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1318604448 HKOJRSMETCRXHT-CQSZACIVSA-N 439.484 2.154 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1ccsc1 1785926484 PCBNTABIQGPBMK-NVKRQELUSA-N 444.509 2.172 10 20 IECD CC[C@H](C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314811 YSUAPNQBDDLASJ-UGSOOPFHSA-N 449.598 2.388 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccccc1 1802211566 SKUMVKFGSDQVKX-ILOCAZANSA-N 443.594 2.289 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCn1ccnc1)C1=NN(c2ccccc2)C(=O)C1 1802869084 RKWAQXJECDIBQR-FNLKRUPLSA-N 448.527 2.094 10 20 IECD Cc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804335780 KVJSZHWEVMGEFB-BTTYYORXSA-N 435.546 2.246 10 20 IECD COc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810542834 ALTNPIVPIZTZQO-UHFFFAOYSA-N 426.473 2.055 10 20 IECD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1ccccn1 1816728484 QMEISJLWTMKGPP-AAEUAGOBSA-N 439.497 2.374 10 20 IECD Cn1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1Cl 1827428160 KFKGALIPAFJNKQ-MRXNPFEDSA-N 447.923 2.427 10 20 IECD CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(C)(C)C 1841499088 MAVZIWRRZPVCML-QGZVFWFLSA-N 437.924 2.119 10 20 IECD CN(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccccc1Cl 1843250707 GDNSXHFDMFGLJT-LJQANCHMSA-N 444.919 2.266 10 20 IECD COc1cccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1F 1847037736 PIRGLMGWFDIPSX-VQHVLOKHSA-N 442.443 2.482 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 10619859 DTTFIBPCJNCFJV-OAHLLOKOSA-N 433.482 2.026 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCN(C)Cc3ccccc3)CC2)cc1 726241052 WOSUUXVBJONWNL-UHFFFAOYSA-N 425.577 2.248 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC[C@@H](N3CCNC3=O)C2)c([N+](=O)[O-])c1Br 733994419 PPJQYHWPGGPOCU-SECBINFHSA-N 444.242 2.268 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740610392 YAZUFUZMUOENGV-UHFFFAOYSA-N 431.514 2.366 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3nc(O)c4ccccc4n3)CC2)cc1 742917115 QSKROTDFJULXLQ-UHFFFAOYSA-N 435.528 2.215 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc21 746040134 ZQZKAWYHTYTGGR-UHFFFAOYSA-N 435.528 2.416 10 20 IECD Cc1noc(C(F)F)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 746082877 UNNSOAHKMDKCGO-UHFFFAOYSA-N 427.379 2.370 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCNS(=O)(=O)c2cccnc2)cc1 751405850 NHSDTQLCQZGHJB-FQEVSTJZSA-N 446.573 2.024 10 20 IECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 752878807 GEZKEVCAGIDJGE-HBMCJLEFSA-N 443.592 2.319 10 20 IECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 753076658 IERHGMPQXIZRLR-WRGVRERRSA-N 447.630 2.471 10 20 IECD COc1ccc(CCN2C[C@@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc1OC 753640469 QTRMCXUSSXMFRU-QAPCUYQASA-N 442.512 2.253 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(CC4CCCCC4)CC3)CC2)cc1 754020178 RJVSELKZVXZHSO-XMMPIXPASA-N 430.637 2.376 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](CC(C)C)N3CCCCC3=O)CC2)cc1 756580755 QWXBXPDUXVMUPT-NRFANRHFSA-N 445.560 2.314 10 20 IECD O=C(NCc1cccc(Br)c1O)C1CCN(c2ccc3nncn3n2)CC1 765747442 NHCAHDWABGLYBP-UHFFFAOYSA-N 431.294 2.125 10 20 IECD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NCc3ccc(O)c(O)c3)c2c1 768917986 ZTDMOGKENISSME-UHFFFAOYSA-N 445.497 2.312 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1C(=O)c2ccccc2C1=O 769894171 MSNGMHCAYMUDHH-KRWDZBQOSA-N 448.523 2.079 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 772867000 XGGBPMUHJYZWDF-QWHCGFSZSA-N 427.523 2.234 10 20 IECD COc1ccc([C@H](CCO)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 774848988 VMUWVORTAQTRSO-NRFANRHFSA-N 431.508 2.000 10 20 IECD COC(=O)[C@H]1C[C@@H](OC)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778236374 ZPRQBIBLXJCMJR-IFXJQAMLSA-N 436.464 2.053 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc2c1OCCC2=O 780687305 QBGFOIIBTJGFLJ-UHFFFAOYSA-N 429.498 2.208 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 785423304 WJFMMFNETVFRTB-UHFFFAOYSA-N 449.599 2.217 10 20 IECD COc1ccc(C[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788318644 GTPFXLUYPRTRQH-SFHVURJKSA-N 425.529 2.143 10 20 IECD O=C(COC(=O)[C@H]1CC(=O)c2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 789305247 OXXSWWUPZXSOMR-SFHVURJKSA-N 426.444 2.192 10 20 IECD CS(=O)(=O)CC[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 789900443 QKMJAHOWVBNJLA-IBGZPJMESA-N 434.533 2.497 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3(S(C)(=O)=O)CCC3)cc2F)C[C@@H](C)O1 792835932 OCFMZHJLARYWCI-HUUCEWRRSA-N 427.542 2.206 10 20 IECD Cc1cccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 793733268 LYHNCKVVBCTPBF-DENIHFKCSA-N 449.555 2.072 10 20 IECD CCOc1cccc(CNc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2OC)c1O 796409368 YZNNAQHNNRVCGB-UHFFFAOYSA-N 435.546 2.348 10 20 IECD C[C@@H]1C[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCN1C 803451188 GCPLZKSHJGBOGF-QAPCUYQASA-N 438.519 2.314 10 20 IECD CCOc1c(OC)cc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1OC 803723954 RWXJJOYVNLKPJL-UHFFFAOYSA-N 429.517 2.443 10 20 IECD CN(Cc1ccccc1)C1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 806494130 LNWUEJZCCQPCAW-NRFANRHFSA-N 435.572 2.414 10 20 IECD CC(C)S(=O)(=O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 808238751 NUCULZRZNPAIEO-UHFFFAOYSA-N 437.484 2.164 10 20 IECD COc1ccc(N2CCCN(C(=O)Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)CC2)cc1 917821671 MSFBXTPFMNZBGQ-UHFFFAOYSA-N 426.429 2.250 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCCO4)cc2F)C[C@@H](C)O1 918286268 GIAZEZLIFRUOOV-GASCZTMLSA-N 443.475 2.465 10 20 IECD C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340810 VOTRUYFZVVXHNI-QGZVFWFLSA-N 439.537 2.053 10 20 IECD CCN(CC)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 918438667 JPAOIBRVVOHHLZ-UHFFFAOYSA-N 443.523 2.283 10 20 IECD COc1ccc(C(=O)NCCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920869897 DAHRIKQQJJDECX-KRWDZBQOSA-N 426.517 2.322 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1ccc(N2CCOCC2)cc1 920880279 BKXHSEVPTBQCQX-BXKMTCNYSA-N 436.512 2.168 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4nc(C)oc4c3)cc2)CC1 1116891118 TXBNTKNDCVGEFR-UHFFFAOYSA-N 428.514 2.283 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c[nH]c(C(F)(F)F)c3)CC2)cc1 1329886158 VSQMOBQZXPYZIN-UHFFFAOYSA-N 432.468 2.143 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1778341608 ZZCPZEUEVJJYMD-ROMRWMGNSA-N 438.528 2.045 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ncccc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994272 FITHCQIQRQTKCJ-VLIAUNLRSA-N 437.431 2.055 10 20 IECD Cc1[nH]ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827886017 UYZOKHSTHJZAJR-KRWDZBQOSA-N 448.614 2.417 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccon1)CC2 1828198834 LUXKMXLMFBESBK-SZHMKSFOSA-N 442.453 2.187 10 20 IECD C[C@@H](CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1846045523 QEQLUAWLDVIOBD-HNNXBMFYSA-N 431.583 2.244 10 20 IECD CCN1CCN(c2ccc(CNc3ccc(S(N)(=O)=O)cc3[N+](=O)[O-])cc2F)CC1 301206660 TUDMVCWQNVCTKX-UHFFFAOYSA-N 437.497 2.135 10 20 IECD Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 303802902 SULURAUKWUMLNI-HSZRJFAPSA-N 434.544 2.290 10 20 IECD NC(=O)c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726726371 LMUHRTJCGOCELO-UHFFFAOYSA-N 432.427 2.111 10 20 IECD O=C(NCCOC1CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743745510 ARIIDHGSMBXXND-UHFFFAOYSA-N 435.458 2.400 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCc4c[nH]nc4C3)cc2F)C[C@@H](C)O1 745621878 IMDGNOYTUQJKOY-HLLBOEOZSA-N 444.507 2.127 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 745944094 OKZATDYQYUTZMY-LJQANCHMSA-N 432.565 2.285 10 20 IECD CNS(=O)(=O)C[C@@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 749850132 JRBJJFLKSFPZLM-SFHVURJKSA-N 447.557 2.062 10 20 IECD CN(CC(=O)NCc1ccco1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751058532 DFIYRLPKRFPNNK-UHFFFAOYSA-N 449.510 2.236 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCNC(=O)C3CCCCC3)CC2)cc1 751303387 NDLREQGVFFJOPN-UHFFFAOYSA-N 430.593 2.410 10 20 IECD COc1cc(N2CCN(Cn3nnc4sc(C)c(C)c4c3=O)CC2)cc(OC)c1OC 758964770 OIVCRZXEQDGFNS-UHFFFAOYSA-N 445.545 2.275 10 20 IECD O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NCc1ccc(N2CCCCC2)cc1 759762528 RCODJZZVHPBTOP-UHFFFAOYSA-N 429.542 2.302 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnc1Cl 760095050 DKJYGDCLJKVHQP-OAHLLOKOSA-N 429.908 2.000 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(S(C)(=O)=O)CC1 760933850 QTRNQCBLVKRRNA-CQSZACIVSA-N 440.521 2.298 10 20 IECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1F 761651872 QBVJHUWOTVHORF-LBPRGKRZSA-N 433.436 2.283 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1F 766178986 GSMRMNLFORYPLD-UHFFFAOYSA-N 438.296 2.176 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCO4)cc2)C1 771732148 PDVIZMCFCSMRCV-GOSISDBHSA-N 429.542 2.192 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1 774125591 DNDRILBLPAAMQJ-UHFFFAOYSA-N 432.546 2.420 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCC(C)(C)N2CCOCC2)cc1 774859079 JOOPQPASGFXGSF-UHFFFAOYSA-N 442.560 2.101 10 20 IECD CC[C@@]1(CO)CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 778330985 IDUQQKUYPORYOT-JOCHJYFZSA-N 433.574 2.409 10 20 IECD Cc1cc(N2CCC(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)n[nH]1 784129786 JOOIYLARSPYMKO-UHFFFAOYSA-N 430.528 2.287 10 20 IECD COc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 786763513 WPVYCVYESFATKH-OAHLLOKOSA-N 429.492 2.289 10 20 IECD Cc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789798940 GHXMLOMKCLKOHJ-QGZVFWFLSA-N 429.492 2.171 10 20 IECD CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800396 ONZGJZADBUFNNY-BEVDRBHNSA-N 435.540 2.234 10 20 IECD Cc1ccc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1[N+](=O)[O-] 790388424 INTBZVMNBGAUDU-UHFFFAOYSA-N 439.515 2.247 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(Cl)n3)CC2)cc1 792950171 WAELSFJKNPRAKM-UHFFFAOYSA-N 431.924 2.011 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nnc4n3CCCC4)cc2Cl)C1 793584849 UBDFMUNDVGBXEA-HNNXBMFYSA-N 444.967 2.437 10 20 IECD CC(C)CN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCC1 793727048 VJPVMFBKNFWLNM-IBGZPJMESA-N 428.577 2.432 10 20 IECD COC(=O)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 797299070 IPNHAVCRFZHESO-LBPRGKRZSA-N 443.319 2.478 10 20 IECD Cc1cc(OCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 797437283 IPPPPFNEVRSJRZ-KRWDZBQOSA-N 426.473 2.300 10 20 IECD COC(=O)c1ccc(NS(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1 798203620 IESYWKJYDYACRO-UHFFFAOYSA-N 428.470 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H](c4ccnn4C)C3)CC2)cc1 801518184 YZSKRJZHPGJBPB-YXBWYFRISA-N 437.544 2.040 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCN3c4ccccc4C[C@@H]3C)CC2)cc1 803975764 NKMOJVXTCUDGAZ-IBGZPJMESA-N 436.556 2.301 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCN(c4ncccc4F)C3)cc2)CC1 805023626 YCPMENAQDLONAS-LJQANCHMSA-N 439.535 2.468 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(N(C)C)cc1 807672876 JUHKJTHFGYHITG-MRXNPFEDSA-N 425.489 2.187 10 20 IECD CCC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 807840664 HRLLDWNEEQDESL-RDJZCZTQSA-N 434.968 2.320 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3COc4ccccc4[C@H]3O)cc2F)CC1 812033534 XXHNUWSVMGHMEC-SIKLNZKXSA-N 428.508 2.261 10 20 IECD O=C(CN[C@@H](C1CC1)[C@]1(CO)CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815289060 WHGRSEJDGRJLAT-LOSJGSFVSA-N 434.492 2.310 10 20 IECD O=C(Nc1nc(CCO)cs1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816705596 MZSUROHLNUGHFL-UHFFFAOYSA-N 425.513 2.498 10 20 IECD Cc1cc(C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)c(C)n1-c1ccccn1 914903884 SVJSPHYLNUUYAN-UGKGYDQZSA-N 447.557 2.364 10 20 IECD COc1cc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1OCCO 918228457 KBPBERWMRJECOH-UHFFFAOYSA-N 429.517 2.245 10 20 IECD COc1cc(N2CCN(C(=O)c3n[nH]cc3Br)CC2)cc(OC)c1OC 1263758703 HSGUGWODSUBFDK-UHFFFAOYSA-N 425.283 2.160 10 20 IECD CNC(=O)c1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1319239304 JHUZBBRXALIXTD-UHFFFAOYSA-N 443.415 2.012 10 20 IECD C[C@]1(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC=CCC1 1784760962 WQCKQHQLABQWRC-RGXGMQNRSA-N 442.512 2.393 10 20 IECD CC[C@@H](NC)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809958178 CUEAOXPBPJEZBI-DBWMJRBXSA-N 431.533 2.046 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cocn1 1816602449 YFWPNMKCAUUJSN-SFHVURJKSA-N 447.455 2.497 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccn3cncc3c2)[nH]n1)c1cc(O)nc(O)c1 1817846288 PDTODMZXSCCADL-KRWDZBQOSA-N 447.455 2.483 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429563 MHNPVPMFGGZVNB-PBHICJAKSA-N 449.504 2.288 10 20 IECD COc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1829258660 RFWKSKWMSWRWOF-IBGZPJMESA-N 440.500 2.444 10 20 IECD O=C([C@@H]1CNc2ccccc21)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038979 HDBXLBIYXYEBTK-UGAXZCSASA-N 435.480 2.229 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCCC12CN(C(=O)C(F)(F)c1ccco1)C2 1847039332 HARZHVDMDVNAHG-FNORWQNLSA-N 434.395 2.405 10 20 IECD Cc1nc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)cs1 1848200137 NGMIHTHYECSQKA-TVKHYIBRSA-N 429.498 2.026 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ccc(=O)[nH]c2=O)c(C)n1-c1cccc(C(F)(F)F)c1 18580325 AUDRWKSSGCWJGS-UHFFFAOYSA-N 449.385 2.389 10 20 IECD Cc1cc(C(=O)CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C)n1-c1cccc(F)c1 727297391 JWBCDGCYTMXWAJ-HXUWFJFHSA-N 433.549 2.221 10 20 IECD CN(CCc1ccccn1)C(=O)CNC(=O)NCc1ccc(N2CCSCC2)cc1 727476244 REMLXBIRYVXGPG-UHFFFAOYSA-N 427.574 2.135 10 20 IECD COC(=O)c1c(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[nH]c(C(C)=O)c1C 728301428 BKGIROCWHQVWBH-UHFFFAOYSA-N 427.501 2.350 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCCC4=O)C3)cc2)C1 732887252 IMFMHTAFSMJOCB-PZJWPPBQSA-N 441.576 2.075 10 20 IECD C[C@@H](OC(=O)CN(C)C(=O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733515171 WDPHZHFFHXHYQU-CYBMUJFWSA-N 434.448 2.201 10 20 IECD O=C(N[C@H]1CCN(CCN2CCOCC2)C1)N(Cc1ccco1)Cc1ccccc1O 734685985 JDOJTUFYHYVXBI-FQEVSTJZSA-N 428.533 2.104 10 20 IECD O=C(CCc1nc(-c2nc[nH]n2)no1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799155 HMDFTNJMCXOXRC-LBPRGKRZSA-N 433.419 2.174 10 20 IECD CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1F 743958371 UAJZFAWENRSDMP-UHFFFAOYSA-N 438.452 2.208 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](N2CCNC2=O)C1 744200964 RSSUWXZXGGLSPW-WBVHZDCISA-N 446.507 2.279 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccn(CC(F)(F)F)n1 746152779 PRYKRESDTLJOPQ-UHFFFAOYSA-N 431.440 2.002 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3cc4c(cc3O)OCO4)CC2)c(OC)c1OC 747468132 VWYODAWMAFYSEL-UHFFFAOYSA-N 430.457 2.105 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNc2nc(C)cc(OC)n2)c1 747654973 UNDJBPPYAUNBQF-UHFFFAOYSA-N 438.579 2.446 10 20 IECD O=C(CCOC1CCOCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 753204478 OJVCTOZAFMGGLU-UHFFFAOYSA-N 443.523 2.144 10 20 IECD O=C(CNC1(C2CC2)CC1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 754356901 ANZOKJBYOXXXGZ-LICLKQGHSA-N 445.566 2.265 10 20 IECD CN1CCC([C@@H]2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)CC1 756683378 OBYQCLBOYNTXAX-RTWAWAEBSA-N 427.593 2.262 10 20 IECD CCn1cc(C(=O)C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 758860888 XXLILTQKIXFNMT-UHFFFAOYSA-N 431.404 2.043 10 20 IECD O=C1N[C@H](C2CCOCC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761100949 VRNYAQGXQIFZFM-QGZVFWFLSA-N 427.423 2.389 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccccc3Cn3cncn3)c2)CC1 769847415 HIOMTWRTGIKFLL-UHFFFAOYSA-N 426.546 2.269 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cn4c(C)cccc4n3)CC2)cc1 778270002 YECWSYLCGXPWQW-KHPPLWFESA-N 433.512 2.173 10 20 IECD CNC(=O)c1ccc(OC)c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 783325786 BJISCTTUROTVFL-UHFFFAOYSA-N 426.517 2.497 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C2CC2)cc1 786651674 WNTRFTULVVPDEN-UHFFFAOYSA-N 438.528 2.258 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N2CCOCC2)c1 787611891 IEJVDCGJQOLNLY-DEOSSOPVSA-N 448.567 2.177 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCC1(c2ccc(F)cc2)CC1 789763085 XABHGDCDYQYBAB-UHFFFAOYSA-N 443.494 2.390 10 20 IECD Cc1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789821775 UNYOOVWXLRECTI-OKILXGFUSA-N 434.537 2.479 10 20 IECD COCc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 789855688 WFZKSGSYCUMGJT-UHFFFAOYSA-N 431.533 2.458 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CCOCC1 789949929 LGMJLSFUDBYQIO-AWEZNQCLSA-N 443.466 2.090 10 20 IECD O=C(NCc1cccc2c1OCCCO2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793750276 UPMSNJLZGQXKKG-IBGZPJMESA-N 440.496 2.378 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCC[C@H]3COC(=O)NC(C)C)CC2)cc1 796706859 AELVGVPJFSQGBI-FQEVSTJZSA-N 432.565 2.333 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]4C3)ccc21 803689810 ZZTGBWNDVILVIP-KDURUIRLSA-N 442.560 2.011 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3nncn3-c3ccccc3)cc2)CC1 805023920 NDOSATHRKIHZGO-UHFFFAOYSA-N 432.528 2.436 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(C(=O)N4CCC(C)CC4)CC3)CC2)cc1 917068065 NBKNKBRNGUAQHQ-UHFFFAOYSA-N 442.604 2.314 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccccc3O)CC2)cc1OC 917309029 CACDEARABSWBBW-UHFFFAOYSA-N 448.541 2.469 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3cccnc3)cc2F)C[C@@H](C)O1 918211986 MSUHECQSINJPFU-IYBDPMFKSA-N 429.496 2.064 10 20 IECD C[C@@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919699615 SOFANLPRVCQXIU-MRXNPFEDSA-N 442.539 2.109 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505431 IFZYXRZKSALHRV-AHSVPJFESA-N 430.501 2.083 10 20 IECD O=C(CCc1ccccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932460 AQBWIKJNMPTJMF-NUZGMZIFSA-N 445.523 2.445 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)n(C)n1 1798852284 YGKPJVSWVNOMCX-FJXIAYRNSA-N 440.500 2.065 10 20 IECD C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CC1(F)F 1808000405 IMDNCEHPXROKQX-ASUYLVSUSA-N 432.427 2.253 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1cc(O)nc(O)c1 1817848694 XXHYCMOXEPVVRD-CZUORRHYSA-N 429.477 2.339 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825335636 YTJZERVKBSGHNM-VQIMIIECSA-N 441.532 2.259 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827289320 FFIBXFSYZZLAHY-SFHVURJKSA-N 427.505 2.325 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827429316 SPXBKEPUKNPSLK-QFBILLFUSA-N 441.532 2.492 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2nc3n(c2=O)CCCCC3)cc1 105956293 OKCBXWAMDZJWHX-HXUWFJFHSA-N 427.549 2.045 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(CCN4CCOCC4)C3)ccc21 604372554 OTHFPFAQEYUSNE-OAQYLSRUSA-N 428.577 2.041 10 20 IECD COc1cccc2c1OC[C@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 728396756 YESKKMFXVLPLEN-RBUKOAKNSA-N 438.528 2.200 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1 729062338 QLRTZEVRLSXPHS-INIZCTEOSA-N 427.501 2.091 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 738545372 FWDQVGJBBIXUFU-UHFFFAOYSA-N 427.504 2.168 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)CC2)cc1 742916518 KWYUWRNTBYMCQU-FQEVSTJZSA-N 432.565 2.333 10 20 IECD CN(C)Cc1ccc(C(N)=O)cc1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 747563566 XSJSELVXBRYNJA-UHFFFAOYSA-N 425.533 2.348 10 20 IECD CC(C)[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCC[C@@H](C(N)=O)C1 751931876 UUBPZVPJILEGIE-DNVCBOLYSA-N 444.557 2.221 10 20 IECD CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 758978975 IWWFXNDLVMYIAU-GOSISDBHSA-N 436.512 2.154 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc(N2CCOCC2)cc1 759030879 ZLNSUXFQKGLIGA-GOSISDBHSA-N 448.527 2.173 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(S(=O)(=O)CC)c2)cc1 760343788 XLYLDQUTWMDCMW-UHFFFAOYSA-N 446.572 2.433 10 20 IECD O=C(Cc1ccc(O)cc1)NCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 765589717 NAOCPPKJRRLZLT-GOSISDBHSA-N 431.920 2.191 10 20 IECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)s1 773086543 CQAQJZUEFHCRCG-AWEZNQCLSA-N 445.632 2.335 10 20 IECD NS(=O)(=O)c1sc(Cl)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 773980024 SKCUINIRGAISAJ-UHFFFAOYSA-N 443.978 2.188 10 20 IECD CN1CCC(N(C)CCN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 774729324 UEKWEWZKVSKRKN-UHFFFAOYSA-N 448.567 2.358 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3cc(OC)c(OC)c(OC)c3)nc12 774964336 UYGZJBPPORMICV-LBPRGKRZSA-N 430.461 2.488 10 20 IECD CCN1CCN(C(=O)CC2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)CC1 775682311 WBNQUQKUXZDASQ-UHFFFAOYSA-N 427.637 2.205 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cn(C)nc3C(F)(F)F)CC2)cc1 778392640 QFSAAELIAXKLMP-BQYQJAHWSA-N 437.422 2.291 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC([C@H]4CCCO4)CC3)CC2)cc1 784624254 KZCGTUKREYUJPZ-FMFFHWJCSA-N 427.545 2.318 10 20 IECD O=C(Cn1ccnc1[C@@H](O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)c(F)c1 786759395 ULSBICPKJGGIPH-QFIPXVFZSA-N 442.466 2.396 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C[C@H]2CCCO2)CC1 787119256 XHNHSCXCIMZTTG-JOCHJYFZSA-N 430.593 2.249 10 20 IECD O=C(NCCOc1ccc(F)cc1F)C(=O)NCc1ccc(N2CCSCC2)cc1 789854774 LQRFUZPDBYXDJZ-UHFFFAOYSA-N 435.496 2.329 10 20 IECD C[C@H]1OCC[C@@]12CN(C(=O)c1ccc3c(c1[N+](=O)[O-])C(=O)c1ccccc1C3=O)CCO2 791887883 HWYOWRBQGLZUHQ-JCQPUDPBSA-N 436.420 2.390 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](C)O[C@@]4(CCCOC4)C3)CC2)cc1 797412485 OOZBVUVXHSIAGU-YKSBVNFPSA-N 446.592 2.187 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCCCNS(=O)(=O)c2ccccc2Cl)c1O 798958286 SMDGWCWITXUGLN-UHFFFAOYSA-N 429.882 2.421 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 803448990 KQFGAXHZCFKLPT-WMLDXEAASA-N 425.476 2.399 10 20 IECD CN(C[C@H]1CCCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451761 VLSONTPIQWDGDQ-GOSISDBHSA-N 425.476 2.401 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)cc1F 803663474 PLFWOEKDBZPUJI-MRXNPFEDSA-N 436.528 2.414 10 20 IECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663570 SRRYDLPNUASMHU-MRXNPFEDSA-N 427.524 2.245 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1 804345691 LXVLAFTUQINJES-UHFFFAOYSA-N 436.556 2.407 10 20 IECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 815519176 NXRMQMPNVLFOJF-UHFFFAOYSA-N 428.514 2.225 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCN(C(=O)CSc3nccs3)CC2)cc1 916120635 FBYVZZYOMHAVOX-UHFFFAOYSA-N 427.573 2.167 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917918527 SXXJAYSEBYNNDB-UHFFFAOYSA-N 425.438 2.058 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1 917929323 CWWBASIXDVKFGI-SFHVURJKSA-N 431.558 2.492 10 20 IECD CN(C)C(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918294843 KSUZHNWNOARAKH-IBGZPJMESA-N 425.485 2.240 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)/C=C\c3cnn(C)c3)cc2F)C[C@@H](C)O1 918996621 FURXOWUBOLEWDX-WUWHRIRESA-N 430.480 2.046 10 20 IECD CC(=O)N1c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc2C[C@H]1C 919730265 VVBRQQQTFYELOR-MRXNPFEDSA-N 429.542 2.299 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920924434 AOOSMOLYAKTPAF-OAHLLOKOSA-N 440.500 2.306 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 1325761999 GOONCKSDFDYPSV-IRXDYDNUSA-N 446.887 2.395 10 20 IECD O=C(CN1CCCC1)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1785873487 MACRXBZZSPQUMA-UHFFFAOYSA-N 446.598 2.077 10 20 IECD CC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1792863843 XSORAPOQEYXEBS-NPDDRXJXSA-N 425.529 2.068 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1coc(Cl)n1 1794710443 IYFXPBXMECQBKL-JHURRJJJSA-N 433.848 2.410 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cncc(F)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807989784 CZMSEZDKUBSGFW-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)[nH]n1)c1cc(O)nc(O)c1 1817848381 GWOVWVWYNRWNGD-APHBUQMISA-N 435.444 2.025 10 20 IECD CCC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818148025 VSROXZZAWQDSIG-QGZVFWFLSA-N 436.472 2.174 10 20 IECD Cc1cc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)ccn1 1848114892 KDDOXBJYLSQNEP-VXKWHMMOSA-N 445.523 2.317 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O)c1ccc(N2CCOCC2)cc1 109180430 OGGMBSBGTKJRST-QQMNAOGKSA-N 428.533 2.201 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1ccc(CCS(C)(=O)=O)cc1 437078661 UNZAFOPSUDRDNO-UHFFFAOYSA-N 432.523 2.231 10 20 IECD CC(C)CC(=O)N1CCN(C(=O)CCCCCNCc2cc3c(cc2O)OCO3)CC1 727471567 HBWMRVJIKNDHPK-UHFFFAOYSA-N 433.549 2.488 10 20 IECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 732572723 YCKGSDUKWPKMST-GOSISDBHSA-N 439.585 2.417 10 20 IECD CCOc1ccc(N(C)CC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 739923800 LMUOVBATGNSYBB-UHFFFAOYSA-N 433.530 2.181 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cc1 743165839 SNFSBUCREXAIIR-UHFFFAOYSA-N 435.532 2.279 10 20 IECD Cc1cc(C(=O)N(Cc2ccco2)Cc2ccccc2O)nc2c1c(=O)n(C)c(=O)n2C 743430895 QDAXPPFHMYOILP-UHFFFAOYSA-N 434.452 2.082 10 20 IECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)N1c1ccccc1 745690495 CEAVXSAYBDSBPL-LZNRXBQRSA-N 449.555 2.382 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 746991034 VDIRPFYFMWTEFE-LJQANCHMSA-N 446.525 2.083 10 20 IECD Cc1noc(C(F)(F)F)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 750489952 GEVIAKRWJPJIOH-UHFFFAOYSA-N 445.369 2.451 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)c4ccc(C)cc4C3=O)CC2)cc1F 753739471 TVOVYBYBOAJGML-HNNXBMFYSA-N 425.460 2.476 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](CO)C[C@H](O)c3ccccc3)cc2F)CC1 754641105 QAOCMFSROURGTB-REWPJTCUSA-N 444.551 2.251 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(S(C)(=O)=O)ccc3C)CC2)cc(OC)c1OC 759219553 BEUFHYSMIANIBJ-UHFFFAOYSA-N 448.541 2.387 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 760213358 NZLKFEKDJJSAEV-UHFFFAOYSA-N 448.527 2.039 10 20 IECD NC(=O)c1cc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)on1 769257780 AIKWPONBYDKVIB-MDWZMJQESA-N 436.540 2.133 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775202902 QEDGQBUPGYFTIW-GOSISDBHSA-N 433.530 2.239 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1ccc(N2CCSCC2)cc1 775203467 UNEIFALTPKOFGX-UHFFFAOYSA-N 434.587 2.195 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](C)[C@H](n4ccnc4)C3)CC2)cc1 778327317 WOIRZWCXHWXEEP-FITJFQGMSA-N 437.544 2.206 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CCO)C3CCCCC3)CC2)cc1 778376613 DAKLJFINTQBEKS-GJCOWUBNSA-N 429.561 2.348 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 782249729 LVMUAIQMPDTOPI-UHFFFAOYSA-N 436.870 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC([C@@H]4CCCO4)CC3)CC2)cc1 784624257 KZCGTUKREYUJPZ-UVIRAJKCSA-N 427.545 2.318 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C3CC3)[C@@H](C)C3CC3)CC2)cc1 785528246 PGEYUWSGHAFBPE-SFHVURJKSA-N 428.577 2.113 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccccc3Cn3cccn3)CC2)cc1 785641949 SVSDHCIZPDIUAD-UHFFFAOYSA-N 447.539 2.295 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(C[C@H]4CCCO4)CC3)cc2)CC1 787117136 QMFUUDLCVMULHA-HSZRJFAPSA-N 442.604 2.299 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Br)cn1 788310222 JKQKELHYHOKKMG-AWEZNQCLSA-N 447.333 2.174 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1F 788329544 QGZNFZNIODEGAM-UHFFFAOYSA-N 427.885 2.204 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(CCOc2ccccc2)CC1 788913287 XCPKTBNJLYPVKR-UHFFFAOYSA-N 436.556 2.126 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCN(c2ccccc2)CC1 789800855 QWHLGDQULNYFJA-UHFFFAOYSA-N 440.519 2.017 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCOC2(CCCC2)C1 789843715 NZJPAZHSRWGVEU-KRWDZBQOSA-N 433.524 2.011 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC[C@H](C)C1 789844255 FDSAJUVQNCXBPX-WMZOPIPTSA-N 435.540 2.067 10 20 IECD Cc1ccccc1[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793730687 CFOSYMFXVUTIFG-RTWAWAEBSA-N 448.567 2.329 10 20 IECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 799256025 MWVGXWNLIASWNQ-UHFFFAOYSA-N 446.435 2.429 10 20 IECD C[C@@H](Sc1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(N)=O 800854009 IIAUHWRZNYAYNB-NVXWUHKLSA-N 440.569 2.284 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCCCn2cc(Br)cn2)cc1F 803662035 FCOUMVAJIZGFFM-UHFFFAOYSA-N 440.317 2.064 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)OC4(CCOCC4)C3)cc2)CC1 805024280 RBFDDKLFAPDKEC-IBGZPJMESA-N 429.561 2.336 10 20 IECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 806180110 KAHKKRGNUVNIEA-UXHICEINSA-N 428.577 2.399 10 20 IECD CC1(C)CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCN1CCO 806683671 ASNYLMRTZCFSPE-UHFFFAOYSA-N 426.508 2.355 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O 808227747 GMOYCLHYCONAOZ-QGZVFWFLSA-N 442.482 2.159 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H]4CN(C(C)=O)C[C@H]43)cc2F)CC1 808357766 OKWBPQUQSFLWOW-KCZVDYSFSA-N 445.583 2.414 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 810318228 SXZSTKQTMCUBIN-OAQYLSRUSA-N 427.549 2.277 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1)N1CCC[C@H]1CO 864044822 LXURQGUGKUUPDD-IBGZPJMESA-N 449.548 2.420 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2cccc(-n3cnnn3)c2)c(C)n1-c1ccc(F)cc1 916764596 OVIPUCBNSXMFJB-UHFFFAOYSA-N 440.460 2.328 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 918297322 QQCXOEOLVZNLCB-IBGZPJMESA-N 435.484 2.428 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1 918303845 LHQQIFIWENPQNW-UHFFFAOYSA-N 446.573 2.427 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)cc1 918462597 YDKJCTXYUZCZOY-UHFFFAOYSA-N 438.484 2.329 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccccc4F)CC3)cc2F)CC1 1319726498 HMFMQVAYJUVADE-UHFFFAOYSA-N 443.542 2.473 10 20 IECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3cc(OC)cc(OC)c3)CC2)cc1 1320232692 PRRRMYPQBNZMHJ-UHFFFAOYSA-N 427.501 2.181 10 20 IECD O=C(Cc1ccccc1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935097 VKWAPVOZJKRTLK-FNLKRUPLSA-N 446.507 2.366 10 20 IECD CN(C)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806901921 RVRFCGWUIXXJTR-MGPUTAFESA-N 446.935 2.418 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1C 1807993339 HYTGNEFPDVCFGD-IERDGZPVSA-N 435.484 2.168 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 727612470 HKCJMWWWFIJULE-UHFFFAOYSA-N 425.457 2.031 10 20 IECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N2CCSCC2)cc1 729285833 OQIMOWOEZCQXIY-FQEVSTJZSA-N 437.573 2.144 10 20 IECD NC(=O)N1CCCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 729361764 RBZURLAUAHSBBH-OWBHPGMISA-N 438.600 2.343 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2cccc(Br)c2O)c1 730017979 VYGSTQGQRGBULU-LLVKDONJSA-N 442.335 2.180 10 20 IECD CCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730134640 IKMVDFGJNQFKIQ-LJQANCHMSA-N 433.572 2.415 10 20 IECD O=C(NCCNC(=O)c1c(F)cccc1F)NCc1ccc(N2CCC(CO)CC2)cc1 732996855 MJDJNHITPYMKTK-UHFFFAOYSA-N 446.498 2.403 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)cc2F)CC1 741086035 CIRIXFZSYSNSJV-QZTJIDSGSA-N 440.585 2.123 10 20 IECD CN(c1ccc(CNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1)C1CCCCC1 742591115 YFOZXQQVIZOHBK-UGESXGAOSA-N 425.529 2.234 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1-n1cnnn1 743195741 ZXBDRKWTKOKWHX-UHFFFAOYSA-N 437.504 2.201 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc1 743842043 OXTIURDRNWSEGO-UHFFFAOYSA-N 428.488 2.351 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(C(=O)O)ccc3C)CC2)cc1 748965616 DEOBILNIYVIZMT-UHFFFAOYSA-N 447.557 2.192 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OCCC(N)=O)cc3)cc2)CC1 749647218 VCPPWRCXCPHFJY-UHFFFAOYSA-N 438.528 2.432 10 20 IECD O=C(CSc1nnnn1CC(F)(F)F)N(Cc1ccccc1O)C[C@@H]1CCCO1 752152018 SAGJESGGOXSLDV-ZDUSSCGKSA-N 431.440 2.241 10 20 IECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccc(N(C)C)cc4)C3=O)CC2)cc1F 753978746 UTUBXTIMHUGTJO-FQEVSTJZSA-N 426.492 2.354 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C[C@]1(N2CCOCC2)CCSC1 761151502 YXIMNTPIJAEPEG-LJQANCHMSA-N 425.938 2.018 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(CC(F)(F)F)[C@@H](C)C3)CC2)cc1 762563185 ZOXUXQXLGCLLDY-KRWDZBQOSA-N 443.514 2.095 10 20 IECD COc1cc(N2C[C@@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc(OC)c1OC 763279639 NHPHYGALBQQQSL-HIFRSBDPSA-N 444.484 2.224 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccnc1OCC(F)F 765854281 WEIUIDSSFZGPKX-UHFFFAOYSA-N 434.443 2.159 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2c(c1)CCO2 769025757 VBCQVYZUWWRDDE-UHFFFAOYSA-N 434.540 2.408 10 20 IECD CCN1CCOC[C@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 769079519 VWQBXXGMAQECJG-FQEVSTJZSA-N 428.485 2.327 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)c2)CC1 770148092 OOGDMXUSFGPTDZ-UHFFFAOYSA-N 428.558 2.403 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)cc1F 771548108 UAOHOVPFMQVUJE-MRXNPFEDSA-N 440.475 2.098 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc4c(c3)COCC4)cc2F)C[C@@H](C)O1 777238137 PSIBBODZBXFQHH-GASCZTMLSA-N 442.491 2.162 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1 785644511 DSGOYNLMJLNQPH-IBGZPJMESA-N 429.517 2.222 10 20 IECD CC1CCN(C2CCC(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)CC1 788324598 WFWWUPWEMJEMFN-UHFFFAOYSA-N 442.604 2.299 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(CN(C)C)cc3)CC2)cc1 788590523 CGBYRLCBOYVGKC-UHFFFAOYSA-N 446.617 2.247 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1cccc(F)c1 789798875 FHFHCTPZJDRNND-GOSISDBHSA-N 447.482 2.391 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCC4)C3)cc2F)C[C@@H](C)O1 789815859 BAIVDZSPISUYMW-CALCHBBNSA-N 433.524 2.085 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)cc2F)C[C@@H](C)O1 789824560 IYEVOERECABEAC-CLFNVJJBSA-N 447.551 2.375 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccco1 789824828 KBXYJOJMEWMNOR-MPGHIAIKSA-N 433.480 2.152 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3N(C)CCCC3(C)C)cc2F)C[C@@H](C)O1 789827113 RKASCJOYFLQRJH-LLGFUMIMSA-N 448.583 2.292 10 20 IECD Cc1ccc2c(c1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CC2 793731514 FJPQHMWSXSQYDG-SIKLNZKXSA-N 434.540 2.117 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1Cl 799120959 ZQEPTHVHNDNRPL-UHFFFAOYSA-N 438.314 2.265 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@H](O)CN3CCOCC3)cc2Cl)C1 800720377 SEBHESOSYBOLMU-HKUYNNGSSA-N 439.000 2.411 10 20 IECD CO[C@@H](C)CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 800830815 JHBRTORQGXOAQT-ZDUSSCGKSA-N 443.503 2.481 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21 802610156 SAHWBYBTTABSRB-HXUWFJFHSA-N 426.469 2.488 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3ccnn3C)C(C)C)CC2)cc1 804316865 MCCNEUBPAFTOCQ-HXUWFJFHSA-N 427.549 2.070 10 20 IECD COc1ccc(CN2CC[C@@H](NC(=O)NCc3ccc(N(C)C)cc3)C2=O)c(OC)c1 806026555 FHRNDJFSXVQVNT-HXUWFJFHSA-N 426.517 2.370 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 806282760 SIWGTEZBXCXKNA-HDICACEKSA-N 430.599 2.332 10 20 IECD CC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 806854332 YCFMACUWMBNMSZ-UHFFFAOYSA-N 431.439 2.383 10 20 IECD COCCC1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807770338 KRGBFJGJKQZBOB-HNNXBMFYSA-N 425.476 2.306 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 807832060 ISDCVYGNAUTYPJ-INIZCTEOSA-N 430.549 2.227 10 20 IECD COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 808029427 MSGPWHFHRDIQLD-PKOBYXMFSA-N 432.565 2.473 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC4(CCOCC4)[C@@H]3C3CC3)CC2)cc1 818781701 KRSWTJGVESWHEF-HMLKYZKVSA-N 439.556 2.318 10 20 IECD O=C(COc1ccccc1CNCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CCCO1 916846113 HZIYVOKBIFNXHG-QHCPKHFHSA-N 439.556 2.487 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCOc3ccccc3[N+](=O)[O-])cc2)C1 917836595 QELHMWGRZFCEPT-QGZVFWFLSA-N 426.473 2.382 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)/C=C\c3cnn(C)c3)cc2F)C[C@@H](C)O1 918996620 FURXOWUBOLEWDX-LIMRBJFSSA-N 430.480 2.046 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOc2cccc(Br)c2)c1 919819265 IVYMFHBNRUCENO-UHFFFAOYSA-N 429.292 2.335 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccc4o3)C[C@@H]21)c1cc(O)nc(O)c1 1787292371 WJHAAIZVNQMWSC-QOKNQOGYSA-N 437.452 2.146 10 20 IECD CC(C)NCCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313769 CXQGTBZRWRDNFR-UHFFFAOYSA-N 448.614 2.369 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@]1(F)Cl)C1=NN(c2ccccc2)C(=O)C1 1802486369 VWEGONVUTHSMGZ-IFFVWNJCSA-N 432.883 2.342 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991665 QWZKWADIHODIDQ-LAUBAEHRSA-N 446.463 2.090 10 20 IECD Cn1cncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708789 OROXHYNKBCXIAD-JTQLQIEISA-N 447.904 2.481 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)C(F)F)CC2 1828198432 DGVULELOQMEPEY-BBJBCUTESA-N 425.413 2.150 10 20 IECD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1845500581 QYAXSWIBVIYVAU-QWHCGFSZSA-N 436.892 2.158 10 20 IECD COc1cc2c(O)cccc2cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845655473 MJBGGUYZHWKOJD-UHFFFAOYSA-N 449.463 2.491 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)s1 1847056527 IYCJAKOXAOXCMY-UHFFFAOYSA-N 437.612 2.053 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CNC(=O)N(C)C)cc1 1847344600 XAXXXRGSULJCLK-SFTDATJTSA-N 437.544 2.181 10 20 IECD O=C(Cc1ccc(-n2cnnn2)cc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 71933360 MVRKBFHOBGCIJG-UHFFFAOYSA-N 446.433 2.377 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(C(=O)OC)cc3)cc2F)CC1 730268720 GFGPYFWTVCAECD-UHFFFAOYSA-N 449.548 2.374 10 20 IECD CC1CCN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)s2)CC1 730277067 WMVCDVZUCKNKGX-UHFFFAOYSA-N 437.572 2.165 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 732213200 ZDYPBXUXDNLANH-GGPKGHCWSA-N 446.567 2.142 10 20 IECD CCn1nc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccc1=O 732369651 HYFDNEXHSFYZNH-CYBMUJFWSA-N 445.431 2.223 10 20 IECD CCOCc1cc(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)ccc1OC 735085463 BJLAFCGXRHGIBT-UHFFFAOYSA-N 447.601 2.458 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1C 735316748 YEGSOCBXYYJMJC-UHFFFAOYSA-N 438.571 2.025 10 20 IECD O=C(CN1CC[C@H](CN2CCOCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741809055 NZZBCEDOLGNAQL-QGZVFWFLSA-N 433.508 2.055 10 20 IECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c[nH]1 742288860 NMJYFWGSMZJTQN-UHFFFAOYSA-N 429.445 2.350 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C)c1 743557266 PLOTWFKZMCURLW-MRXNPFEDSA-N 438.511 2.236 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2n1C 743892448 DKJKCLDJQLVYFA-UHFFFAOYSA-N 439.491 2.237 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1nccnc1NC(=O)C(C)(C)C 745563655 OYVKLMDOWAWOJO-UHFFFAOYSA-N 427.505 2.343 10 20 IECD Cc1cc(CC(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 748048283 GXDUBCUYMLWLLZ-UHFFFAOYSA-N 439.965 2.068 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CC(=O)Nc2ccccc2F)CC1 752862146 ZSQUYLOBALVMPP-UHFFFAOYSA-N 441.551 2.106 10 20 IECD COc1ccc(N2CCN(C(=O)CCN3CCN(c4ccccn4)CC3)CC2)cc1F 753748746 XJGSRJDQZANDCM-UHFFFAOYSA-N 427.524 2.090 10 20 IECD CC(C)CN(C(=O)CN(C)c1ccc2c(c1)OCO2)c1c(O)nc(=O)n(CC(C)C)c1N 756653494 KQUMLONJIIGTTF-UHFFFAOYSA-N 445.520 2.041 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cc(OC)c(C(C)=O)cc3OC)CC2)cc1 758233881 XIRQRBJNTRVDCM-IBGZPJMESA-N 444.528 2.477 10 20 IECD CNS(=O)(=O)c1ccc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(F)c1 758935178 IHCNIVXPPGADBM-UHFFFAOYSA-N 439.509 2.086 10 20 IECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)cc1F 761260706 ZINZSQKFJVFYFH-UHFFFAOYSA-N 428.869 2.492 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(NS(=O)(=O)c2cccc3nonc23)c1 765025572 MVMQGONAHWPQPB-UHFFFAOYSA-N 440.503 2.063 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NCc1cccc(Br)c1O 766200864 OWXOKSHVYMLTKK-UHFFFAOYSA-N 434.333 2.345 10 20 IECD COc1cccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c1O 769502936 BCHQRNXHRXDBNV-LJQANCHMSA-N 446.525 2.463 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC4(CCN(C)C4=O)CC3)cc2F)CC1 770537403 QTOWPGNJEXUGOO-UHFFFAOYSA-N 431.556 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc([N+](=O)[O-])c(O)c4)n3)CC2)cc1 771055678 JFUWHANBWPVPON-UHFFFAOYSA-N 439.428 2.250 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)cc2)C1 785538203 SYRPJYDETSDHSE-FXXCCUJSSA-N 425.451 2.360 10 20 IECD CCOC(=O)CSc1cncc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)n1 786067364 IQIRWKARUCLXBQ-UHFFFAOYSA-N 429.546 2.412 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2)CC1 786657150 UCTKVJPKMJPRRB-UHFFFAOYSA-N 427.417 2.102 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC([C@H](O)c2ccccc2)CC1 788318779 HIHCCNOKJLJUEV-HSZRJFAPSA-N 437.540 2.112 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 788333278 RHVWDSFBXOUNPI-FYYLOGMGSA-N 437.540 2.424 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCC1(c2cccc(F)c2)CC1 789834508 MLZOVLINVQKMMT-UHFFFAOYSA-N 443.494 2.390 10 20 IECD CN(C)CCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789855108 JZEASRXYHXIDLZ-UHFFFAOYSA-N 440.613 2.277 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@]3(CO)CC(C)C)CC2)cc1 789873725 NFAXFXQCNUYJMH-HBRDYDSTSA-N 429.561 2.300 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(Br)n1)c1ccc(N2CCOCC2)cc1 792971897 PZDFENDAJXGQON-ZDUSSCGKSA-N 433.306 2.497 10 20 IECD COC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 803297680 CWENCRVGCGJJBK-BTYIYWSLSA-N 447.482 2.483 10 20 IECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803298757 DYKRXEFTEFBPJY-UWJYYQICSA-N 441.528 2.456 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803299837 OEKLNXQEKCIDPA-OFAXGOBFSA-N 436.556 2.262 10 20 IECD O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803344818 HBFWIYUZGRSAPO-OAQYLSRUSA-N 434.496 2.402 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)cc1F 804851433 BXDCQDFGYFFDTK-WIYYLYMNSA-N 445.539 2.136 10 20 IECD Nc1nc(C2CC2)ncc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806550181 IBIVOEHEBVYKOP-UHFFFAOYSA-N 448.506 2.122 10 20 IECD CN(CCCn1ccnc1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771008 QUCGOQPBECMVMH-INIZCTEOSA-N 435.475 2.118 10 20 IECD COc1ccc(CN2CC[C@@H](NCc3ccc(N4CCOCC4)cc3)C2=O)c(OC)c1 808424123 RECSQZXZAJUSEZ-JOCHJYFZSA-N 425.529 2.431 10 20 IECD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835503 VYCXTKJFKDJSOL-KURKYZTESA-N 431.920 2.077 10 20 IECD CN(C)c1ccc(CN(C(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)C2CC2)cc1 914438523 CHSFVZMBFLYMIZ-UHFFFAOYSA-N 432.524 2.316 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cc3c(cc2Br)NC(=O)CO3)cc1 914791584 SCDMMISPLZUCOE-UHFFFAOYSA-N 440.319 2.325 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCCC3)cc2)cc1 916588167 ZGDXCXSRIMZCNN-UHFFFAOYSA-N 446.573 2.211 10 20 IECD Cc1ccc([C@H](CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)N2CCOCC2)o1 918200944 LMRAJQVZYPNBTC-NRFANRHFSA-N 446.523 2.436 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 918440840 VEMWZSGUINZYPC-UHFFFAOYSA-N 438.553 2.404 10 20 IECD CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442242 CKOQYWQSOPMXMF-UHFFFAOYSA-N 438.528 2.417 10 20 IECD COC(=O)C[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919723809 JVIVCMATTRJNLB-SCTDSRPQSA-N 435.540 2.473 10 20 IECD O=C(NC[C@@H]1CCCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 920349075 PEUYKWBDFUEGDY-HNNXBMFYSA-N 435.458 2.400 10 20 IECD CCCC[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1cc(C)on1 920635115 CQIZCEQBTSIHJE-HNNXBMFYSA-N 425.463 2.414 10 20 IECD COc1cc(OCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 921004846 OMHNLTOTJWYXKD-INIZCTEOSA-N 442.472 2.000 10 20 IECD O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)N[C@@H]1CCS(=O)(=O)C1 1335030016 CUKOMUNDKBYYNS-BQHGXPCASA-N 442.537 2.281 10 20 IECD CNC(=O)CC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1786319518 BYLVDHZRABQKAU-UHFFFAOYSA-N 447.495 2.050 10 20 IECD C[C@H](NC=O)C(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1790499780 KDMVXCWNMIXCFI-INIZCTEOSA-N 447.495 2.048 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2ccnc2c1 1798107512 WFXIVFCVKPKDGJ-YBXVHQAYSA-N 448.479 2.416 10 20 IECD CCN1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817848430 JBFLKCWVBMMJAT-QGZVFWFLSA-N 442.520 2.254 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccnn2)CC1 1827240495 FFZMYAGWEJEHTF-KRWDZBQOSA-N 447.923 2.276 10 20 IECD COCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714905 BVAGWPYPGZGXLV-FQEVSTJZSA-N 426.517 2.045 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832221904 OOTUQCJNLIFJHM-QFBILLFUSA-N 441.532 2.259 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2Cc3ccccc3O2)C1 1843910494 GNKVZDIBJZUAHU-QRBZPYHOSA-N 436.464 2.024 10 20 IECD O=C(c1n[nH]c(C2CC2)c1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034002 UGLULHCWMYQFGK-FNORWQNLSA-N 442.447 2.073 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)CC2)cc1 726725806 IZZRIJKCYZMYSE-UHFFFAOYSA-N 434.500 2.059 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCCC4=O)C3)cc2)C1 732887250 IMFMHTAFSMJOCB-FPOVZHCZSA-N 441.576 2.075 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1C 737286264 UCSOXPQZBVBHTJ-UHFFFAOYSA-N 435.502 2.116 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 742284697 XICUMMPDSGKMKJ-INIZCTEOSA-N 425.551 2.125 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](CN3CCOCC3)C2)c([N+](=O)[O-])c1Br 742416057 PIWVWMKVGUGFAK-NSHDSACASA-N 445.270 2.433 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 742952566 LQJARXHXDOIDFK-UHFFFAOYSA-N 427.482 2.099 10 20 IECD O=C(COC(=O)[C@@H]1CCc2c[nH]nc2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 745630406 YAWOIZFRWMOKAL-CYBMUJFWSA-N 429.432 2.472 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3CN3CCOCC3)cc2F)C[C@@H](C)O1 745648347 JXOWDEJBSYXNHO-QWFCFKBJSA-N 434.556 2.446 10 20 IECD O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1Cl 748675796 UGCJOIBQLQFPPX-UHFFFAOYSA-N 445.906 2.284 10 20 IECD CCOC(=O)[C@H]1CCCN(S(=O)(=O)N(CC)Cc2cc(Br)ccc2O)C1 751465538 HRTCLVPXUNOAMM-ZDUSSCGKSA-N 449.367 2.497 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 753644985 QRRKEYXIOPVXON-LLVKDONJSA-N 432.420 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(NC(=O)C4CC4)cc3)CC2)cc1F 754211590 HFPSNZKMUFIGMW-UHFFFAOYSA-N 440.475 2.470 10 20 IECD Cn1c(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)nnc1C1CC1 758550765 FDJPMJCJVNJVKO-UHFFFAOYSA-N 433.515 2.190 10 20 IECD Cn1ccc(/C=C2\SC(=S)N(c3ccc(S(=O)(=O)N4CCOCC4)cc3)C2=O)c1 763284802 XLRCBCYHOZVAFT-ATVHPVEESA-N 449.579 2.452 10 20 IECD O=C(c1ccc(NCc2cccc(Br)c2O)nc1)N1CCS(=O)(=O)CC1 764935272 QNBZTIDSMUNAHG-UHFFFAOYSA-N 440.319 2.032 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3cccc(Br)c3O)cccc21 765927326 QBZRCVKECCSLQJ-UHFFFAOYSA-N 432.274 2.319 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc21 767673228 XDNKJXVLXJZZRC-UHFFFAOYSA-N 431.514 2.272 10 20 IECD CCCCCCn1cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c(O)nc1=O 769636928 NPJTVHPGQNMLKX-UHFFFAOYSA-N 426.514 2.213 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)c1O 774836698 LTOSOYJIWDAJNT-UHFFFAOYSA-N 439.465 2.391 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@]4(C3)C(=O)Nc3ccccc34)cc2)C1 779537352 RHJMHNUHTJWQRT-AVRWGWEMSA-N 447.539 2.194 10 20 IECD CC1(NC(=O)OC(C)(C)C)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 781775258 CIJYNDDJVFKWBD-UHFFFAOYSA-N 427.523 2.283 10 20 IECD COc1ccccc1[C@H](CO)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782064305 RTXIVICGYPTDPX-FVJLSDCUSA-N 445.535 2.387 10 20 IECD O=C(Nc1cnn(C(F)F)c1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764639 JFKUSSWGPWTKRG-CYBMUJFWSA-N 427.839 2.357 10 20 IECD Cc1cc(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)no1 785960775 SHKIROZFTGZWQI-UHFFFAOYSA-N 431.470 2.007 10 20 IECD O=C(NCCOC1CCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950920 SNOPVETUVWRYLI-UHFFFAOYSA-N 443.466 2.234 10 20 IECD COC1(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCC1 791519729 PRCGJCCUMFLSHO-UHFFFAOYSA-N 434.514 2.427 10 20 IECD O=S(=O)(Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1)c1cccc2nsnc12 799185040 ZAPZDWMBEKBGHY-UHFFFAOYSA-N 444.542 2.243 10 20 IECD CO[C@@H]1CCC[C@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451778 WATGBKZCZXRZKB-KBXCAEBGSA-N 425.476 2.304 10 20 IECD Cc1nc(N2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)sc1C 803686400 KCPMRFSVLCDSSE-UHFFFAOYSA-N 427.574 2.107 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)CSc3cccc(F)c3)nc12 803797571 NBZDKFHYAVGIKU-FQEVSTJZSA-N 449.460 2.337 10 20 IECD CNS(=O)(=O)c1ccccc1S(=O)(=O)NCc1cc(Cl)cc(Cl)c1O 805135421 SUBNAPUHDYMDJH-UHFFFAOYSA-N 425.315 2.086 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 805201500 FNOOEBWLAXJPDB-SFHVURJKSA-N 428.920 2.286 10 20 IECD COc1cc(N2CCN(C(=O)c3cn(C4CC4)c(C)cc3=O)CC2)cc(OC)c1OC 807246569 NNFPTIKPAYJHEE-UHFFFAOYSA-N 427.501 2.480 10 20 IECD CCC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 807840663 HRLLDWNEEQDESL-NVXWUHKLSA-N 434.968 2.320 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ncccc2F)C1 807912804 PAUACOCTTOIRJC-SFHVURJKSA-N 427.524 2.419 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1O 809784071 GQDGWHMWEKRDMH-INIZCTEOSA-N 436.509 2.436 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)NC4CC4)ccc3C)CC2)cc1 811875845 NZDBCHKYTBKOKX-UHFFFAOYSA-N 429.542 2.407 10 20 IECD CSC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN(C)CC1 811944388 TVQQBEXBRYEKRZ-SFHVURJKSA-N 433.622 2.015 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 906481016 OBRGWUQARIAFCF-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CCNC(=O)COC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 913361352 HLCAMTRKXKVRJJ-KPKJPENVSA-N 443.344 2.330 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc4ccccc4oc3=O)cc2)C1 917832622 DHVHSYLNTQCTHU-QGZVFWFLSA-N 434.496 2.139 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(F)cc1F 918308226 HMCLGJPSRMEJST-UHFFFAOYSA-N 447.438 2.185 10 20 IECD C[C@@H](OC(=O)c1ccc(=O)n(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919203878 GXCFDWNHTFQQKW-CYBMUJFWSA-N 430.416 2.345 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1 1318605644 NHSVMVXHMZMXDA-SFHVURJKSA-N 444.963 2.410 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4c(cc3Cl)NC(=O)C4)cc2)CC1 1321208377 YVQUQBHSMMWGRW-UHFFFAOYSA-N 426.904 2.433 10 20 IECD Cc1scc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1C 1786246388 GAHUXQACQLXPPY-QRTARXTBSA-N 431.514 2.078 10 20 IECD CCc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807992920 FADUMFZRCQNBRF-VGOFRKELSA-N 447.495 2.479 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2O)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998906 PLSKCDTUYHZFMN-GAJHUEQPSA-N 448.479 2.156 10 20 IECD CCN1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1823551305 OEMUGRHJZLFTEJ-KRWDZBQOSA-N 442.520 2.254 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cn[nH]c1)CC2)c1cc(O)c(O)c(Cl)c1 1823710755 KMOVCLQDUJAMHV-SNVBAGLBSA-N 433.877 2.470 10 20 IECD Cc1nnsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427595 MYJRNLNBIASYNC-HNNXBMFYSA-N 431.518 2.200 10 20 IECD COc1ncc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1C 1842570353 YIRXSDPKSRFZHJ-UHFFFAOYSA-N 447.495 2.009 10 20 IECD O=C(c1c[nH]c2nccc-2c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441576 IQUZROJZAOWOQI-UHFFFAOYSA-N 442.479 2.124 10 20 IECD COc1ccc(N2CCN(Cn3nc(N4CCOCC4)n(C4CC4)c3=S)CC2)cc1 115569035 OEFSSOYZVYPNMA-UHFFFAOYSA-N 430.578 2.374 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(c3nnc4n3CCCC4)CC2)n(C)c2ccccc12 568685216 XIQKCRXIOCXLRZ-UHFFFAOYSA-N 434.544 2.437 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4scnc4c3)cc2)C1 726291450 GIXNIVRJFBEKMN-HNNXBMFYSA-N 437.525 2.253 10 20 IECD O=Cc1ccc(OCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 727375076 WHHMSVKPKWOWMU-UHFFFAOYSA-N 449.486 2.450 10 20 IECD C[C@H](CS(C)(=O)=O)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 733246248 KCDUWQOWQILXGO-VSXLWIIGSA-N 432.614 2.279 10 20 IECD C[S@](=O)Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 734694119 MTVZZMWQIZOOPS-PMERELPUSA-N 449.960 2.310 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2)C1 745773404 STQCHCXRCUUZRE-OAHLLOKOSA-N 430.436 2.131 10 20 IECD CN(C)c1ccc(CNC(=O)CSc2nn3c(=O)c(C(C)(C)C)nnc3s2)cc1 748343885 MXCDOPXIICSTQN-UHFFFAOYSA-N 432.575 2.318 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 751294845 QDQBHEZDVLICJE-SFHVURJKSA-N 434.514 2.396 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@](C)(c4ccccc4)C3)CC2)cc1 754062803 WLEWZDIACCSFOK-ZCYQVOJMSA-N 425.573 2.426 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1F 754193969 XMEYOTWPEFGGCR-UHFFFAOYSA-N 442.491 2.055 10 20 IECD O=C(COC(=O)Cc1ccc2c(c1)COC2)NCc1ccc(N2CCOCC2)c(F)c1 755144235 UWOUENCUQJVWAM-UHFFFAOYSA-N 428.460 2.095 10 20 IECD CC1=CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)CC1 756632919 DBVWLKXFPPJSKN-WQRHYEAKSA-N 445.566 2.385 10 20 IECD O=C(COC(=O)c1cccc(O)c1O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 758557926 LOXJGPSJIJGVBK-UHFFFAOYSA-N 448.497 2.458 10 20 IECD COC(=O)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCCC1 761956128 BQDDLYCTJWIHDZ-IAGOWNOFSA-N 435.540 2.473 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@]4(CCSC4)C3)cc2)C1 769035819 BXRINAQIVQCPAD-JBYIUTFZSA-N 432.590 2.242 10 20 IECD O=C(CN1CCO[C@@H](Cc2ccccc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 776607494 DLDFVIXBBPQSQR-NRFANRHFSA-N 427.520 2.222 10 20 IECD CCNC(=O)c1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778221009 FKBXTKPOODGAFD-VAWYXSNFSA-N 436.512 2.288 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](c3cccs3)N(C)C)CC2)cc1 778226462 SCWHBBXFUIVESS-PISNEZEASA-N 442.585 2.381 10 20 IECD COC(=O)C1(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCOCC1 781796551 LUOHXBKIFIXQCQ-HOTGVXAUSA-N 437.512 2.208 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)ccc1C 783313493 APGBNFGNGZVDMA-UHFFFAOYSA-N 446.573 2.345 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 785302105 ATXPSXHXSBTRSP-CQSZACIVSA-N 439.443 2.133 10 20 IECD CCn1c(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nc2ccccc21 785472549 HYTBNVFQYRZHHU-KRWDZBQOSA-N 435.528 2.386 10 20 IECD CC(=O)Nc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786121564 HJGMCAXGKBUZNJ-UHFFFAOYSA-N 444.557 2.100 10 20 IECD Cc1ccn(C[C@@](C)(O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)c1 790801734 RRFNDMJQEGYHPR-KSFYIVLOSA-N 435.471 2.294 10 20 IECD COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c(O)c1 794387916 OONWBZNCSDOVDT-GJZGRUSLSA-N 434.514 2.129 10 20 IECD O=C1CN(S(=O)(=O)c2cccc(NCc3cc(Cl)cc(Cl)c3O)c2)CCN1 796422926 ZUYCRWWSPVTMHR-UHFFFAOYSA-N 430.313 2.432 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NCCS(=O)(=O)NC3CC3)cc2Cl)C1 800700812 QPJLKRKXPFBOAL-AWEZNQCLSA-N 428.986 2.457 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)Oc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803304190 FBVRNJQZNLUPPK-SJORKVTESA-N 429.492 2.423 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688143 VXHFDMWAWWCMCE-LPHOPBHVSA-N 444.576 2.447 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCC[C@H]1CCO 807771016 QZUHXLDYVAUPKN-RDJZCZTQSA-N 425.476 2.137 10 20 IECD CSCC[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 916617674 VMGUXMBOPSNCAA-HNNXBMFYSA-N 429.450 2.242 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccc2c(c1)OCCO2 917030213 DIOKSBRBDMKWBI-UHFFFAOYSA-N 429.492 2.182 10 20 IECD C[C@H]1Oc2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2NC1=O 918032654 GCBCINPVFARUQO-ZBFHGGJFSA-N 437.500 2.429 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)COc1cccc(F)c1 918206891 QAVQVCITNHOGKU-GOSISDBHSA-N 435.471 2.165 10 20 IECD CCOc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c([N+](=O)[O-])cc1OC 919877761 AJGKQZFJGMTGAX-UHFFFAOYSA-N 449.485 2.489 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 920787326 PUPLPGWUICLYLS-IBGZPJMESA-N 426.469 2.254 10 20 IECD C[C@H](NC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920868762 LHYUXMVWIIYPJT-JKSUJKDBSA-N 432.546 2.292 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1ccccc1)N1CCSCC1 1320437281 WRIIRYCDWNACHE-GHTZIAJQSA-N 444.553 2.478 10 20 IECD C[C@@]1(CO)CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 1341035036 CQXWKRUXWJVQRW-HSZRJFAPSA-N 442.539 2.246 10 20 IECD Cc1nc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cs1 1794354464 ZLXOUVXVMWATGM-SATNDUHCSA-N 443.525 2.462 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n(C)n1 1798848587 OGUIVUBTSIXKNI-GGPHIMKMSA-N 448.527 2.027 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc2cc[nH]c2c1 1804333583 SNGZDFSJIOETIV-MUJYYYPQSA-N 442.566 2.280 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1 1828379094 FJTQTVUEXYCZCS-UONOGXRCSA-N 445.557 2.122 10 20 IECD NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830739858 DIEZOWBOVLSVHW-INIZCTEOSA-N 437.924 2.250 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](C)n2cnnn2)C3)cc1 1845399397 WHWMLEXSRJRBFU-SFHVURJKSA-N 433.516 2.159 10 20 IECD C[C@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N2CCOCC2)cc1 109189611 HLKWKPMMWKFWFW-INIZCTEOSA-N 429.542 2.455 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1 111208594 QKOVFWWYMIECOU-ZUZNIGHFSA-N 428.533 2.029 10 20 IECD NC(=O)C1(c2ccccc2)CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 734526826 VKWBCLFMPAGORF-UHFFFAOYSA-N 440.519 2.391 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1F 737165198 ANLJHJUJSDYQOL-UHFFFAOYSA-N 444.488 2.342 10 20 IECD CCCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737244841 AQGLWEQXSGTWPK-UHFFFAOYSA-N 429.542 2.129 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C2CCS(=O)(=O)CC2)NC(=O)OC(C)(C)C)cc1 742749654 JHMKMYAQJCPXRL-SFHVURJKSA-N 439.578 2.259 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NCc3ccccc3O)CC2=O)cc1 748354281 YGLSRINHXQLMJM-KRWDZBQOSA-N 445.541 2.092 10 20 IECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NCc3ccc4c(c3)CCCN4C)ccc2O1 751981215 UUKCLEAJHGDUBH-OAQYLSRUSA-N 430.526 2.414 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCS(=O)(=O)C[C@H](C)C1 763897392 ZEKFSIFLXAFIMV-CABCVRRESA-N 440.521 2.156 10 20 IECD CC(C)(C)NS(=O)(=O)c1cc(NS(=O)(=O)c2cccc3nonc23)ccc1F 765090000 NEGZUIADAGRVOC-UHFFFAOYSA-N 428.467 2.240 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(Cc3cccc(Br)c3O)CC2)cs1 769335618 OXHROUCOIKOLAN-UHFFFAOYSA-N 432.365 2.426 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 772485413 CFXQBWXTIFFTBK-LJQANCHMSA-N 449.511 2.299 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1)c1ccc(N(C)C)cc1 778729821 RLLCISRJTIBLIE-HNNXBMFYSA-N 442.491 2.180 10 20 IECD CCC[C@H](C)NC(=O)[C@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779222169 WDOAEJGJAVLUSU-FUDKSRODSA-N 446.636 2.195 10 20 IECD C[C@H](NC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(N2CCOCC2)cc1 779503483 QBPAHCOZQYHRTF-PNHOKKKMSA-N 427.526 2.405 10 20 IECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785528386 HFHFLTMARXVUNL-WOJBJXKFSA-N 430.593 2.409 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCS(=O)(=O)c1ccccc1 788735376 PZWAKHFLVOVIQB-UHFFFAOYSA-N 431.558 2.080 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 795075249 XXPLQZNMJGUMCM-UHFFFAOYSA-N 425.438 2.058 10 20 IECD Cc1cc(C(=O)CN(C)Cc2nncn2C(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795631137 QLBNEGMAUGLJRD-UHFFFAOYSA-N 444.561 2.229 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@]2(CCCOC2)O1 796612285 NQLBLZUGMSBPHF-FVJVTNMWSA-N 449.567 2.325 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1F 803662166 SWQWIEAPYYXGPP-KRWDZBQOSA-N 445.470 2.070 10 20 IECD Cc1nc(S(=O)(=O)NCc2cccc(Br)c2O)c(Br)n1C 805080817 QGYAGPTWGNYDOL-UHFFFAOYSA-N 439.129 2.438 10 20 IECD C[C@@H]1CC(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 806948232 YXMAZKFDTAEUAD-RBSFLKMASA-N 425.476 2.445 10 20 IECD COc1c(F)cc(CC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1S(N)(=O)=O 807837961 GTTYPNNLOBPCHM-UHFFFAOYSA-N 437.276 2.353 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3([S@](C)=O)CC3)cc2Cl)C1 807955260 RBJBRKTUUITVNT-SUMNFNSASA-N 425.982 2.220 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC 917758280 NKUOEVKYUONTBH-UHFFFAOYSA-N 429.476 2.474 10 20 IECD COC(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc([N+](=O)[O-])c1 917834197 YQABCLIMMQKWNI-OAHLLOKOSA-N 440.456 2.013 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)NC(C)C 919767468 KQFXFJRQIVYWNC-UHFFFAOYSA-N 447.557 2.149 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(N2CCCS2(=O)=O)cc1 919968789 KODJMEIIERJIQB-UHFFFAOYSA-N 443.569 2.365 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccccc2CC)C1 1320386624 OIGDKGYFQXYDMA-ROUUACIJSA-N 440.496 2.304 10 20 IECD CC(C)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C(C)C 1804285167 HHCMKGOZHWQIND-JIKJNHBQSA-N 445.560 2.477 10 20 IECD C[C@H](CN)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807017908 MUUZTJYVRRCOLK-RVZJWNSFSA-N 432.908 2.061 10 20 IECD CO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822448005 CUOQUSMSKZOTNF-KDOFPFPSSA-N 438.488 2.230 10 20 IECD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)n1cccc1 1826590577 DZIXACPLFBKIHD-DGCLKSJQSA-N 427.486 2.238 10 20 IECD CCO/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828201103 XBKUUWLXWSQONP-NPABGRFFSA-N 445.497 2.436 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1829321945 YFCRDXIKYKAFPA-GOSISDBHSA-N 441.532 2.336 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cncc(O)c2)CC1 1831698605 HGCZNDWBZJVFLI-GOSISDBHSA-N 426.473 2.141 10 20 IECD CN(CC(=O)N1CCN(CC(=O)NC(C)(C)C)CC1)Cc1ccc(N2CCCCC2)cc1 15571617 HBKAPGVJMVHETA-UHFFFAOYSA-N 443.636 2.168 10 20 IECD CC(C)Oc1ccc(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1 726434907 KUFKBDIRMJGYLR-UHFFFAOYSA-N 425.492 2.343 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(F)c(Br)c2)SC1=S 727178601 XODAQHNERBFBNI-XFFZJAGNSA-N 439.353 2.339 10 20 IECD CNS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)c1 727245870 GKCYOITTXPMUQM-UHFFFAOYSA-N 437.524 2.411 10 20 IECD C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742921786 ZQPJAKMOIJMBHU-LJQANCHMSA-N 434.540 2.449 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 743717818 RQTLWOLBVOEZIS-KRWDZBQOSA-N 446.573 2.328 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C)nc3-c3ccncc3)CC2)cc1 745838293 JAPJRFGUGQSTFA-UHFFFAOYSA-N 434.544 2.433 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(NC(=O)[C@@H]4CCCO4)cc3)ccc21 747018316 ZTDYNOFMXCFNQU-NRFANRHFSA-N 436.512 2.441 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NCCCSc2nccs2)c1 749730438 QBVDAJNNTLPUCV-UHFFFAOYSA-N 433.964 2.437 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 751318614 MZHGYDJHQCMLSR-CQSZACIVSA-N 442.559 2.471 10 20 IECD O=C(CN1CCC(Cn2ccnn2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 753218229 CJOZWXNVUSBKJD-UHFFFAOYSA-N 429.480 2.404 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)cc(F)c1O 756704527 GWLXFNIXWDKQNH-YPMHNXCESA-N 439.347 2.433 10 20 IECD COCCOc1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 757856439 RZQOFHIWAZRWFZ-FQEVSTJZSA-N 425.529 2.272 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1 758989868 NQPMAFMWWZUIEU-CYBMUJFWSA-N 432.440 2.346 10 20 IECD O=C(NCCCSc1nccs1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 759584559 AUGDVMNKCIGZCP-UHFFFAOYSA-N 432.515 2.239 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 766268801 GORBBZMCVPNEHJ-ICSRJNTNSA-N 436.574 2.033 10 20 IECD C[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)c1ccc(N2CCOCC2)cc1 771753312 PZNXTGLEFCPLHW-SFHVURJKSA-N 447.557 2.430 10 20 IECD COCCn1nc(C)c(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 772534805 KXRWMAINNMEUPI-SFHVURJKSA-N 428.537 2.170 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)[C@H](C)C3)cc2F)C[C@@H](C)O1 780313052 UWSWFKYXRLSKPY-KZNAEPCWSA-N 436.572 2.426 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 782105029 PIMQKMORYDUUSY-UHFFFAOYSA-N 435.477 2.074 10 20 IECD Cc1nn(C)c(C)c1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 788357891 ROWRPFRSEHLOHL-UHFFFAOYSA-N 435.475 2.040 10 20 IECD COc1ccccc1C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800242 QVVPXAXSVXDDKS-UHFFFAOYSA-N 443.519 2.381 10 20 IECD O=C(N[C@H]1CCCN(c2ncccn2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 790255015 PAPXRWDRNVFFKK-SFHVURJKSA-N 435.484 2.089 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 790964694 ULRRMMOSROUGGI-LBPRGKRZSA-N 437.294 2.037 10 20 IECD CCS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793735006 WNWGVTFDKQEABR-UYAOXDASSA-N 446.617 2.139 10 20 IECD NC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c1 798428486 CQJDVCJPPNAQQG-UHFFFAOYSA-N 425.963 2.471 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(N(C)C)cc1 803136194 YYQXOPXJKVXZBH-IIBYNOLFSA-N 438.528 2.364 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1F 804851686 LEZSNUAMGCUOBU-INIZCTEOSA-N 436.528 2.414 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](c3nncn3C)C(C)C)CC2)cc1 805767581 XZPZMGRFRAUVDD-FQEVSTJZSA-N 429.569 2.032 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)N(C)C)c(C)n1-c1ccccc1Br 812391394 DTJABHZHLBBZMK-UHFFFAOYSA-N 428.352 2.478 10 20 IECD COCCOCc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 812478132 DLVIXJWFONKHMS-NRFANRHFSA-N 425.529 2.481 10 20 IECD Cc1cc(CCNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1 862054820 TZEPUNGSZMHGLW-UHFFFAOYSA-N 431.496 2.012 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cncn1-c1ccc(F)cc1 916676753 QETBGZPZDSFXAO-UHFFFAOYSA-N 428.489 2.176 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 917833929 DMHQAPMTNFMION-OALUTQOASA-N 426.561 2.186 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1S(N)(=O)=O 918702992 FXGOKXPRGSPKFN-HUUCEWRRSA-N 435.521 2.325 10 20 IECD C[C@H](NC(=O)CNC(=O)c1ccc(Br)o1)c1ccc(N2CCOCC2)cc1 920890320 WKMZQCQDTGZJPI-ZDUSSCGKSA-N 436.306 2.486 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1NC(C)=O 920926467 PIXJWMAFDROTRH-OAHLLOKOSA-N 440.500 2.306 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccnn3C[C@H]3CCOC3)CC2)cc(OC)c1OC 1324158590 IXTZTZIRVZEGSD-MRXNPFEDSA-N 445.520 2.300 10 20 IECD CC[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)CC1 1791103493 FILSAWRDKZWYFR-QAGGRKNESA-N 431.533 2.303 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@H]3CCCO3)CCC2)cc1 1792313998 SKPKFOCLNCEJKO-OAHLLOKOSA-N 433.555 2.160 10 20 IECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nc1 1805867231 DWMJIONHQQLCRR-IERDGZPVSA-N 433.468 2.225 10 20 IECD CC[C@@H](C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806081360 CHWJZGVBINYBJN-QOWAEHBASA-N 446.544 2.455 10 20 IECD Cn1nccc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1808433316 VWVGVQKQTSXVCW-GQCTYLIASA-N 440.500 2.095 10 20 IECD O=C(CCCn1ccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429292 RVJICUFJAQAZTN-LJQANCHMSA-N 441.532 2.403 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831133995 PVJHKUXETVHIAA-RHSMWYFYSA-N 449.504 2.288 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)/C=C/c2cccc(O)c2)C1 1846040292 GUAXADYAJMRHDK-FWMCCXIMSA-N 436.464 2.439 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cn1 1847034052 XVNMKNBDBSMALR-JXMROGBWSA-N 437.496 2.356 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 726566369 WTIZNQTVUHQERF-HNNXBMFYSA-N 445.532 2.435 10 20 IECD COc1cc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(C)c1 728014837 IFDSZQAFVQWJSU-UHFFFAOYSA-N 428.488 2.183 10 20 IECD O=C(COC(=O)C1(C(=O)NC2CC2)CCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 729741629 UGRNEPGBWDMNSR-UHFFFAOYSA-N 446.459 2.393 10 20 IECD CN1CCN(Cc2cccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)c2)CC1 743956951 YYLSQQCIQBLFOZ-UHFFFAOYSA-N 436.556 2.273 10 20 IECD COC(=O)[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccn1 744372582 JMEHZNXXLYZGID-SFHVURJKSA-N 445.387 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(-n4cnnn4)c3)CC2)cc1F 753891819 OOUNIKHMUKJPCW-UHFFFAOYSA-N 427.440 2.173 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccco3)C[C@@H]3CCCO3)CC2)cc1 754019764 WOJAKEOFLHMHNB-URXFXBBRSA-N 429.561 2.452 10 20 IECD COc1cc(N2CCN(C(=O)CSc3nnc(S)s3)CC2)cc(OC)c1OC 760085371 QFVMGRLKPQKPHC-UHFFFAOYSA-N 442.588 2.294 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)c3ccc(OC)c(Cl)c3)CC2)cc1 760859096 MYBWIUGNPKYBOP-UHFFFAOYSA-N 431.920 2.478 10 20 IECD CNc1c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cccc1[N+](=O)[O-] 765523354 WJLCHWNGXXIIKY-UHFFFAOYSA-N 428.445 2.151 10 20 IECD CC[C@@]1(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CCC(=O)NC1=O 769723439 YUZUNHQMPIMAFY-NRFANRHFSA-N 445.497 2.100 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769849140 IKMRXKUULWIDAW-LBPRGKRZSA-N 446.572 2.150 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@@H]3CC(=O)c3cccs3)nc12 771301899 KESTUMWIPDMYRN-AWEZNQCLSA-N 430.486 2.147 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 774804625 AAKHQMNDHGQLPL-UHFFFAOYSA-N 449.502 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CC3(O)CCCCCC3)CC2)cc1 779283382 JYYLAYUIBWXPNT-VAWYXSNFSA-N 429.561 2.444 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C)(NC(=O)OC(C)(C)C)CC3)nc12 781973686 KFPBIGUIWDKUBG-UHFFFAOYSA-N 433.509 2.491 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3cccc(Cl)c3)CC2)cc1 787901601 PCVDKEVMBXMFCP-UHFFFAOYSA-N 444.963 2.407 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 788189083 QWZODMUAIBQGTH-UHFFFAOYSA-N 436.434 2.178 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@H](c2cccs2)C1 789833164 DKAXYFLEOIQPMX-IBGZPJMESA-N 447.532 2.065 10 20 IECD CCOC(=O)C1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 793673202 GDMUKEZZKUJUJP-NKELODKYSA-N 432.517 2.138 10 20 IECD C[C@H](OC(=O)[C@@H](O)c1cccnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954873 ZWWAFVJDHJTFFS-RBZFPXEDSA-N 430.416 2.461 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCC[C@@H](N4CCCC4)C3)CC2)cc1 804318262 FLHWPILAEOJAEK-OAQYLSRUSA-N 428.577 2.257 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 807671496 PUHWEVPZZGLQPY-KXBFYZLASA-N 426.492 2.381 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 807769868 JIJYAHJJLOASHA-FDPIWHGQSA-N 449.498 2.447 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1CCN(C2CC2)CC1 809865950 FOWRFEZEKDGGOD-UHFFFAOYSA-N 438.366 2.494 10 20 IECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(N2CCSCC2)cc1 915906195 QSRZQAOKRASONN-UHFFFAOYSA-N 445.589 2.294 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnccn4)CC3)cc2F)C[C@H](C)O1 918220210 IEHSZDNWXROFFV-IRXDYDNUSA-N 428.512 2.261 10 20 IECD O=C(NCC1CC1)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 918220917 MABPOICVXPQPAF-SFHVURJKSA-N 432.540 2.235 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(C(=O)OC)c(OC)c3)CC2)cc1 1116897499 JBYUKJZESWJQBT-UHFFFAOYSA-N 434.514 2.391 10 20 IECD CNS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ccc(N(C)C)c(F)c2)c1 1318092068 SICSUSAHRMPJCB-UHFFFAOYSA-N 444.326 2.492 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CC12CCS(=O)(=O)CC2 1323043402 VCWSDGIULZHEPZ-IAGOWNOFSA-N 426.966 2.341 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc(Cl)cn1 1796210382 UYSWEOLWAKAMLG-KOTZLPFRSA-N 446.891 2.005 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccccc1=O 1800718266 SCVHAUZNMLVYJS-DMRZNYOFSA-N 445.903 2.426 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC(O)C2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811796270 HAZULPNLNMMHBQ-AOEDZNLZSA-N 445.903 2.237 10 20 IECD C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CC1(F)F 1814073817 JESGIXGXUOTLJA-WSXQUGQNSA-N 432.427 2.253 10 20 IECD CCn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cc1C 1816724866 BLBGEALIJYCTFX-GFCCVEGCSA-N 442.501 2.014 10 20 IECD CC[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O)N(CC)CC 1847876506 CKSMGDCCZJCUAJ-OHNRDBALSA-N 431.533 2.139 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O)c1ccc(N2CCOCC2)cc1 109180433 OGGMBSBGTKJRST-SAHWJRBASA-N 428.533 2.201 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 726976495 LTISVUWYVACFMP-UHFFFAOYSA-N 444.962 2.062 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)Cc3ccccc3)CC2)cc1 729586009 CKWIHQVQLOFFMA-JOCHJYFZSA-N 426.561 2.110 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H]3CN3CCCCC3)CC2)cc1 729606818 JORRXCCMJFYOAG-QFIPXVFZSA-N 429.609 2.477 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(NS(C)(=O)=O)cc3)cc2F)CC1 730235820 NVEAWWVPNXTNCQ-UHFFFAOYSA-N 434.537 2.269 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)[C@H](C)[C@@H]3C)cc2F)C[C@@H](C)O1 736376192 PUGLDPHHBJEGOE-XUWVNRHRSA-N 427.542 2.156 10 20 IECD CCCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 737246124 UOEUOWVOWVHMMY-UHFFFAOYSA-N 429.542 2.129 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)c([N+](=O)[O-])cc1OCC 737285923 NERLCJIKSZHZRB-UHFFFAOYSA-N 433.417 2.361 10 20 IECD CCn1c(=O)nc(O)c2c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc(C(C)C)nc21 753644409 MBWKCQIBMJVGTG-GFCCVEGCSA-N 426.473 2.413 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 756179096 DSZZAXDMOGOCAR-UHFFFAOYSA-N 443.884 2.180 10 20 IECD CC(C)N1CCC(O)(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 761636640 FZUKANGCEBWKHE-QZTJIDSGSA-N 436.572 2.474 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN1CC(F)(F)F 763014165 ZYRYEXBKDZOWAV-WBVHZDCISA-N 441.498 2.166 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccc(N2CCCS2(=O)=O)cc1 763641769 IQOFHLZNVDVRCG-UHFFFAOYSA-N 444.557 2.063 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)cc1 765060463 KCAXCEYYHWTALF-UHFFFAOYSA-N 427.504 2.303 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773860134 ZGVFCEXRIGIKGD-CYBMUJFWSA-N 429.473 2.372 10 20 IECD CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774363371 JGGKXPAJQROJQO-UHFFFAOYSA-N 429.473 2.420 10 20 IECD COc1ccc(F)cc1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775108096 IJVPDIPIJJLLRD-UHFFFAOYSA-N 434.439 2.212 10 20 IECD CC1(C)OCC(C)(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CO1 775145435 AVLDLWVDPPINAN-UHFFFAOYSA-N 443.523 2.348 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](O)[C@H]3C(=O)OC)c2C)cc1 781956825 BAYDMNFWVCJMHZ-FPOVZHCZSA-N 428.485 2.062 10 20 IECD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 783833883 GHQBMLUVASHGLZ-OLZOCXBDSA-N 427.523 2.329 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)nc3)cc2F)C[C@@H](C)O1 786614195 LUGPPOKXFVIIFX-OKILXGFUSA-N 434.899 2.420 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN(C)C1CCCCC1)c1ccc(N2CCOCC2)cc1 787686766 GFYQHWJTIYANAC-IBGZPJMESA-N 430.593 2.471 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2ccc(F)cc2F)CC1 788312748 LZJPUIHBHRWDNJ-UHFFFAOYSA-N 429.467 2.266 10 20 IECD C[C@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(N(C)C)C1 789844411 RYPMQFOSOFMAAJ-BXKMTCNYSA-N 448.583 2.030 10 20 IECD Cc1cccc([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793734689 VTRJIRFSLWBXTJ-GHTZIAJQSA-N 436.556 2.233 10 20 IECD CN(C)S(=O)(=O)C[C@H](NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(F)(F)F 796458330 LLQFYXAIGYDWMX-INIZCTEOSA-N 438.472 2.497 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 798431206 DXXVCZVTEAYZMA-OAHLLOKOSA-N 434.514 2.358 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451522 OBMQSXOKKZKBJR-QGZVFWFLSA-N 438.519 2.362 10 20 IECD CCc1cc(N2CCC[C@H](NC(=O)C(=O)N(CC)Cc3ccc(N(C)C)cc3)C2)ncn1 806270140 SOQLQWIHZIYHIO-FQEVSTJZSA-N 438.576 2.239 10 20 IECD CS(=O)(=O)c1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cc1 918198833 ICVBRYIUISWWOV-SSZFMOIBSA-N 426.585 2.014 10 20 IECD O=C(NCCc1nnc2n1CCCCC2)NCc1ccc(N2CCC(O)CC2)c(F)c1 918199489 DBNCZEWNBZJIML-UHFFFAOYSA-N 430.528 2.147 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cnc4ccccc4c3)cc2)C1 918463238 JWSTWHNRFXQWDR-GOSISDBHSA-N 431.496 2.191 10 20 IECD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 919767338 WWDQHXWYBAEOPU-HNNXBMFYSA-N 437.949 2.160 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1 920252007 WVRSTYGFPIOBPZ-VAWYXSNFSA-N 448.567 2.244 10 20 IECD C[C@H](N[C@H](C)C(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc(N2CCOCC2)cc1 920868011 ZXEWPMXHBXXUMX-RBUKOAKNSA-N 440.544 2.140 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920888670 WGOJQRHTRMOCBB-MSOLQXFVSA-N 431.558 2.376 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1)c1ccc(N2CCOCC2)cc1 920927388 WNOCFQSLQXQXSQ-MRXNPFEDSA-N 436.512 2.231 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C(=O)N(CC)CC)cc1 1116669778 YVWUSWBXJDSOQR-SFHVURJKSA-N 428.485 2.484 10 20 IECD Cn1cc(C(N)=O)c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 1337146486 OCDMDTSRPJUSKP-XYOKQWHBSA-N 435.556 2.201 10 20 IECD Cc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782004335 BQMXVRRWJYZSBX-QFIPXVFZSA-N 445.903 2.141 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1Cl 1787292507 WCEVLJCGSHHEAL-ZVZYQTTQSA-N 445.903 2.362 10 20 IECD C[C@](O)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)C(F)(F)F 1793933742 OOADRIHGKBDWLC-UCSBCBTLSA-N 436.814 2.316 10 20 IECD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1 1798944223 IWGCIIRXIUHAJI-CCWDJLKJSA-N 446.887 2.277 10 20 IECD CCCNC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824405194 FJFZNFHNKCPFNQ-GOSISDBHSA-N 446.548 2.033 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCOC3)sc2C1)c1cc(O)c(O)c(Cl)c1 1827175963 ARCSPKZMUVBEDY-GXSJLCMTSA-N 437.905 2.470 10 20 IECD Cc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428512 SLLTYWSMHYYUBM-QGZVFWFLSA-N 425.489 2.138 10 20 IECD COC[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195009 HCNQNLCQGWOUGB-SGHLJCSCSA-N 447.513 2.168 10 20 IECD Cn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)c1 1832898714 WZEIGAHOJMQMKP-QGZVFWFLSA-N 448.614 2.119 10 20 IECD O=C(CCc1ccoc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031672 BYRPPLGYHTZZES-UHFFFAOYSA-N 443.500 2.331 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3nc[nH]c3c2)C1 1844054421 DLLNFSJJSZRPPV-QPJJXVBHSA-N 434.452 2.210 10 20 IECD CC(C)(C)c1ncccc1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056913 VCIBXLDTNINILH-UHFFFAOYSA-N 446.598 2.056 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3cc(C)cc(C)c3)CC2)cc1 24089010 RWJXQESDINYFCA-UHFFFAOYSA-N 438.572 2.370 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1 729063361 JKSOJZLGGCGFSP-CQSZACIVSA-N 441.484 2.461 10 20 IECD COC(=O)CN(CC(=O)NC(=O)N[C@H]1CCCC[C@H]1C)Cc1cc(Cl)ccc1O 731845750 FFDLAJQQTDTIPS-CJNGLKHVSA-N 425.913 2.425 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4c(F)cccc4F)=NO3)cc2)C1 736005092 BMBNYZIRCGAFPJ-QRWLVFNGSA-N 442.466 2.476 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)c1O 737284050 KOSGKWVJLYGXCG-UHFFFAOYSA-N 443.525 2.153 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741096998 ICISMEBNMFECGS-UHFFFAOYSA-N 435.513 2.015 10 20 IECD O=S1(=O)CCN(c2ccc(CNC(=S)N[C@H]3CCc4ccccc4C3)cc2)CC1 742992171 JXQDFZIJODPLGK-FQEVSTJZSA-N 429.611 2.443 10 20 IECD CCN(CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(OC)cc1 746108943 GEGVXQDNSXHEPQ-UHFFFAOYSA-N 433.530 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCN3C(=O)CC(C)(C)C)CC2)cc1 748381115 CKAXFECATIVQHK-FQEVSTJZSA-N 445.560 2.314 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H]3CCCN(C(=O)c4ccncc4)C3)CC2)cc1F 753737184 BOSGQUVFVXXFDA-SFHVURJKSA-N 426.492 2.430 10 20 IECD COc1cc(N2CCN(Cn3ncc(Cl)c(Cl)c3=O)CC2)cc(OC)c1OC 758963984 KMLOGMNRWWOMNR-UHFFFAOYSA-N 429.304 2.356 10 20 IECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CN(Cc2ccccc2)CCO1 761608015 JREGAIFDEZRBRU-PZJWPPBQSA-N 447.557 2.173 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(OC)cc(OC)c3)CC2)cc1 767834947 ARUCVIFASFRQKX-UHFFFAOYSA-N 449.573 2.203 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 769635375 CUDUUCGIPZHFRJ-OKILXGFUSA-N 437.493 2.099 10 20 IECD C[C@](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)(C(N)=O)c1ccccc1 769744911 ZTSKXIRBFNXILH-HXUWFJFHSA-N 445.522 2.385 10 20 IECD Cc1ccc(I)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 773459119 RSMFJASULRSWHP-UHFFFAOYSA-N 440.237 2.308 10 20 IECD COc1cc(OC)cc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)c1 774836921 NAEXHHGJAKWQOT-UHFFFAOYSA-N 431.445 2.284 10 20 IECD CC(C)c1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(O)n1 775048521 CKZUNKJRXDQNOQ-UHFFFAOYSA-N 431.464 2.360 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc4c(cc3F)NC(=O)CC4)CC2)cc1 778561340 ICZDQQQZHOGYPM-UHFFFAOYSA-N 440.475 2.396 10 20 IECD CC(C)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1=O 779980452 JGQFAMCZFZBGRH-UHFFFAOYSA-N 428.455 2.304 10 20 IECD COc1cc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ncn1 783068134 XGCYAJKBDAGXBV-UHFFFAOYSA-N 438.467 2.063 10 20 IECD CC(C)n1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1N 783197445 JUZSPMAWADIJMV-GJZGRUSLSA-N 447.511 2.272 10 20 IECD CN1CCO[C@@H]([C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c2ccc(Cl)cc2)C1 785434866 VRFZUJGGCRXYOO-RTWAWAEBSA-N 444.963 2.210 10 20 IECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 799833027 UFHVYZCHSGBQDL-UHFFFAOYSA-N 446.573 2.394 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccn(-c4ccccc4)n3)CC2)cc1 804106459 LBYUBUKLEOCHAV-UHFFFAOYSA-N 447.539 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(OCCCO)cc3)CC2)cc1 804757953 MIMFQIQHASLATB-QXMHVHEDSA-N 439.512 2.300 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1 805186563 LSROJWNTUAVHQL-GOSISDBHSA-N 438.528 2.015 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc(OC)c1OC 806928393 UAMKOHPSOWEVBP-IXDOHACOSA-N 433.549 2.302 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C12CCCC2 807199893 RAJYXFLWTXXZBI-LEWJYISDSA-N 429.561 2.336 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(N(C)C)cc1 807469627 JNWGFWISIHWPSA-SFYKDHMMSA-N 438.572 2.336 10 20 IECD CN(C)c1cccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 807770784 OOUOKYIUKDCWKP-INIZCTEOSA-N 447.486 2.150 10 20 IECD NC(=O)COc1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 880630881 LYBRXHJGJDPVCL-UHFFFAOYSA-N 445.387 2.487 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccccc1C(=O)N1CCOCC1 915778702 PSWRHNLKNGGNDP-UHFFFAOYSA-N 436.512 2.014 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 918284614 LDAAKHFIPVQUEV-UHFFFAOYSA-N 445.491 2.251 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)cc2F)CC1 1319717856 MCUYRKDMFAXPLM-UHFFFAOYSA-N 441.507 2.444 10 20 IECD CCOC(=O)/C=C/C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426291 DGLPYDJEGLMILF-CMDGGOBGSA-N 425.441 2.360 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)s1)C2)c1cc(O)c(O)c(Cl)c1 1799767220 BTVWLTSRCDXCCF-CULMDFNYSA-N 440.880 2.469 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801287960 QBJLMPPDYPWERU-NDTRKSHOSA-N 445.560 2.433 10 20 IECD Cc1nscc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805185379 NCJORRLFAGPRKY-LIRRHRJNSA-N 439.497 2.286 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3[nH]cc4c3CCC4)sc2C1)c1cc(O)nc(O)c1 1821198235 KUQRMDHDYHGPOE-GFCCVEGCSA-N 439.497 2.306 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1[C@H]2C=CS[C@@H]21 1821706270 BMWKHFBGZOEFTA-MWDQSAOVSA-N 427.486 2.397 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccc(Cl)o1 1835265399 JIDBLVSFAMAVNO-UHFFFAOYSA-N 448.907 2.238 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)on1 1843442749 XXRHFUZZHQLXOL-UHFFFAOYSA-N 435.484 2.408 10 20 IECD COc1ccccc1CC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846061447 GVMHSAJPPHUIDJ-UHFFFAOYSA-N 446.507 2.234 10 20 IECD C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccc(N(C)C)cc3)c2)C[C@@H](C)O1 15135007 JDIOAEHSEPIZAG-IAGOWNOFSA-N 431.558 2.481 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 108808329 PUNGUXTWNCRHLD-FQEVSTJZSA-N 449.507 2.228 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3ccc([S@](C)=O)cc3)C=C2)CC1 464001936 HFQKYQYGVQKUAV-SANMLTNESA-N 426.585 2.030 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)cc2F)C[C@@H](C)O1 728746064 POIILLSWKXJHLS-WOSNLTMFSA-N 434.556 2.180 10 20 IECD COCCOC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729063091 YBCFQHSJPXPXLU-CYBMUJFWSA-N 431.445 2.412 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 734406104 MMIMVUKSCUHQAN-SYZXBLONSA-N 434.540 2.481 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1 735117619 AIRUSNVPJXCSAZ-CYBMUJFWSA-N 441.456 2.374 10 20 IECD CC(C)(C)c1nsc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 737132096 VOAZGGHNMGFMMD-UHFFFAOYSA-N 435.525 2.191 10 20 IECD O=C1CSc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 738890181 ZCBPJGAGVJZAPZ-UHFFFAOYSA-N 446.554 2.287 10 20 IECD O=S1(=O)CCN(c2ccc(CNC(=S)N[C@H]3CCOc4ccccc43)cc2)CC1 741491703 LCHURHQQOVTBAH-IBGZPJMESA-N 431.583 2.409 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 747570754 KHVMCGCYWCZBIT-HDICACEKSA-N 438.532 2.217 10 20 IECD COc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1OC 748673975 OJPKINRPFIYCGH-UHFFFAOYSA-N 440.543 2.048 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 749641264 YTJYHEIHWNJJOO-UHFFFAOYSA-N 444.557 2.476 10 20 IECD C[C@@H](CC(=O)NCc1ccc2c(c1)CCCN2C)NS(=O)(=O)c1cccnc1Cl 760474738 QYSCNLWBQXSDEB-AWEZNQCLSA-N 436.965 2.491 10 20 IECD CC(C)N1CCN(C2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)CC1 760820119 KFEVIVBCXGJLAB-UHFFFAOYSA-N 429.609 2.223 10 20 IECD C[C@](O)(C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1)C(F)(F)F 767897936 UPUPJVSNGOLWER-FQEVSTJZSA-N 447.473 2.304 10 20 IECD CN1CCC(N(C)C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 769571007 WSQHHLIAFQCAOS-UHFFFAOYSA-N 448.501 2.267 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)N1C(=O)c2ccccc2C1=O 771400421 NEAMDKUIUPVREV-UHFFFAOYSA-N 439.487 2.478 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1C(=O)OC 773859539 VVBVHNMGTMUSPK-ZDUSSCGKSA-N 427.457 2.142 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2-c2ccno2)cc1C(=O)O 782250648 CIPMJAZHDWRYFI-UHFFFAOYSA-N 437.455 2.212 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CCO)Cc3ccc(C)cc3)CC2)cc1 783641156 ZFRDYJGHLYZBFU-VAWYXSNFSA-N 437.540 2.230 10 20 IECD O=C(Nc1cnn(C(F)F)c1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764640 JFKUSSWGPWTKRG-ZDUSSCGKSA-N 427.839 2.357 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCn1cnc2ccccc21 785410218 CZMLMYGBGXJSFV-UHFFFAOYSA-N 435.528 2.038 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cc2)CC1 786263487 YCWJPCUJWXEMRX-UHFFFAOYSA-N 448.483 2.379 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 788312278 GIQAKSGNTUXAED-VXKWHMMOSA-N 441.503 2.315 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCCc2ccccc2C1 789844258 QRYDUTRPPVQTQQ-UHFFFAOYSA-N 425.504 2.378 10 20 IECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)NCc1cccc(Br)c1O 795186261 QMTXHUICWWJLCI-UHFFFAOYSA-N 431.356 2.008 10 20 IECD COCc1ccc(OC)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 795349912 IDTDPOSWPRMUDH-UHFFFAOYSA-N 433.530 2.311 10 20 IECD Cc1nc(O)c(Br)cc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795396649 LRQFVORQFHIYCQ-CQSZACIVSA-N 447.333 2.490 10 20 IECD CC(=O)N[C@@](C)(C(=O)NCCCSc1nccs1)c1ccc(S(C)(=O)=O)cc1 797726294 BKFRQMSEQZIJIN-GOSISDBHSA-N 441.600 2.197 10 20 IECD CC[C@H](C)N(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804220131 YFUKROFTWYQTRR-HOTGVXAUSA-N 426.508 2.220 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCOCC4)C3)cc2)CC1 805024260 QOHZLHUUNNQQGA-UHFFFAOYSA-N 429.561 2.195 10 20 IECD CN(CC1CCOCC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770942 PXTJSAMCRYZYQN-INIZCTEOSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCC(=O)c5cccn54)n3)CC2)cc1 809464966 NVLVWZOFVTXUJM-IBGZPJMESA-N 435.484 2.337 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCCc4c3cnn4C)CC2)cc1 916197176 WPMCBCCNGJSAHC-OAQYLSRUSA-N 426.565 2.318 10 20 IECD Cc1nc(O)nc(O)c1CCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456708 NHDPLMOWMZRNGR-UHFFFAOYSA-N 440.422 2.301 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(CN2CCOCC2)CC1 918221198 QKNQFUYGQGPBEI-UHFFFAOYSA-N 434.556 2.041 10 20 IECD Cn1cnnc1-c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918294580 HABMGCUAAHEFMR-IBGZPJMESA-N 435.484 2.334 10 20 IECD O=C(Cn1cc(Br)ccc1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969616 UPJVRTWUZGHYEQ-UHFFFAOYSA-N 438.297 2.027 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n(C)n1 1794654237 MVUPLBBAPRVOGK-CLLJXQQHSA-N 434.880 2.059 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C(=O)c1ccccc1 1806234695 FOTYVCQHAOTJJT-UWJYYQICSA-N 446.463 2.090 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000170 XRWORCGTLWQSQY-YHEJKZAPSA-N 440.500 2.024 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccn3ccnc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845977 FKHFCFMLIJYSEV-INIZCTEOSA-N 447.455 2.483 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(C)n1 1844607716 CCBLIYLWRNTGIX-UHFFFAOYSA-N 431.496 2.308 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc(O)cs3)CC2)cc1OCC 732262310 UOVOITXVUVHIGH-UHFFFAOYSA-N 440.543 2.398 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 732922941 IHZJWWWYTRJVKI-UHFFFAOYSA-N 434.518 2.012 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NCCCCN1CCN(c2ncccn2)CC1 734527555 YPTSGLGTSRHASA-UHFFFAOYSA-N 425.581 2.253 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1cnc(C2CC2)nc1 737107946 RJQRRISTAGPXEG-UHFFFAOYSA-N 449.433 2.464 10 20 IECD Cc1cc(C(=O)CN2CCO[C@H](C(F)(F)F)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739923699 WOHBSLCIHCVMFJ-SFHVURJKSA-N 445.463 2.187 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 741741862 MNOKHQWLAYJZPJ-LJQANCHMSA-N 441.557 2.047 10 20 IECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CN(C)C3=O)c2C)c1 749366012 YWIMENLDDGENPL-UHFFFAOYSA-N 429.498 2.436 10 20 IECD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(Cl)c1 751213231 LHENFYQACHBNDE-UHFFFAOYSA-N 445.906 2.284 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 753295777 ZUVUQWNBBAZDHR-GOSISDBHSA-N 445.585 2.141 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 756161242 UKNCRZXZSHQZIF-UHFFFAOYSA-N 435.427 2.074 10 20 IECD C[C@@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc([N+](=O)[O-])ccc1O 756712961 RKAPUAKBGYCSTI-CVEARBPZSA-N 428.493 2.247 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1)c1ccc(N2CCOCC2)cc1 758980728 CHHJNCJOCDZDMD-OAHLLOKOSA-N 438.463 2.059 10 20 IECD O=C(NCCCSc1nccs1)NCC1CCN(S(=O)(=O)C(F)F)CC1 759577893 BABOEUNUCSFGEO-UHFFFAOYSA-N 428.552 2.189 10 20 IECD O=C(COC(=O)c1ccn(C2CCCC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 764163131 LZAJRVMEPGFEIP-UHFFFAOYSA-N 430.480 2.447 10 20 IECD CS(=O)(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)ccc1F 766198962 BJUAXKIWOVALMH-UHFFFAOYSA-N 438.296 2.176 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1cnn(C(F)F)c1 768002141 HLUINMJSCBWMSZ-UHFFFAOYSA-N 447.364 2.389 10 20 IECD COc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)cc1OC 768442988 VEHWUPGAPQDZSY-UHFFFAOYSA-N 432.542 2.405 10 20 IECD CC[C@H](C)[C@@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771062537 ASLYIZHBBBGGDT-SGTLLEGYSA-N 437.474 2.238 10 20 IECD O=C(NCCc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774653564 MRFZWXLFCISNQB-UHFFFAOYSA-N 433.911 2.415 10 20 IECD CCN1CCOC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775013073 MOEALEPRIKIAGB-JLTOFOAXSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC)cc3OC)CC2)cc1 778239591 UBRLKUFPSDGRHC-KHPPLWFESA-N 439.512 2.234 10 20 IECD COC(=O)[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 781343222 CKBBWUBPYQNYLU-FVJLSDCUSA-N 435.540 2.473 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 782104631 HSBPCCCLFSLCIH-UHFFFAOYSA-N 445.541 2.307 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2 785191467 BJEXQBGQXQRUCW-UHFFFAOYSA-N 446.301 2.428 10 20 IECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccnn1C 788112909 YARORSIOONLULY-AZUAARDMSA-N 426.565 2.361 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1ccccc1F 788320227 NUYUZSBFOSTZKX-IBGZPJMESA-N 429.492 2.252 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCN(Cc2cscn2)CC1 788934105 SMLDBGAUZVXKPF-UHFFFAOYSA-N 427.574 2.094 10 20 IECD CN(C[C@H]1CCCOC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951219 ULBLVCSGGFRDRO-OAHLLOKOSA-N 443.466 2.043 10 20 IECD CCOCC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 799558377 GEJMUWFGEHQGFR-UHFFFAOYSA-N 434.514 2.284 10 20 IECD CC(C)Cn1c(N)c(C(=O)CN(C)Cc2ccc(N3CCCCC3)cc2)c(O)nc1=O 800709703 QINKFNBJZHFNHX-UHFFFAOYSA-N 427.549 2.492 10 20 IECD CCCCCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662528 COOLIBPMVRYSBF-GOSISDBHSA-N 434.556 2.443 10 20 IECD CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803747258 POGUYUWOSLNWBN-OAQYLSRUSA-N 438.572 2.071 10 20 IECD CCN=c1nc(NC(C)(C)C)[nH]c(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 804613863 OQZZJBBURABNQM-UHFFFAOYSA-N 445.568 2.288 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(C(C)(C)O)cc3)CC2)cc1 806728124 IJZHNDSFGWJJJB-UHFFFAOYSA-N 425.529 2.278 10 20 IECD CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C(C)(C)O1 806951276 DVQOYVGAOMQEIJ-OAQYLSRUSA-N 442.604 2.297 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C1 807101688 AOBLILCXKDJGJY-QFBILLFUSA-N 432.565 2.439 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(OC)c1OC 807387116 ZVSZTGRLMHTVDS-UHFFFAOYSA-N 439.262 2.435 10 20 IECD C[C@H](O)C[C@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769739 VKWWDUGGEYHHSN-YQQAZPJKSA-N 425.476 2.135 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC(O)(c4ccc(F)cc4)C3)CC2)cc1 811995555 SQZZSUXMMHGILS-UHFFFAOYSA-N 442.535 2.259 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 917715649 SIYQWKVBGMARAE-UMVBOHGHSA-N 431.430 2.466 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 918286822 KMKVQCMGAKVPEF-HUUCEWRRSA-N 442.491 2.054 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c(C)n1-c1cccc(Cl)c1 920101287 PLLFVAVABJMZNZ-UHFFFAOYSA-N 434.905 2.304 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3ccc(C)s3)CC2)cc(OC)c1OC 1323876282 WIELDGPTNLMDST-UHFFFAOYSA-N 433.530 2.161 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nn1C 1799006682 XJUHJRYPCPLZNA-IDHPPYADSA-N 448.527 2.027 10 20 IECD CC(C)(C)CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806311346 FMUHGFBXRZMTDR-KXBFYZLASA-N 448.614 2.384 10 20 IECD O=C1CCCN1CC(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809563970 KNKCGTAWYLNDKO-UHFFFAOYSA-N 449.935 2.218 10 20 IECD NC[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)c1ccccc1 1809881361 WAVUZGLMNXOQCF-IBGZPJMESA-N 438.528 2.080 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(=O)C2CC2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811797293 RFRHRKPNAKQUFC-RDTXWAMCSA-N 443.887 2.445 10 20 IECD C[C@H](CN)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804306 UZFCCWDLONETGC-DFHBCGBQSA-N 432.908 2.061 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3ncon3)sc2C1)c1cc(O)c(O)c(Cl)c1 1821027746 GFOGNQGIPUNFBQ-MRVPVSSYSA-N 435.849 2.130 10 20 IECD O=C1CC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)C1 1823713503 NPYBITGCVCSHTI-SNVBAGLBSA-N 435.889 2.413 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ncc(Cl)cn2)CC1 1825683376 ABGXLSKCLZVPCN-MRXNPFEDSA-N 445.907 2.483 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccc(C)cc4)n3N)CC2)cc1 3555601 VSRCXNHECBAGMC-UHFFFAOYSA-N 438.557 2.417 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H](C)NS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 726562484 OBUVOUQLTWMLBB-INIZCTEOSA-N 447.557 2.156 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCC(CCO)CC1 730120823 VEXHRFRBNAPZNL-UHFFFAOYSA-N 442.539 2.246 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1OC 731855897 FRRUSTHULGOYMR-KRWDZBQOSA-N 434.514 2.130 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H](C)CS(C)(=O)=O 732993162 CFOPONBGFDIRGB-HRCADAONSA-N 429.558 2.404 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)cc1 739923031 BXNGXZHSXHMGIE-UHFFFAOYSA-N 435.521 2.194 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742804158 SWSOWNHEICKURD-HNNXBMFYSA-N 439.484 2.263 10 20 IECD O=C(CN1CCN(C[C@@H]2CCOC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749853379 YPVDWBXFPVUCKS-KRWDZBQOSA-N 433.508 2.055 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4cccc(F)c4F)CC3)CC2)cc1 754044820 ZQZZHEZOYSWKOG-FQEVSTJZSA-N 446.542 2.279 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OCC(F)(F)F)cn1 765225302 COJMKNPSTBFACJ-UHFFFAOYSA-N 443.447 2.188 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(C4CCOCC4)c3C)CC2)cc1 766339852 SCSVLLKKZRHUTB-UHFFFAOYSA-N 441.576 2.494 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)[C@H]4CCCN4C)CC3)cc2)CC1 766971539 PMAASXDPFBWULA-JOCHJYFZSA-N 427.593 2.371 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC)cc3F)CC2)cc1 778323704 JTNLTHYDDZUIOY-MDZDMXLPSA-N 427.476 2.364 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCC(N4CCS(=O)(=O)CC4)CC3)c2C)cc1 779455610 XPGKYWZDXOVXNO-UHFFFAOYSA-N 445.585 2.438 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1I 785294207 LONASWKOIKSWAO-JTQLQIEISA-N 440.237 2.388 10 20 IECD Cc1nc2ccccc2n1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785494908 CNOLDHJWJWFGCO-LJQANCHMSA-N 436.512 2.374 10 20 IECD C[C@H](OC(=O)C(C)(C)S(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785983907 KJSKLTPQDRVCAH-LBPRGKRZSA-N 443.477 2.155 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(F)c(S(C)(=O)=O)c3)cc2F)CC1 786113738 AAPOIEHLRNKCCC-UHFFFAOYSA-N 437.512 2.440 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OC(C)C 787219455 XCYUMWYBELSZRR-UHFFFAOYSA-N 441.528 2.252 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)C(=O)NC4)cc2F)C[C@H](C)O1 788792073 VEZUGZYZQOPYII-GJZGRUSLSA-N 427.476 2.378 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)CC2)cc1 788894022 VWWNDGOLCDKNFC-UHFFFAOYSA-N 448.564 2.107 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)cc2F)C[C@@H](C)O1 789824563 IYEVOERECABEAC-RWQYCXNXSA-N 447.551 2.375 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 790906267 WGVYMRYBPHPKAH-DOTOQJQBSA-N 447.532 2.466 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCc4sccc43)cc2)C1 793734134 QFEQFCQNGTXPEC-QFBILLFUSA-N 440.569 2.260 10 20 IECD Cc1cc(CO)oc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 801422485 PZKXNWJGLIYGEI-UHFFFAOYSA-N 446.481 2.175 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCC(=O)OC3CCCCC3)CC2)cc1 801552616 PIGAAVLHFFRWAV-QXMHVHEDSA-N 443.544 2.282 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc1F 803664198 GMEMVZSETXNBAY-IBGZPJMESA-N 440.519 2.319 10 20 IECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)Oc2ccccc21 803685718 IVHWHTHXCQCQFU-HXUWFJFHSA-N 436.556 2.431 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C2CCN(C)CC2)CC1 804009461 UVVPWCZXXHXGEP-UHFFFAOYSA-N 443.636 2.164 10 20 IECD COc1ccc(CN2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 807291081 FOXULFKOVJPFAX-UHFFFAOYSA-N 448.567 2.422 10 20 IECD CCOC(=O)C(C)(C)Cc1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809465832 ZQEWSYLUFUCLBE-UHFFFAOYSA-N 430.505 2.101 10 20 IECD O=C1/C(=C/c2ccc(-n3cncn3)c(F)c2)SC(=S)N1CCCN1CCOCC1 824025929 FCWXYTSRCONWLC-BOPFTXTBSA-N 433.534 2.330 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)cc2F)C[C@H](C)O1 917712203 VWEPWNDVHOUPBX-HOTGVXAUSA-N 446.523 2.310 10 20 IECD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340124 LPGHFXYBVMFFTC-WSUXWNOTSA-N 432.586 2.259 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(Cc2csc(C)n2)CC1 1255149252 SPESMJULWSJNEA-SFHVURJKSA-N 447.557 2.365 10 20 IECD Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1780678992 MENAWRCBVGQJFG-YFTVHVBSSA-N 438.480 2.269 10 20 IECD Cc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)c1 1787580888 ZHYYHGAWWNVKPM-RFUYNDQBSA-N 445.903 2.362 10 20 IECD C[C@H]1CCc2c(C(=O)N3CCC4(CCCN(C(=O)c5cc(O)nc(O)c5)C4)CC3)n[nH]c21 1810551277 GJBXYACFHRWGJI-AWEZNQCLSA-N 439.516 2.424 10 20 IECD Cc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834112457 WVRHTIXTGWAAIG-UHFFFAOYSA-N 444.557 2.362 10 20 IECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 726277400 NCUXLHVHJGZKLS-VQTJNVASSA-N 432.565 2.026 10 20 IECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726600884 KLYUUVAHDKZKDW-QGZVFWFLSA-N 447.504 2.119 10 20 IECD Cc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1C(N)=O 729060436 SHQHKBQLIRRZFH-UHFFFAOYSA-N 446.454 2.419 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)NC)cc2)cc1F 731356884 YJFGODBMGBETAV-UHFFFAOYSA-N 429.539 2.059 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cc2)CC1 734702300 VNZVMTYSVFPZGW-UHFFFAOYSA-N 437.588 2.453 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958319 RDYVOWRCUGMTBP-WJOKGBTCSA-N 444.553 2.421 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(O[C@@H]4CCOC4)CC3)cc2F)CC1 748627921 PVEFRSRZIPVFAI-HXUWFJFHSA-N 434.556 2.447 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 752722726 RGPRDQVAPVGENG-QGZVFWFLSA-N 443.475 2.379 10 20 IECD CCc1nc([C@H]2CCCCN2C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)no1 754013317 ROIZMTNCDUNWDX-PZJWPPBQSA-N 429.565 2.351 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccccc3C[S@](C)=O)CC2)cc1 762647306 HWARCGNJOOHREG-PMERELPUSA-N 429.542 2.297 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc4c(cc3=O)CCCC4)cc2F)C[C@@H](C)O1 768518148 YQPFKWOHDGRCLL-IYBDPMFKSA-N 428.508 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc(N4CCOCC4)cc3)nc12 775254364 HNFLFOXOIICPTE-HNNXBMFYSA-N 425.489 2.299 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ncc(C)c(OC)c3C)CC2)cc1 778252974 XSTJHAORDPVGTP-MDZDMXLPSA-N 438.528 2.237 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(CCc4ccccc4)CC3)CC2)cc1 779215133 HAHAKYFPMIQOLT-RUZDIDTESA-N 438.616 2.038 10 20 IECD Cc1noc(C2(C)CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)n1 781367660 FMRNVGCOPLIIBT-SFHVURJKSA-N 440.548 2.343 10 20 IECD O=C(c1cccc(Cl)c1)N1CC(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 781522950 HWUHBEAMAWJHGJ-UHFFFAOYSA-N 449.960 2.121 10 20 IECD COC(=O)CCSc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785295285 SNUPKOJHIRZMJA-CYBMUJFWSA-N 432.498 2.439 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c[nH]c4nccc(Cl)c34)cc2)CC1 786122748 YGIRWQWPZBRAPX-UHFFFAOYSA-N 447.948 2.363 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 787853133 VTDQTAAZSQKRIE-HXUWFJFHSA-N 437.588 2.258 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCN(c2ccccc2)CC1 788018178 ZEMIYDUFLZBZHZ-HXUWFJFHSA-N 449.599 2.012 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(CC4CC4)CC3)cc2F)C[C@H](C)O1 788486803 YUZYOAKPNWKPTM-IRXDYDNUSA-N 446.567 2.046 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 788938268 QNDXSJYAJFBCJY-UHFFFAOYSA-N 441.963 2.296 10 20 IECD CC(C)(C)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789843437 LFSHMHCFJXQTLX-OXQOHEQNSA-N 435.540 2.113 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCSC[C@H]3c3cnn(C)c3)CC2)cc1 790262271 JGKOUVMCQHFVSU-NRFANRHFSA-N 444.605 2.050 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3CCO4)cc2F)CC1 796799811 CINGUSIHVUPODO-UHFFFAOYSA-N 426.492 2.157 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(Cc2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803297243 OFUCLDHGFLBFCN-FQEVSTJZSA-N 436.556 2.045 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCc2ccccc21 803912023 FJQQNRSUYSBFFK-IBGZPJMESA-N 436.556 2.049 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 804319696 RXAXAHVVWYXPEM-UHFFFAOYSA-N 434.540 2.473 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)Nc1cnn(CC(=O)N2CCOCC2)c1 806321292 CWMUIADUZFCYIX-UHFFFAOYSA-N 428.276 2.076 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC3C[C@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 806901277 HMSUOHURFPJCRH-HZPDHXFCSA-N 433.549 2.302 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 807100132 KPHDBIUVBFUULD-UHFFFAOYSA-N 429.952 2.070 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 807372923 QJOPOUNMANKZFL-LJQANCHMSA-N 428.920 2.286 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1NC(C)=O 807385793 QVSNMNUMKGMTSM-UHFFFAOYSA-N 436.262 2.377 10 20 IECD COCC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOCC1 810193180 SHCMEJZRGDDWEA-UHFFFAOYSA-N 443.523 2.002 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](n4cc(C)cn4)C3)CC2)cc1 811994993 JXSKZRSITFHUQU-NRFANRHFSA-N 426.565 2.369 10 20 IECD O=C(CNS(=O)(=O)c1c(F)cccc1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364827 NXWZWZHICCPJJB-HNNXBMFYSA-N 440.468 2.157 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCCCO1 920418507 ZIQMWXWYNPLWNT-GOSISDBHSA-N 428.512 2.311 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NNC(=S)Nc3cccc(F)c3F)cc2)CC1 1319432352 LGZOGQXZTTYSMZ-UHFFFAOYSA-N 441.529 2.214 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cn[nH]c3)cc2)CCC1 1788741099 GHNHJBPFKVNBTQ-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccns3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242051 JDMFQWGGLHFZLW-WBIUFABUSA-N 437.905 2.115 10 20 IECD N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1cccc(Cl)c1 1796073526 OQSZBZGAICQFJK-RCJHGTSTSA-N 430.892 2.098 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc([N+](=O)[O-])o1 1804283143 HNAVSNGXUHXTGN-JHQOCODQSA-N 443.412 2.270 10 20 IECD CC(C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805650884 HJNNHSINGDVFQI-XZXOBPBMSA-N 432.517 2.065 10 20 IECD CC(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195334 LWQIVKJHJPCKQK-FLUIGGAXSA-N 447.513 2.310 10 20 IECD C[C@H](NC=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740270 MEQKQQNMLZZWEJ-GUYCJALGSA-N 437.924 2.119 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)ccc2O)CC1 1830761819 RSJHWQZJJPDTPA-GOSISDBHSA-N 441.484 2.451 10 20 IECD O=C(CSc1ncccn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501111 AVBSSJHUUPKZTL-UHFFFAOYSA-N 434.905 2.151 10 20 IECD C[C@H](Cc1ccncc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1845763101 YJQGQHLTNZOSDY-GOSISDBHSA-N 445.523 2.257 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727102518 FAJWJSWANZQSFV-UHFFFAOYSA-N 447.337 2.007 10 20 IECD O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1nc(-c2cccc(-n3cnnn3)c2)cs1 727249199 SJRVDLUCXQEJRY-UHFFFAOYSA-N 429.443 2.495 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(C(=O)c2sccc2-n2c(C)ccc2C)CC1 728888756 FGQNLPSJSIULFD-SFHVURJKSA-N 432.590 2.455 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C(=O)OC4)cc2F)CC1 730269151 PUTNNMBPVSXMFB-UHFFFAOYSA-N 433.505 2.117 10 20 IECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 731615021 ZKBLLGDLJUKZDF-UHFFFAOYSA-N 447.419 2.087 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(CN2CCOCC2)c1 732062141 RLLMSBLMYDQXQI-UHFFFAOYSA-N 429.542 2.006 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@](C)(c2cccc(OC)c2)C1=O)c1ccc(OC)cc1 733794007 KXDCFFXKHPCCAF-JOCHJYFZSA-N 426.473 2.029 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1N1C(=O)CCC1=O 743956400 STKYYNNVXBGDKD-UHFFFAOYSA-N 435.480 2.488 10 20 IECD Cn1ncc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1C1CC1 747124200 LOOBTQWKPSBWSX-UHFFFAOYSA-N 435.507 2.483 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](C)N3CCc4sccc4C3)CC2)cc1 758208511 GSRLHSQQBYIFRA-UGKGYDQZSA-N 444.645 2.276 10 20 IECD Cn1cc([C@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 766762809 GUQRNLYOAQMFJY-PGRDOPGGSA-N 445.539 2.318 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)COc3ccc(OC)c(C)c3)CC2)cc1 768148661 DDYBAAROZRSGOH-UHFFFAOYSA-N 428.485 2.283 10 20 IECD O=C(CN1C(=O)NC2(CCCCC2)C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771052589 IDWUOKRBADIHNQ-QGZVFWFLSA-N 448.951 2.381 10 20 IECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2nc(O)nc(O)c2c1 771056805 GWVVUCFATQTAHI-AWEZNQCLSA-N 429.864 2.189 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 775255912 TUFJSHVZBRYGPK-SFHVURJKSA-N 440.544 2.280 10 20 IECD CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C[C@@H]1COc2ccccc2O1 779219392 LYUODGLCOSWZLQ-FYYLOGMGSA-N 441.572 2.340 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@H](C(=O)NCC(F)(F)F)C3)CC2)cc1 779555234 DWMNIHONNUXNKU-AWEZNQCLSA-N 428.455 2.374 10 20 IECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781443344 MTKPXBDYFOTNEQ-UHFFFAOYSA-N 443.475 2.436 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 782535354 KMAMAAFVTOJDLX-UHFFFAOYSA-N 446.573 2.414 10 20 IECD CC(C)C[C@@H]1C(=O)NCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783744690 ZEQDIEQCSFJZGI-OAHLLOKOSA-N 437.543 2.241 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(O)nc(S)nc4c3)cc2)CC1 788004438 VSWXQHBYZPLDAV-UHFFFAOYSA-N 437.525 2.223 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](c2ccsc2)O1 788324887 ZGBZNCXCMXUPDA-UZLBHIALSA-N 429.542 2.190 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H](C)C1 789823390 DLLALMVHIJEIKK-WKRCXCSHSA-N 448.583 2.244 10 20 IECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2c(O)ccc(Cl)c2F)CC1 790966564 GHZVHGHORISPPP-UHFFFAOYSA-N 427.929 2.411 10 20 IECD C[C@@H]1CN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 797356783 FRYQSPWECJMYNC-JCQPUDPBSA-N 436.420 2.390 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(N2CCOC2=O)cc1 803583339 JQYCAEJLBHAQFX-AWEZNQCLSA-N 428.464 2.342 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@@H]3CCc4ccccc43)CC2)cc1 803747503 RPZKZYLEYJGHQU-HSZRJFAPSA-N 436.556 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@@H](O)c3ccc(C)cc3)CC2)cc1 804467193 ATCCYYLQIDRZSV-YIQHDIKQSA-N 437.540 2.447 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1cc2c(cc1OC(F)F)OCO2 806276248 LOZCDYONMGROCZ-UHFFFAOYSA-N 445.469 2.388 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 808229084 ZPNVFLVOGDVEIL-QGZVFWFLSA-N 442.482 2.161 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)Cc3cnc4ccccc4n3)nc12 815463864 XQEAODXZNUAGNP-ZDUSSCGKSA-N 435.440 2.477 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(c2nc(O)n[nH]2)CC1 816471487 GNSRASGKTCRXSX-UHFFFAOYSA-N 449.514 2.098 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 906477779 IOEUVSVSNGMQPG-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc1 914470878 REQFCYLWONRKAN-UHFFFAOYSA-N 447.495 2.134 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 914687417 JKCTZZZWXZKIKG-GOSISDBHSA-N 433.578 2.152 10 20 IECD CCCC(=O)NC1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 916197413 YLQGOQCYIPDYCD-UHFFFAOYSA-N 445.608 2.298 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1 917371638 MKOVZNMFLYETGA-UHFFFAOYSA-N 440.468 2.136 10 20 IECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 919765845 LZRIWQOCDKNKQS-UHFFFAOYSA-N 428.880 2.091 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(CN2C(=O)CCC2=O)cc1 919970719 BBLKRBRRKBJHBJ-UHFFFAOYSA-N 439.487 2.366 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2csc(-c3ccc(C(N)=O)cc3)n2)c1 920637785 IKFNJXGGUGCYHQ-UHFFFAOYSA-N 447.494 2.343 10 20 IECD C[C@H](NC(=O)N1CCCC[C@@H]1CCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 920921779 SROVIOIQGDTEAX-FXAWDEMLSA-N 438.594 2.088 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1=CCCS1 1803634915 USZGTNDBTIXQOQ-AUUYWEPGSA-N 426.498 2.228 10 20 IECD O=C(CCCn1cccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813450281 XAZCRGNHXLIFEW-FDDCHVKYSA-N 449.511 2.489 10 20 IECD O=C(Cn1cc(Cl)cn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817502037 KOVKELRLMFXCPY-CQSZACIVSA-N 445.867 2.072 10 20 IECD O=C(c1cccc(O)n1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426712 BBIOFXVEQIFMMU-QGZVFWFLSA-N 426.473 2.141 10 20 IECD N[C@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccnc1 1842978050 YAKSTANQQVODQZ-MRXNPFEDSA-N 430.892 2.053 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)cc1 730570697 KLHYJWOCIRBYBM-SFHVURJKSA-N 448.589 2.181 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)c1 734072528 FMLOGRZWVCTVPT-UHFFFAOYSA-N 446.463 2.254 10 20 IECD Cc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 736623509 LYLGBOFPYWBDNP-HXUWFJFHSA-N 438.572 2.289 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3c(F)cccc3F)cc2)C1 741081123 LLYXIVGVVSFCTJ-HNAYVOBHSA-N 432.471 2.199 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCCN(C(N)=O)C2)NC(=O)OC(C)(C)C)cc1 742751415 UNJSOKVDNKHFGN-FUHWJXTLSA-N 433.553 2.225 10 20 IECD FC(F)Oc1ccc(N2CCC[C@H](NC(=S)NCCCN3CCOCC3)C2)cc1 743016574 XLZWQHXBWALOAQ-INIZCTEOSA-N 428.549 2.443 10 20 IECD COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 744474050 NZRURKYUKDVFTO-AWEZNQCLSA-N 449.459 2.419 10 20 IECD NC(=O)NC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745905935 SPVJYYSFNWJGFZ-LSDHHAIUSA-N 425.480 2.347 10 20 IECD C[C@H](OC(=O)c1cccc(=O)n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 757750797 YPUMKHUODUNVPS-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD C[C@@H](CO)CCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760834601 PIXMKNSKPGCFOH-CYBMUJFWSA-N 437.474 2.240 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765925697 JUMMHTWUOBWOKS-UHFFFAOYSA-N 434.290 2.040 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)c1 769542673 LBBYGSHFDGIXOP-KRWDZBQOSA-N 427.457 2.485 10 20 IECD Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 769748714 JXOLIAKDPFCQAZ-MRXNPFEDSA-N 435.527 2.226 10 20 IECD COCCCS(=O)(=O)N1CCN(C(=O)c2sccc2-n2c(C)ccc2C)CC1 770334446 PXHHWZJQIJDQSD-UHFFFAOYSA-N 425.576 2.280 10 20 IECD COc1cc(N2CCN(C(=O)NCC3CCN(C4CC4)CC3)CC2)cc(OC)c1OC 770622407 QJAJEIMLQPTNMI-UHFFFAOYSA-N 432.565 2.418 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Cl)ccc1CS(C)(=O)=O 775286873 DBZFBQQWCKJPHJ-UHFFFAOYSA-N 433.891 2.178 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 775433466 DLFHGUBMYSKPJL-FQEVSTJZSA-N 429.565 2.413 10 20 IECD CN(CCCNCc1cc(Br)cc(Br)c1O)S(C)(=O)=O 775981793 MYQZNRPWARFVSZ-UHFFFAOYSA-N 430.162 2.288 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 779475828 LUUUVEBRUBAVME-DJWKRKHSSA-N 428.919 2.359 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H](c1ccc(C)cc1)n1cncn1 785440773 CELPBKSYVQPZAA-YADHBBJMSA-N 434.544 2.453 10 20 IECD C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785896854 GTAWNUXAIHWSKG-MRXNPFEDSA-N 443.519 2.246 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 786655139 DRNIAGCKQNQTJF-WIYYLYMNSA-N 428.577 2.256 10 20 IECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 787155844 GRJXJSKRAXQQPI-CALCHBBNSA-N 443.519 2.423 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1 788585471 VNYHJDPBVJMISO-FUHWJXTLSA-N 436.503 2.116 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 788909816 HUKJLKVPUAFVAC-LJQANCHMSA-N 440.931 2.478 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C4CCOCC4)C3)cc2F)C[C@@H](C)O1 789823729 FNHNKYDVDSQORR-QKLQHJQFSA-N 447.551 2.331 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1Br 795141866 YMYPVOYFLQJGFT-VHSXEESVSA-N 433.259 2.165 10 20 IECD CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCc2ccc(OC)cc2O)CC1 797389663 SBHFLAZLLJXCEX-UHFFFAOYSA-N 446.935 2.451 10 20 IECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1F 806857201 NXCUVIMKMPEGCI-QGZVFWFLSA-N 426.492 2.345 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O 808542444 KPPGEVRHIVVAAH-SFHVURJKSA-N 439.512 2.451 10 20 IECD CCOC(=O)[C@H](CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(C)=O 816889663 HKCWLGABEBWXQU-MRXNPFEDSA-N 430.423 2.317 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccnc3N(C)C)cc2F)C[C@@H](C)O1 919139109 ACMQXQCQJBVLKP-IYBDPMFKSA-N 444.507 2.374 10 20 IECD C[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F)c1ccc(N2CCOCC2)cc1 920887258 CBCCTYUHABZTEL-HNNXBMFYSA-N 435.521 2.404 10 20 IECD COc1ccc(/C=C2/SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1OCC(N)=O 1115954387 IQMKAFOQWRJJFT-CXUHLZMHSA-N 443.506 2.064 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(Cc4cccnc4)c3)cc2)C1 1323498696 RMWLUDAMLMEDRM-IBGZPJMESA-N 433.516 2.350 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cnc[nH]3)cc2)CCC1 1787350312 KGWKPSFDKQTOBB-UHFFFAOYSA-N 429.527 2.018 10 20 IECD CC(C)N1CCC(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1 1810546664 IQLQLRPWQWKVPC-UHFFFAOYSA-N 444.576 2.458 10 20 IECD Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817843756 YEHMCBZBTFRYCC-QGZVFWFLSA-N 436.472 2.468 10 20 IECD Cc1ccncc1CCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842053167 RRUQLLPIIMTLMJ-QPJJXVBHSA-N 437.496 2.356 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@H]3Oc4ccccc4NC3=O)CC2)cc1 9833543 LKUDCMXNNANHST-JOCHJYFZSA-N 438.528 2.113 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CN(C)C3=O)c2C)cc1 19113422 DVFHUOIYOZIJNH-UHFFFAOYSA-N 427.457 2.113 10 20 IECD CCn1c(=O)[nH]c2cc(C(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)ccc2c1=O 108898718 IPAALBZASIZUOZ-UHFFFAOYSA-N 447.539 2.494 10 20 IECD COc1ccc(N2CCC(NC(=O)C3=NN(c4ccc(F)cc4)[C@@H](C(N)=O)C3)CC2)cc1 110475052 GQGZWANHMDIBGH-OAQYLSRUSA-N 439.491 2.040 10 20 IECD Cc1c(CNC(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)n(C)c2ccccc12 472236670 BMPRDUKRSRBNBU-UHFFFAOYSA-N 436.578 2.069 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3nnnn3-c3ccccc3)cc2F)C[C@H](C)O1 730579710 FJLLDMGGAKJODU-HOTGVXAUSA-N 439.495 2.414 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3[C@H](O)C(F)(F)F)cc2F)C[C@@H](C)O1 732201863 PSJSCMPORVXERD-MKKLKVPQSA-N 447.473 2.443 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@H]3CCCN(c4ccccc4)C3=O)CC2)cc1 734489033 RDFGBSSDNLXCBY-QHCPKHFHSA-N 436.556 2.471 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)Nc3cnn(CC(=O)NCCN(C)C)c3)c2C)cc1 741712770 DBISSZHXCOISJK-UHFFFAOYSA-N 438.532 2.229 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CN(CC)CC(F)(F)F)C3)nc12 747967163 LNUOBTMKQPRTFC-ZDUSSCGKSA-N 429.443 2.318 10 20 IECD CCN(CC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1 748305855 PPOYFNGADVWDEQ-MRXNPFEDSA-N 436.534 2.033 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(Cl)ccc1-n1cnnn1 749408036 ZGLPPZXZOFYDJZ-UHFFFAOYSA-N 430.871 2.346 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 749643932 MNIFQESULOSZFH-CYBMUJFWSA-N 435.502 2.368 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1F 753911561 OBUHEPGGOFBLTC-INIZCTEOSA-N 441.507 2.044 10 20 IECD COCCOc1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 757856440 RZQOFHIWAZRWFZ-HXUWFJFHSA-N 425.529 2.272 10 20 IECD CSc1ccccc1NC(=O)CN(C)C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759591378 HGGPKCIMKKKQFY-CSKARUKUSA-N 430.482 2.473 10 20 IECD COc1ccc(CN2CCCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 759596464 VOOJMJGHHHQZFS-POHAHGRESA-N 440.496 2.397 10 20 IECD C[C@H](OC(=O)c1coc(C(N)=O)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759769833 XCJHBAUQZOWWAF-NSHDSACASA-N 432.388 2.338 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765113971 XIOBFBUYDYCYDH-UHFFFAOYSA-N 447.485 2.478 10 20 IECD CCN(CC)S(=O)(=O)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768217104 MUGDAZXUILVVDE-UHFFFAOYSA-N 439.582 2.289 10 20 IECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 768320312 FVQBEHQPDAVNAT-INIZCTEOSA-N 434.514 2.170 10 20 IECD O=C(NCCN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)c1ccccc1F 769342914 PFDGZGJFHCYHIU-UHFFFAOYSA-N 444.526 2.349 10 20 IECD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 771631375 VCLZHXREGYNCOL-GOSISDBHSA-N 435.521 2.237 10 20 IECD CC[C@H]1CN([C@@H](CC)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 773734524 SCLLJHVXTFTGEJ-GMAHTHKFSA-N 432.609 2.213 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 773742004 OLQHTCZYZFRUKA-GOEBONIOSA-N 435.521 2.051 10 20 IECD O=C(CNc1cc2c(cc1F)NC(=O)CC2)NCc1ccc(N2CCOCC2)c(F)c1 777623808 MIDFCZAZJCHUNB-UHFFFAOYSA-N 430.455 2.414 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)N2CCN(C)CC2)cc1 784029709 FRLPFXSOFIHCMV-UHFFFAOYSA-N 438.528 2.157 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)N(C)CCC4)cc2)CC1 786122550 SUKOLTOQRVCVMR-UHFFFAOYSA-N 442.585 2.216 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccco1 789799718 KRGPTTBUZXFPON-FQEVSTJZSA-N 446.523 2.071 10 20 IECD CC(C)CSCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840110 DBKSEBNORGZKFH-UHFFFAOYSA-N 425.570 2.299 10 20 IECD CN(C)c1ccc([C@H](CNS(=O)(=O)C[C@@H]2CCCO2)NC(=O)OC(C)(C)C)cc1 795248654 ITALETORSIKDHY-ROUUACIJSA-N 427.567 2.417 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 795814958 IEDZECRORMKVLA-UHFFFAOYSA-N 447.557 2.019 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)NC[C@@H]1CCCCO1 802144549 RXJPNGYMUFBOKH-SFHVURJKSA-N 427.567 2.192 10 20 IECD CCC(CC)NC(=O)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCOC 802433233 OAIOEQWJQBGNNJ-UHFFFAOYSA-N 448.543 2.317 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(OC[C@@H]4CCCCO4)CC3)ccc21 803687951 SNJCADZVSRRWPO-NRFANRHFSA-N 429.561 2.262 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386564 ASFFLMICPJZMSV-UHFFFAOYSA-N 425.210 2.335 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](c2nc(O)n[nH]2)C1 808777918 ZXFXKIPJZPQKOX-UONOGXRCSA-N 445.479 2.492 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@H]3CN(CC)c4ccccc4O3)nc12 917064597 JDMRYFILNLMBGS-INIZCTEOSA-N 425.489 2.331 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(N2CCNC2=O)CC1 917162091 WGWNVWHHEVXKQN-HNNXBMFYSA-N 446.507 2.279 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 918221130 OBCRKRRCJRRGRW-NSHGMRRFSA-N 434.556 2.446 10 20 IECD Cc1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)ccc1-n1cnnn1 918294286 PBVAVOWRFKXXSG-UHFFFAOYSA-N 432.440 2.437 10 20 IECD CCn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cc1C 1782007077 IRSCMPGCCKRSDW-OAQYLSRUSA-N 448.907 2.033 10 20 IECD O=C(Cn1cnnn1)NC1(c2ccc(NC(=O)c3cc(O)c(O)c(Cl)c3)cc2)CCC1 1790775644 LSWBMJLRVZOYQX-UHFFFAOYSA-N 442.863 2.186 10 20 IECD O=C(Cc1ccccc1O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729368 STHCWYUFJMBEOR-ZDUSSCGKSA-N 440.481 2.123 10 20 IECD CCn1nc(C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845026 UWLIDJGGZZGYJD-HNNXBMFYSA-N 439.476 2.360 10 20 IECD CCN(CC)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccccc1 1843250805 QCBCCQGIURLWDK-NRFANRHFSA-N 438.528 2.393 10 20 IECD CCC(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251703 RUGWPGVXYCGZMR-MRXNPFEDSA-N 447.532 2.147 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CSc3n[nH]c(N)n3)c2C)c1 10716064 DWMTXFRTFMYBKW-UHFFFAOYSA-N 443.485 2.343 10 20 IECD COc1ccc(CCS(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 12069057 NPHSQJWWEGBXFU-UHFFFAOYSA-N 447.601 2.378 10 20 IECD CCNc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c1cccc2nsnc12 19101301 IDXFLEPGXAKGIC-UHFFFAOYSA-N 441.560 2.174 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)N2CCOc3cc(N(C)C)ccc32)c1 434240079 PKNWNJNTNFPJIQ-UHFFFAOYSA-N 431.514 2.049 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 728984740 SVZWYGHZLXDPHN-MRXNPFEDSA-N 448.541 2.232 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 729785942 DATYSVSMHBYGFB-KRWDZBQOSA-N 439.512 2.445 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCCc3ccc4nc(O)[nH]c4c3)nc12 730373866 BWBHEUCHDLHDJB-UHFFFAOYSA-N 439.428 2.260 10 20 IECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCN1C 745738072 SMSMJLDPTWWFDR-MJGOQNOKSA-N 441.555 2.224 10 20 IECD C[S@@](=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 747545047 RKDWNAPDDUDFRB-MUUNZHRXSA-N 439.534 2.120 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1 748482613 VSWLTQPWSOMAQG-UHFFFAOYSA-N 445.523 2.364 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC(OCCO)CC1 757625792 XHCXPSANXAZUQP-UHFFFAOYSA-N 431.455 2.225 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3cccc([N+](=O)[O-])c3)CC2)cc1 758738850 SKAMVWPHZVCOIB-UHFFFAOYSA-N 427.505 2.267 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)NN1CCCC1=O 762643305 ZLOMICAVFPGXLU-XYOKQWHBSA-N 440.344 2.304 10 20 IECD CCC(CC)NC(=O)[C@@H]1CN(S(=O)(=O)c2cccc3nonc23)c2ccccc2O1 765074207 CJCXANVQJHTERU-KRWDZBQOSA-N 430.486 2.484 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)c4c(C)nn(C)c4C)n3)CC2)cc1 771069528 WNHOWXPPXUFRPH-HNNXBMFYSA-N 438.532 2.472 10 20 IECD COc1cc(Br)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1C(=O)O 772864452 INQRSYSOCAQZIB-UHFFFAOYSA-N 446.231 2.361 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC2CCN(c3ccc(OC)cc3)CC2)c1 772961509 VNWDMSCTTOYDAO-MRXNPFEDSA-N 446.573 2.189 10 20 IECD CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](CNC(=O)OC(C)(C)C)C1 775426976 NGYYNCPWAGJLHS-LJQANCHMSA-N 431.581 2.419 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](OC)c3ccccc3)cc2F)CC1 786652912 CCUJNHJYMGZTNK-QFIPXVFZSA-N 442.535 2.088 10 20 IECD C[C@H]1CCCN(CCCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 787914269 YNKNXWLVOUHJCE-PMACEKPBSA-N 430.593 2.329 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 788936352 KKEBYBOHOANPHC-ZRZAMGCNSA-N 432.568 2.493 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 790835064 IKCHMIJKKUJDQI-QGZVFWFLSA-N 446.529 2.392 10 20 IECD Cn1ncc2c1C[C@H](C(=O)NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)CC2 798405188 CCTRRSZLCQYGME-GOSISDBHSA-N 449.534 2.097 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1)c1ccc(N2CCOCC2)cc1 803310621 MKNPLKSSPMIXAN-IOMROCGXSA-N 441.528 2.408 10 20 IECD Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)c2ccc(C)c(O)c2O)c1 804894023 RBWYWOLGBPUOOC-UHFFFAOYSA-N 443.319 2.185 10 20 IECD CN(C)C(=O)C1(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CCCC1 806265592 OUJKWZVVECEUMO-UHFFFAOYSA-N 428.577 2.400 10 20 IECD O=C(NC[C@H]1COC2(CCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806691283 AOUQSWYQLNBANT-OALUTQOASA-N 432.517 2.092 10 20 IECD COCCNC(=O)c1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807513865 XGOLBZXLOGWWGR-UHFFFAOYSA-N 440.283 2.330 10 20 IECD C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CN1C1CC1 807770558 MOQGTUYYTHWHQB-BZUAXINKSA-N 436.503 2.114 10 20 IECD COc1ccc(N2CCCN(c3nnc(C(=O)NC(C)C)n3C[C@H]3CCOC3)CC2)cc1 812423697 XBTKMONCHXIZFQ-GOSISDBHSA-N 442.564 2.178 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 915598090 MHSPVJXBGNOTLD-UHFFFAOYSA-N 447.532 2.377 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 917916762 BHCOZWSQKHVGGB-UHFFFAOYSA-N 437.493 2.108 10 20 IECD O=C(Nc1cccc(N2CCOC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295324 DLJRDKIRRUCNJX-IBGZPJMESA-N 439.468 2.495 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 918308235 HTKVNLRRACHEKN-UHFFFAOYSA-N 428.464 2.218 10 20 IECD Cc1occc1C(=O)NCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919479390 KNJAHHYFYBSNRA-UHFFFAOYSA-N 446.415 2.275 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)c3cn(CC(=O)N(C)C)nn3)c2C)c1 920642884 XXZDCTQDWWWXSF-UHFFFAOYSA-N 437.500 2.430 10 20 IECD CN1CCN(c2ccccc2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 1318781949 MYQOEXYSMCYLJR-HXUWFJFHSA-N 435.572 2.070 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccccc3Cn3cncn3)CC2)cc1 1320226104 UYUDAXSWNGSUQH-UHFFFAOYSA-N 427.530 2.236 10 20 IECD Cc1ccc(NC(=O)N(C)C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 1330878284 BGZAXIIRVSKODX-UHFFFAOYSA-N 444.557 2.253 10 20 IECD Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)n1 1785969410 NZWUVTZJVLIMPL-RFUYNDQBSA-N 445.903 2.362 10 20 IECD Cn1cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1796219122 UWQKLGAKXZPZQG-MUJYYYPQSA-N 432.908 2.369 10 20 IECD Cc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)s1 1796734434 IEARHJUAYSKECP-DRXBFXEBSA-N 437.905 2.033 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc(F)c1)CC2)c1cc(O)nc(O)c1 1816720400 QNNXJPYFZHHJIQ-LLVKDONJSA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(F)cn2)[nH]n1)c1cc(O)nc(O)c1 1817845020 UVDZDFLWZKALIP-INIZCTEOSA-N 440.435 2.299 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCOC3)sc2C1)c1cc(O)c(O)c(Cl)c1 1827175964 ARCSPKZMUVBEDY-KOLCDFICSA-N 437.905 2.470 10 20 IECD O=C([C@@H]1CCCSC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442896 BOPKHHMWUDUESZ-MRXNPFEDSA-N 426.542 2.126 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3nc[nH]c3c2)C1 1844052851 YKDASYBGWUHSPT-UHFFFAOYSA-N 442.479 2.173 10 20 IECD Cc1c(CNC(=O)C(=O)NCC2(N3CCOCC3)CCCCC2)n(C)c2ccccc12 550326061 SGIWHQKDCBDFEU-UHFFFAOYSA-N 426.561 2.254 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCNC(=O)Cc3cccc(F)c3)CC2)cc1 726709793 SNGGUGZWSOCGJH-UHFFFAOYSA-N 428.508 2.461 10 20 IECD C[C@@H](C1CC1)N(C)S(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727452665 RDMWPIBFZVUJTK-INIZCTEOSA-N 448.568 2.007 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 731283541 CFGAWMFRSPJZQQ-UHFFFAOYSA-N 436.490 2.201 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)cc2F)C[C@@H](C)O1 732572308 SNUIBUWFGNOIHZ-IOASZLSFSA-N 446.445 2.402 10 20 IECD NC(=O)CCNC(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 733631087 DDPZYLBOYUXCGL-LJQANCHMSA-N 440.500 2.211 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(F)c1 737139368 OFMVPWXNSQIZRS-UHFFFAOYSA-N 429.448 2.298 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnc(C(C)(C)C)nc3)cc2F)CC1 737188561 SKLZAIASEDZMOT-UHFFFAOYSA-N 442.539 2.310 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1 742528604 OUKKWBVGGLVEHA-UGESXGAOSA-N 437.496 2.037 10 20 IECD CCN(CC(=O)Nc1ccc(C)c(S(=O)(=O)N2CCOCC2)c1)c1ccc(OC)cc1 746109078 JCIQEGIAZFNXOQ-UHFFFAOYSA-N 447.557 2.490 10 20 IECD CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cccc(OC)c2O)cc1 751306152 RGQMWGZNEIYJLC-UHFFFAOYSA-N 428.532 2.421 10 20 IECD C[C@@H](O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752652450 FTJSVODVNKONTP-IEBWSBKVSA-N 442.539 2.387 10 20 IECD COc1cc(NC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc(OC)c1 754458622 GFOYKFOEIWSKKR-UHFFFAOYSA-N 449.529 2.498 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ccncn3)cc2F)C[C@@H](C)O1 755633771 PHJKCLUMRHOXEW-IYBDPMFKSA-N 430.480 2.022 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)cc(F)c1O 756704520 GWLXFNIXWDKQNH-AAEUAGOBSA-N 439.347 2.433 10 20 IECD COc1cc(N2CCN(C(=O)C3CCN(c4cnccn4)CC3)CC2)cc(OC)c1OC 759221253 RHKAMTFZMYAGME-UHFFFAOYSA-N 441.532 2.068 10 20 IECD CS(=O)(=O)NC1(CNC(=O)NCc2cccc(Br)c2O)CCCCC1 765444093 DAZBHMHFWWIJTC-UHFFFAOYSA-N 434.356 2.206 10 20 IECD Cc1cc(Cl)ncc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 766366801 ORIHWQNERKJICC-HNNXBMFYSA-N 429.908 2.000 10 20 IECD COc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OCC(N)=O 768911105 BZGYEOPJASVILR-KRWDZBQOSA-N 447.919 2.313 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(CCN2CCCC2)c1 769992989 IGHNNRSGZHCUEX-UHFFFAOYSA-N 436.556 2.416 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCC1(CO)CCCC1 771300353 MUCVILXTBOGQCA-UHFFFAOYSA-N 442.539 2.294 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 776491023 JUSDHERGCWXLGJ-UHFFFAOYSA-N 435.477 2.074 10 20 IECD O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 777458554 GGEZMDTZIQAJEM-OAHLLOKOSA-N 430.496 2.450 10 20 IECD COC(=O)[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 781343554 CKBBWUBPYQNYLU-LZJOCLMNSA-N 435.540 2.473 10 20 IECD C[C@H](c1ccccc1)N(C(=O)C(=O)Nc1cnn(CC(=O)N(C)C)c1)c1ccc(N)cc1 783485649 JYRHPRCYZWEQMC-MRXNPFEDSA-N 434.500 2.286 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C3CC3)[C@H](C)C3CC3)CC2)cc1 785528245 PGEYUWSGHAFBPE-GOSISDBHSA-N 428.577 2.113 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1 786116080 CNLHPZSPRDLZRB-UHFFFAOYSA-N 426.517 2.163 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CO)Cc3ccc(C)cc3)CC2)cc1 786116661 LVVLAXVTGQGGQO-NRFANRHFSA-N 426.561 2.028 10 20 IECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC12CCCCC2 788931847 JUNBENTXGOQSCB-UHFFFAOYSA-N 426.561 2.297 10 20 IECD CCN(C)Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789799726 PRQVQXIBHZHVOU-UHFFFAOYSA-N 442.535 2.047 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]3(C)CCCO)cc2F)C[C@@H](C)O1 789823081 YRKSLTKPDNSWEM-QZMQVMSPSA-N 435.540 2.209 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)O[C@]4(CCO[C@H]4C)C3)cc2F)C[C@@H](C)O1 790369505 PXCCHKKMVAHEBS-JIWZOFCXSA-N 449.567 2.324 10 20 IECD CCS[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793727929 WMYPGSSGSACZMM-YZGWKJHDSA-N 446.617 2.185 10 20 IECD CCC[C@H](C)[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793729336 ZSCGMRDYYGEKLC-CUWPLCDZSA-N 428.577 2.432 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743040 QXVKJWGHZRUIIL-AUSIDOKSSA-N 438.572 2.428 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(C(=O)OC)c(OC)c3)c2)CC1 799184988 UYQXXENBKWMRMH-UHFFFAOYSA-N 433.530 2.425 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCc4cc(F)ccc43)CC2)cc1 802546468 LAOZBHLAGCNRQJ-UHFFFAOYSA-N 440.519 2.052 10 20 IECD CC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 804326422 SFAZETJPOJHUTA-UHFFFAOYSA-N 447.498 2.313 10 20 IECD C[C@H]1COCC[C@@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977732 XSJORMYTWGLNBN-PKOBYXMFSA-N 442.539 2.414 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](C)C[C@H]3C)CC2)cc(OC)c1OC 806192032 PSHMDMVSQSHFQB-JFIYKMOQSA-N 433.549 2.302 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]1C 807097116 LSBDLNHDMZAUAC-DLBZAZTESA-N 432.565 2.439 10 20 IECD CO[C@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1(C)C 808854651 GTSUVUDVQDDPBQ-SQJMNOBHSA-N 442.604 2.155 10 20 IECD CCOC(=O)C(CC)(CC)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 817082109 MZJDLUBIDMTSJN-OUKQBFOZSA-N 431.533 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)CCC4CCCC4)CC3)CC2)cc1 914573978 VKXXCZFCWSXHLQ-UHFFFAOYSA-N 442.604 2.458 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(NS(C)(=O)=O)cc1 916381061 QIXASOHMBHEYDO-UHFFFAOYSA-N 432.546 2.236 10 20 IECD COC(=O)c1c(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[nH]c(C(C)=O)c1C 917708338 FSUUAZFSAFPVBR-UHFFFAOYSA-N 431.464 2.147 10 20 IECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917930829 VSDTWZMDCFOKLW-INIZCTEOSA-N 432.502 2.083 10 20 IECD C[C@@H]1Sc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2NC1=O 918337934 HKNDAJHCQWOCAP-AWEZNQCLSA-N 445.566 2.284 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(N2CCOCC2)cc1 920925645 KRIXGWOFXQCVIB-ZDUSSCGKSA-N 430.892 2.091 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3cccnc3)cc2)CC1 1324997974 HFNROAHBACCQCN-DEOSSOPVSA-N 435.572 2.421 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3cccnc3)cc2)C1 1338887567 MPCJYFRTDTXQQK-GGAORHGYSA-N 435.572 2.454 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1 1814162382 RVYFWEOHGZGWOZ-ULMKCPKDSA-N 441.459 2.276 10 20 IECD CC1(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CCC1 1814185230 NPJVJZINCOSTIA-YJBOKZPZSA-N 446.598 2.138 10 20 IECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cc(O)n1 1827427275 KBRPRWSTEXFAJO-GOSISDBHSA-N 440.500 2.449 10 20 IECD CC(C)/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840626889 MPPMSLRWJJFEQY-SHTLVRLNSA-N 438.908 2.033 10 20 IECD O=C(O)COc1ccc(Br)cc1/C=C1/SC(=S)N(CC(=O)O)C1=O 3803867 YWLSEXNOUYBXIJ-ONNFQVAWSA-N 432.273 2.198 10 20 IECD Cc1c(CNC(=O)N2CCN(C[C@@H]3CN(C(C)C)CCO3)CC2)n(C)c2ccccc12 472286870 WWHXHSAFGAGRLY-HXUWFJFHSA-N 427.593 2.423 10 20 IECD COc1ccc(N2CCC(NC(=O)CCNS(=O)(=O)c3ccc(F)cc3)CC2)cc1 726562527 KZAXVEHAENYKMU-UHFFFAOYSA-N 435.521 2.288 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1Cl 726727502 HWYJMNRDSOJBLG-UHFFFAOYSA-N 444.919 2.432 10 20 IECD CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 730121195 JTRIAGBJBDXGRU-ROUUACIJSA-N 445.564 2.197 10 20 IECD CN(C)c1ccc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 732933944 NPJQZYDUUVPOJM-LJQANCHMSA-N 432.502 2.130 10 20 IECD CS(=O)(=O)Nc1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1F 739767467 CLVASCAYYHRHJS-UHFFFAOYSA-N 434.493 2.151 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)N(C)CCO4)CC2)cc1 746741886 IXIWYZYFTQTUGK-UHFFFAOYSA-N 425.533 2.468 10 20 IECD CCCNC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 747836652 CENPBKFELHOVTD-WSTZPKSXSA-N 448.583 2.294 10 20 IECD CNC(=O)Cc1noc(COC(=O)c2ccc3c(c2Cl)C(=O)c2ccccc2C3=O)n1 750313152 LFJXGSIJTRRTNV-UHFFFAOYSA-N 439.811 2.144 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(CCNS(=O)(=O)c3ccc(C)cc3)CC2)c1O 750819372 AHGOZSYCDZGORG-UHFFFAOYSA-N 449.548 2.138 10 20 IECD C[C@@H]1OCC[C@]1(C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 753123552 VXTLVXYTWUMLFG-AOMKIAJQSA-N 428.512 2.309 10 20 IECD O=C(COC(=O)c1ccoc1Br)NCc1ccc(N2CCOCC2)c(F)c1 773539704 CGQKFUFAWSEHTK-UHFFFAOYSA-N 441.253 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4cncn4)CC3)cc2F)C[C@@H](C)O1 778226261 PXHPCFFSOWXVJE-HDICACEKSA-N 444.555 2.059 10 20 IECD O=C(CN1CCC=C(F)C1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 778962068 YOKIPCIZIBEZTR-RQZCQDPDSA-N 449.529 2.292 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)[C@@H](O)c2nc3ccccc3[nH]2)cc1 779620458 SXNVRJRNLSBXBB-VLCRHTCISA-N 438.528 2.231 10 20 IECD COCc1noc(CN2CCN(Cc3c(O)ccc(C(=O)c4ccccc4)c3O)CC2)n1 780491167 YCQYFYAWQIASAB-UHFFFAOYSA-N 438.484 2.176 10 20 IECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C1 784639180 RWYRVCRBPVZKHJ-LJQANCHMSA-N 427.476 2.031 10 20 IECD CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1F 785294815 NSYNQHKJNPIPEJ-GFCCVEGCSA-N 442.451 2.157 10 20 IECD Cc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789798938 GHXMLOMKCLKOHJ-KRWDZBQOSA-N 429.492 2.171 10 20 IECD CN(Cc1ccc(Cl)nc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789835797 QUNOFPRFAUEHBV-UHFFFAOYSA-N 434.899 2.110 10 20 IECD COc1cc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1C 789842576 DVCIZFYIQCVRBE-UHFFFAOYSA-N 443.519 2.079 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(-n2ccnc2)cc1 789864172 MWWZFYIXRDWWHF-UHFFFAOYSA-N 435.553 2.358 10 20 IECD Cc1cc(C)cc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793716266 AGNJHXBVOLBUDK-AZUAARDMSA-N 436.556 2.499 10 20 IECD C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793729472 ADJJVOXZVHAUGH-POAQFYNOSA-N 428.577 2.336 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@@H](N2CCCC2)C1 803448539 TXJSLMCABHDFLQ-GOSISDBHSA-N 436.503 2.070 10 20 IECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 803618095 NPSBUOIGEMVYEM-QFIPXVFZSA-N 430.593 2.252 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CNC(N)=O)C3)cc2Cl)C1 807953997 DWCKRMNVPFWEPZ-RDJZCZTQSA-N 449.983 2.099 10 20 IECD C[C@@H](OC(=O)C[C@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808687899 OQZOSIODBBWLCK-ZIAGYGMSSA-N 434.448 2.391 10 20 IECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cc(C)cc(Br)c2O)CC1 809711852 QDXYFUDDXNDEHY-UHFFFAOYSA-N 434.352 2.405 10 20 IECD O=C(CN[C@@H](C1CC1)[C@@]1(CO)CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 815289686 JEHXCPYQPLVZJS-DQEYMECFSA-N 434.492 2.310 10 20 IECD C[C@@H](NC(=O)Nc1ccccc1CN1C(=O)CNC1=O)c1ccc(N2CCOCC2)cc1 920871284 HEXCRHXAFGADQX-MRXNPFEDSA-N 437.500 2.458 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)c1 921085857 XSXMKKFIFGXBGO-GFCCVEGCSA-N 425.457 2.298 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(C(N)=O)nc3)c2C)cc1 1318028619 SBIBWRTVONDWDM-UHFFFAOYSA-N 435.436 2.414 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(Cc4cccnc4)c3)CC2)cc1 1318907328 RMUPFBGJUZIQOJ-UHFFFAOYSA-N 435.532 2.279 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1c(C)nc2cc(F)c(F)cc21 1322433144 AEWZEROZSTYXSO-INIZCTEOSA-N 433.411 2.325 10 20 IECD C[C@H]1CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1782684193 BYLQITGQKLMRDI-RSZAZKGPSA-N 431.533 2.447 10 20 IECD Cc1cc(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1 1789567507 JZFSYUMLNPOIJZ-SNRMKQJTSA-N 425.485 2.017 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nnc(-c2ccccc2)o1)c1cc(O)nc(O)c1 1798500864 ZUZAFUWZAJBDNE-MUJYYYPQSA-N 435.440 2.108 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H]1CCOC1)C1=NN(c2ccccc2)C(=O)C1 1803346341 KAOQIZNGSBQZQT-IZBJGVDFSA-N 438.528 2.234 10 20 IECD COC(OC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291605 WEVYWFUXJMXYOX-CYBMUJFWSA-N 438.868 2.399 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@@H](NC(N)=O)c3cccs3)CC2)cc1 115540911 SRAGZIBSYRBUDG-LJQANCHMSA-N 445.589 2.185 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2c(F)c(F)c(F)c(F)c2F)SC1=S 727177032 AZOCWVLWUJQSAU-GQCTYLIASA-N 432.417 2.133 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)NCc1nc[nH]n1 732116303 ICTYZXFBTJJVMM-VZUCSPMQSA-N 438.332 2.085 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 741099530 CUSTUZGVDJYZFU-HDICACEKSA-N 435.528 2.326 10 20 IECD CCN1CCN(C[C@H](C)CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 745807239 AXAYZTHKAPZMDY-HXUWFJFHSA-N 448.631 2.040 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746016097 NCILEIGARFYYTE-OAQYLSRUSA-N 435.528 2.261 10 20 IECD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)CN3CCOc4cc(N(C)C)ccc43)CC2)C1 746492167 AWMMOBXOJUMVFM-GOSISDBHSA-N 428.577 2.449 10 20 IECD O=C(Cc1cccc(F)c1)NCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749015425 XJZQIHJRIALVAE-UHFFFAOYSA-N 446.498 2.084 10 20 IECD Cc1cc(S(C)(=O)=O)cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 758577721 QPVUBBAMANHMIJ-SFHVURJKSA-N 443.569 2.339 10 20 IECD COc1cc(N2CCN(c3cc(N4CCC[C@@H](CO)C4)ncn3)CC2)cc(OC)c1OC 758936678 UNCYAORNRRSBAF-QGZVFWFLSA-N 443.548 2.038 10 20 IECD O=C(CN1CCC(Nc2ccccn2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 761120081 SONJJXYEFMLJDU-UHFFFAOYSA-N 427.524 2.250 10 20 IECD CN1CCc2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2C1=O 761724344 OVIAOFPDPIBFQB-GOSISDBHSA-N 435.528 2.338 10 20 IECD Cc1nc(Br)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 774167313 SECWDKYYAMENDR-UHFFFAOYSA-N 433.306 2.244 10 20 IECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C 778144738 ZQARKUZYMKXQHF-UHFFFAOYSA-N 429.542 2.047 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3nc4ccccc4n3C)CC2)cc1 778268736 IBXSJZYUDUQQLU-OUKQBFOZSA-N 447.539 2.445 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 782041089 GFEBZEZQBIMUPZ-ZDUSSCGKSA-N 437.474 2.070 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(Cl)ccc2N2CCOCC2)cc1 785425478 ZZXVOJGVMVMWRV-UHFFFAOYSA-N 430.936 2.175 10 20 IECD Cc1c(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(=O)n(-c2ccccc2)n1C 786482545 MRFZOOJGDORLTE-UHFFFAOYSA-N 440.569 2.009 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 787982786 MEVCZXKUHOVYAS-UHFFFAOYSA-N 428.558 2.355 10 20 IECD COC1(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCC(C)CC1 789845048 JDMFDVIGTYOTPR-UHFFFAOYSA-N 435.540 2.115 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1 789862924 YSJVKAKJCWTPSL-DYESRHJHSA-N 435.615 2.027 10 20 IECD COc1ccc(CNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c(O)c1 794387674 IVVXNUZTJRMDQF-UHFFFAOYSA-N 428.304 2.395 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCCN3Cc3ccccn3)nc12 795609080 FDCUYIIXJKHTLT-GOSISDBHSA-N 439.472 2.105 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 799251166 NNJRDEQSODUDOG-OAQYLSRUSA-N 438.528 2.268 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCN(C)C)Cc3cccs3)CC2)cc1 804317616 KDALFAKVWKCJRU-UHFFFAOYSA-N 444.601 2.432 10 20 IECD CC(C)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1=O 806259740 BVRNOZGILBXOGE-MAUKXSAKSA-N 434.968 2.318 10 20 IECD O=C(CC1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1)NC1CCCC1 806282722 RKAJIZZLJRCSQY-UHFFFAOYSA-N 438.619 2.429 10 20 IECD CC(C)(C)OC(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292812 ZHTBPOMYQUZYMJ-UHFFFAOYSA-N 428.533 2.195 10 20 IECD O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 807540669 BIYYOTPNSUOAHR-SJLPKXTDSA-N 431.455 2.346 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@@H]1CCC(F)(F)C1 807570923 WTQQEAJCQQVXNR-LJQANCHMSA-N 434.531 2.386 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807676169 CPTBLDJECBAQEW-MRXNPFEDSA-N 428.508 2.426 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 810064772 TYYXTLDXGSGBRF-UHFFFAOYSA-N 429.542 2.425 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCc1ccc(N2CCSCC2)cc1 810161356 JQOAOLPHSGZYHT-FQEVSTJZSA-N 429.590 2.353 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3nc4cc(Cl)ccn4n3)CC2)cc1 810248277 SEELJMCRCAHHJW-UHFFFAOYSA-N 429.912 2.335 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 918438465 QGABAMPQUXJSKX-UHFFFAOYSA-N 447.582 2.207 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)cc2)C1 919816659 CHKUAKWTGWJHBQ-IRXDYDNUSA-N 426.483 2.279 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(CCNS(C)(=O)=O)cc3)CC2)cc1 1323193629 REUFRXQUTJXJRZ-UHFFFAOYSA-N 431.558 2.139 10 20 IECD O=C(CCN1CCCCC1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810542872 CRWIAVDEBNHGDH-UHFFFAOYSA-N 430.549 2.214 10 20 IECD CCc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)co1 1811009034 NTMXJHFFSPOUDV-JLTOFOAXSA-N 437.456 2.072 10 20 IECD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)o1 1815387818 XJHKGRDRLPRCNO-ZDUSSCGKSA-N 447.542 2.477 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3cncn3c2)[nH]n1)c1cc(O)nc(O)c1 1817846429 WYEOFVBYFSPCPR-QGZVFWFLSA-N 447.455 2.483 10 20 IECD Cn1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)cn1 1823708805 PJFCUCWQLIBTOL-LLVKDONJSA-N 447.904 2.481 10 20 IECD Cn1cc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426407 UFUSGRMOCIRNPF-IBGZPJMESA-N 441.532 2.092 10 20 IECD C[C@@H](Oc1ccccc1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038362 OQTRCIHAKVDFOF-PXUDHTSWSA-N 438.480 2.488 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)N2CCOCC2)o1 520766488 BXMPVNVPOPTFQV-OAQYLSRUSA-N 438.528 2.194 10 20 IECD CCOC(=O)c1ccc(N2CCCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)nc1 725799311 UDMUFYBTMJOBGK-UHFFFAOYSA-N 439.560 2.153 10 20 IECD COc1cccc(CNC(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c1O 729861115 CVUQPNDSWXDIRX-INIZCTEOSA-N 433.486 2.477 10 20 IECD Cc1cc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)nc2c1c(=O)n(C)c(=O)n2C 737779617 KFJIVWFBRXLKLS-UHFFFAOYSA-N 435.528 2.203 10 20 IECD COc1ccc(CC[C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3)C2=O)cc1 749601120 CFNCTZGWEGWPMC-DEOSSOPVSA-N 438.528 2.321 10 20 IECD CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 755329702 ZOIBKIFPGVWWTA-UGSOOPFHSA-N 449.485 2.334 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 758225229 XXBUNQKPFDHZKQ-FQEVSTJZSA-N 438.488 2.045 10 20 IECD CCO[C@H]1COCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760044847 DEYVTMFHUYFQBA-ZBFHGGJFSA-N 426.516 2.178 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c1 760918062 JTBOUSQBWMZSAR-WMLDXEAASA-N 435.521 2.484 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(CCC=C(C)C)C3=O)CC2)cc1 764588911 FPXIIPTVUOFAPC-HSZRJFAPSA-N 428.533 2.401 10 20 IECD Cc1cc(NC(=O)NCc2cccc(Br)c2O)n([C@@H]2CCS(=O)(=O)C2)n1 765236068 WFHXNRYBKCLVHR-GFCCVEGCSA-N 443.323 2.341 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)NCCC(N)=O)cc1 769280561 IAOOHZIYCBKWQX-JOCHJYFZSA-N 432.524 2.427 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1 771054956 WRFORQWBRFLQRB-MAUKXSAKSA-N 443.997 2.188 10 20 IECD CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)cc1 772692681 BCHXAPWDSCYOIJ-UHFFFAOYSA-N 447.503 2.139 10 20 IECD O=C(NCc1ccc2c(c1)OCO2)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774410596 YWRYBQGFDPWELU-HNNXBMFYSA-N 447.438 2.418 10 20 IECD C[C@@H](NC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(N(C)C)cc1 775404274 MJFHRLGKGJADGH-IERDGZPVSA-N 435.528 2.480 10 20 IECD Cc1ccc(N2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)cc1 784389110 LLGKPPPCELDKJW-UHFFFAOYSA-N 426.536 2.409 10 20 IECD CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788936307 JWTRDHGNEYDTII-UHFFFAOYSA-N 440.491 2.179 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc2F)C[C@@H](C)O1 789824576 JIIJRYVEXCVNJJ-REWKAPCFSA-N 433.524 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccc(Cl)nc3)cc2F)C[C@@H](C)O1 789828754 YHSUHWWAJDDGLZ-GASCZTMLSA-N 448.926 2.463 10 20 IECD Cn1cccc1[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841119 RWDMMTLKBKMCOY-OAQYLSRUSA-N 428.508 2.105 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@@H](c2ccsc2)C1 789841230 VHBRIYPUIBAKLD-HXUWFJFHSA-N 447.532 2.065 10 20 IECD CCOc1ccc(NCc2cc([N+](=O)[O-])ccc2O)cc1S(=O)(=O)N1CCOCC1 796403419 YGCIYJOLQFVFIZ-UHFFFAOYSA-N 437.474 2.332 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 803298632 VUPFLZSRAVHXBP-UZLBHIALSA-N 429.517 2.360 10 20 IECD CN(C)CCN(Cc1ccc(F)cc1F)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664450 JIZOWXWLWPSBPZ-UHFFFAOYSA-N 436.478 2.377 10 20 IECD C[C@@H](OC(=O)[C@@H](O)c1cccnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954875 ZWWAFVJDHJTFFS-XCLFUZPHSA-N 430.416 2.461 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 807768438 JRAKZYDLDMPDHN-AXUOBQJMSA-N 437.487 2.447 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O 808542522 NRFLQKWKUOEYHL-KRWDZBQOSA-N 425.485 2.061 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cn3nc(C(F)(F)F)cc3C)CC2)cc1 811244249 KLWBUPAUMZSFMG-UHFFFAOYSA-N 440.422 2.111 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(Cc4ccco4)CC3)cc2F)C[C@@H](C)O1 917020179 DNAXPEFSUZRGQQ-RTBURBONSA-N 444.551 2.466 10 20 IECD Cc1ccc(S(=O)(=O)N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 917708633 LOCRMCHGNZZKNH-UHFFFAOYSA-N 449.548 2.216 10 20 IECD COc1ccc(N2CCCN(C(=O)NC[C@]3(N4CCOCC4)CCSC3)CC2)cc1 918006386 KQAHJIKUVWAONF-JOCHJYFZSA-N 434.606 2.125 10 20 IECD Cc1nn(C)c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1[N+](=O)[O-] 920661427 QIHPAMLFWLLTAS-UHFFFAOYSA-N 448.391 2.208 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 920787328 PUPLPGWUICLYLS-LJQANCHMSA-N 426.469 2.254 10 20 IECD O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 921199912 AIOXZDMTBUIBDF-UHFFFAOYSA-N 435.521 2.326 10 20 IECD CC[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 985207357 GUGXUSPYJFWQTI-LUMDGCDRSA-N 425.489 2.382 10 20 IECD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)nc2ccccc12 1777876106 FZZJANULECRVQR-XMMPIXPASA-N 448.479 2.107 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)cn1)c1cc(O)nc(O)c1 1794783789 INHUCBNTLRBEGX-CLLJXQQHSA-N 434.399 2.055 10 20 IECD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccn1 1801469561 XEWRQGHJVUHBTG-NFWAQSGPSA-N 445.903 2.153 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)[C@H]3C[C@@H]3C3CC3)C2)CC1 1805363883 TYGLQRWNVSINPO-CVEARBPZSA-N 435.615 2.124 10 20 IECD COc1ccccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727501 ZDNOUCVTHWWJQR-GFCCVEGCSA-N 440.481 2.498 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccccn3n2)[nH]n1)c1cc(O)nc(O)c1 1817845495 NIXQTGVLMQZGGC-KRWDZBQOSA-N 447.455 2.483 10 20 IECD COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827423637 AUQCYIPQFFPKGV-SFHVURJKSA-N 440.500 2.444 10 20 IECD COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nc1 1827427609 NAWXAZJZWKZCAP-LJQANCHMSA-N 440.500 2.444 10 20 IECD O=C(c1cc2ncccc2[nH]1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442194 DIAHFNPQSUISKS-UHFFFAOYSA-N 442.479 2.173 10 20 IECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 726712724 ALXLTNOOPAWTMT-ROUUACIJSA-N 432.565 2.237 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1 728980262 YZRUDDMPFXNJRJ-YOEHRIQHSA-N 434.514 2.349 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1 729037399 UMDQZJKXMVJMAU-CQSZACIVSA-N 435.502 2.304 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCNC(=O)[C@H]3c3ccccc3)cc2F)CC1 730135361 WFEKFUDXSZPGGH-JOCHJYFZSA-N 439.535 2.350 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 735196367 YWZVWWQQWFMCJQ-NGFNCXNUSA-N 434.514 2.112 10 20 IECD O=C(CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)N1CCCCCC1 740919633 FEHRLCISEMFFSN-UHFFFAOYSA-N 425.577 2.293 10 20 IECD C[C@H](O)C[C@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 741081375 OTJJFRGDODROHI-IRXDYDNUSA-N 430.528 2.149 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1C(N)=O 743975036 LHXHTUGMNJLRKP-OAHLLOKOSA-N 446.454 2.419 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCOc1ccc(S(C)(=O)=O)cc1 746517919 UJHGADWTQDQVKQ-UHFFFAOYSA-N 432.542 2.354 10 20 IECD NC(=O)c1cccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 748023701 DLDBWSASQJCEDN-UHFFFAOYSA-N 431.495 2.283 10 20 IECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407150 SUEUDASUGFUUMS-KRWDZBQOSA-N 448.499 2.244 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O 749729897 DPAQPCFHKHOHPL-UHFFFAOYSA-N 432.527 2.029 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN(C)CC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 749835945 LUDJEACZRGHYRL-IBGZPJMESA-N 445.585 2.129 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 750296498 JVNNAIQKTWDXMJ-ZXDLDBCASA-N 434.606 2.267 10 20 IECD COC(=O)N1CCC[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060015 FMIFVIQTLUSUIL-ZDUSSCGKSA-N 439.515 2.215 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 753363806 ZFFIZGMTLVHKEZ-UHFFFAOYSA-N 444.465 2.265 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 757555891 KWUAXOQTJHQIAR-UHFFFAOYSA-N 435.477 2.115 10 20 IECD CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769734604 DGVZKQIDRJLUPK-UHFFFAOYSA-N 427.473 2.246 10 20 IECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N2CCOCC2)cc1 772526613 UHOUYTYVFDOPIO-IBGZPJMESA-N 447.561 2.018 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN([C@@H]2CCOC2)CC1 773480416 CGGACDJLQDGETM-IAGOWNOFSA-N 433.508 2.196 10 20 IECD C[C@@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 775261196 UBMGNWDYMOPUOI-OAHLLOKOSA-N 426.473 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 778232764 MEQBEFCQAWHKCQ-MDZDMXLPSA-N 446.511 2.428 10 20 IECD Cc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn(C)c1=O 781969524 FXVFBGPSLQKKRM-UHFFFAOYSA-N 434.443 2.019 10 20 IECD CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)=NN1c1ccccc1 786656719 QJOKESMHYLZTNU-DEOSSOPVSA-N 447.539 2.195 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCC(C)CC4)C3)cc2)CC1 786657214 VGLRFHPCOWCYGS-STDCAVTESA-N 440.588 2.399 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@H]1COC2(CCCCC2)O1 789859260 BOHAPEGFDSSXNK-IBGZPJMESA-N 433.574 2.048 10 20 IECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CN1CCN(C)CC1 790195849 PEEKZNNMNIUTIE-IBGZPJMESA-N 430.593 2.053 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c(C)nn(C)c3-n3ccnc3C)cc2F)CC1 793456365 RASSQMWVJLOCGF-UHFFFAOYSA-N 439.539 2.434 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794831731 PYRDFHCXBBMNAE-VBKZILBWSA-N 429.521 2.050 10 20 IECD CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 799537020 ASQBJYCEQGJCLR-KRWDZBQOSA-N 449.617 2.492 10 20 IECD COc1c(C)cnc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 803666828 KZQMLAJFEFHGMX-SFHVURJKSA-N 427.501 2.237 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 806852746 CZNPOGHJJHOKQE-UHFFFAOYSA-N 449.504 2.198 10 20 IECD COC1CCC(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 806944402 FROBEPYIBXFXPQ-UHFFFAOYSA-N 442.604 2.156 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](C)O1 807770948 QCQBSTCSLZFOAV-YQQAZPJKSA-N 425.476 2.399 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(F)(F)[C@@H](CO)C3)cc2F)C[C@@H](C)O1 812858887 FGXJGSJNAGILLE-HLLBOEOZSA-N 429.483 2.005 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3ccccc3N3CCOCC3)nc12 917064991 OVXLIOGNLADMFZ-UHFFFAOYSA-N 425.489 2.080 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCO4)cc2F)C[C@H](C)O1 918286644 JLZXYUNELLAWEB-KBPBESRZSA-N 429.448 2.423 10 20 IECD C[C@@H](Cn1cccn1)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919785328 XRHBVTKKGVEUPH-KRWDZBQOSA-N 438.511 2.027 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1(C(=O)O)Cc2ccccc2C1 1332590500 HIGNZQSTTNXXAA-UHFFFAOYSA-N 427.476 2.208 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1 1782740238 JPBSVDUEURVLPC-VHICIVCISA-N 436.917 2.070 10 20 IECD CC1=CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1797133872 ZXJDGOFQTAEQDP-UBUPODRFSA-N 442.512 2.153 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)Cc2cnc[nH]2)C3)cc1 1799620363 GUEXWLKCAQKQKA-IRJINJETSA-N 447.539 2.263 10 20 IECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nc1 1807990119 DZMVIVOSCNMWEU-IERDGZPVSA-N 433.468 2.225 10 20 IECD CCC(C)(C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814190211 UBNYEQDKWAGEPB-CRAIPNDOSA-N 448.614 2.384 10 20 IECD CC(C)N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)C(C)C 1815282484 YUDYVXHOEPFFSD-ACJLOTCBSA-N 447.561 2.198 10 20 IECD CN1CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817842780 NWZQVHCNVOHZLT-QGZVFWFLSA-N 442.520 2.254 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C1=COCC1 1822984917 MNKXTYGMQVUUBS-IBGZPJMESA-N 448.483 2.499 10 20 IECD O=C(CC[C@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823028165 IQTGTLLGQDIDKY-XJKSGUPXSA-N 429.477 2.339 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCO1)CC2 1828197559 BBELVPQQXOEAJX-AZOMNODSSA-N 445.497 2.064 10 20 IECD C[C@@H](OC(=O)CCN1CCCC1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 727911813 DNUXAFBFUIHKPT-CQSZACIVSA-N 434.448 2.345 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCCS(=O)(=O)CC1 732119234 SBYYLLKLQRSGPD-OWBHPGMISA-N 444.625 2.377 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCO)Cc3ccccc3OC)CC2)cc1 743363620 URVNKGAXDWZSSR-UHFFFAOYSA-N 442.560 2.030 10 20 IECD O=CNc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 746156135 YXDOMRMALBOCIS-UHFFFAOYSA-N 434.475 2.441 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cn(CC(=O)C(C)(C)C)nn3)cc2F)CC1 746229452 QEVOSQIAKDRONW-UHFFFAOYSA-N 430.528 2.104 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 749577901 UTFPFAGSIQCDRD-HXUWFJFHSA-N 437.496 2.173 10 20 IECD O=C(NCCOC[C@H]1CCCO1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067340 YHRBPNWRWBBFDM-CQSZACIVSA-N 426.516 2.180 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c(C(=O)OC)s1 751318200 LBDBLGYEIVAHNN-VIFPVBQESA-N 429.472 2.075 10 20 IECD O=C(NCCCSc1nccs1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1 765895429 YEDNANILGPZXCD-KRWDZBQOSA-N 434.587 2.395 10 20 IECD CCOC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 766113014 NGXVHPRWQXECEA-ZIFCJYIRSA-N 435.540 2.331 10 20 IECD O=C(Nc1cccc(-n2cnnn2)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769640794 YVEGMSKZPWJKGR-UHFFFAOYSA-N 442.482 2.483 10 20 IECD CCN1CCN(c2cccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)c2)CC1 770732979 GFQUIAMTKLPIBS-MRXNPFEDSA-N 426.517 2.359 10 20 IECD CN(C)c1ccc(CN(CCC(=O)NN2C(=O)NC3(CCCCC3)C2=O)C2CC2)cc1 771790939 JYUYZAQWLRFWSX-UHFFFAOYSA-N 427.549 2.393 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cc(Br)c(=O)n(C)c2)C2CC2)cc1 774158843 ZIODCUHEAXKIPJ-UHFFFAOYSA-N 447.333 2.344 10 20 IECD O=C(NC[C@H]1COC2(CCOCC2)O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776944683 DPUYMQOLFXGOPI-YJBOKZPZSA-N 441.475 2.478 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@@H](C)C3CCN(C)CC3)CC2)cc1 778411422 RSYRMUAOWWHRMK-YXBWYFRISA-N 428.577 2.089 10 20 IECD Cc1cc(C)nc(N2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)n1 783187699 PDENZPNGCGUSST-UHFFFAOYSA-N 442.539 2.225 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)nc12 785807463 OMLHGOZOSJBOLE-RFHZTLPTSA-N 429.351 2.011 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccc(OC)cc3)cc2F)CC1 786760733 ODVQIBSOTFMOTB-KRWDZBQOSA-N 442.535 2.470 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 787203515 QUTPDALPFRYNHR-SFHVURJKSA-N 440.544 2.457 10 20 IECD COc1ccc(C[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788318643 GTPFXLUYPRTRQH-GOSISDBHSA-N 425.529 2.143 10 20 IECD CCN(CCCN1CCCC1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789819448 MYZBPBXABBUFKY-OALUTQOASA-N 448.583 2.390 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccnc1 789847734 SYUDKNHKZZMWDT-FQEVSTJZSA-N 442.535 2.354 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@H](c2ccccc2)C1 789855142 OUCNWSBPFXTOAB-NRFANRHFSA-N 425.554 2.456 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nn(-c4ccc(C)cc4)cc3O)nc12 801369734 AKJLLOMRAVQBEM-UHFFFAOYSA-N 437.412 2.168 10 20 IECD COc1cc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 803311330 UTKDTDWPFLTTHI-SFHVURJKSA-N 425.529 2.376 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(c4c[nH]nc4C)CC3)CC2)cc1 803637584 PCYZRPIJPKFQLO-FPLPWBNLSA-N 437.544 2.338 10 20 IECD C[C@@H](OC(=O)c1ccoc1CC(N)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803941040 IXNFOISGLNFBHE-GFCCVEGCSA-N 446.415 2.267 10 20 IECD COCCCN1CCC(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 804352703 WWNOQWDWVTTZPC-UHFFFAOYSA-N 430.593 2.156 10 20 IECD O=C(NC[C@@H]1CCCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806042477 USELCRWPGTUKAX-LSDHHAIUSA-N 431.505 2.381 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1 807292392 PXGSBTQAWOAFHD-PMACEKPBSA-N 441.553 2.092 10 20 IECD Cc1ccc(N2CC[C@@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)cc1 807585888 JSZJWAHDRVQJMM-JOCHJYFZSA-N 434.540 2.474 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2cccc(F)c2)CCOCC1 919985505 JCWVOUDVGJKXAP-UHFFFAOYSA-N 446.544 2.425 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCC2)C1 1782823078 XERHKRTVWADVLF-OUWGLZAPSA-N 448.491 2.223 10 20 IECD COC(C)(C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1785896026 LPTJHSAPSVKCIN-UHFFFAOYSA-N 435.571 2.406 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(F)c3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242968 IMPBLXJIBGRMBX-JDFRZJQESA-N 449.866 2.192 10 20 IECD Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)ccc1F 1807542822 JTCWRDIXZUTIRK-UHFFFAOYSA-N 428.464 2.494 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812477969 WDRMEAPCMZKYDH-ONZODILHSA-N 449.486 2.238 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3cc(S(C)(=O)=O)ccc3C)C=C2)cc1 531809486 OYNVGLCQXODUAE-UHFFFAOYSA-N 444.534 2.381 10 20 IECD CN(CCc1ccccn1)C(=O)CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 727608212 NTAJGSVHOXUJPR-HXUWFJFHSA-N 426.517 2.179 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1 729062382 ACIVIUXDKKOQQE-ORAYPTAESA-N 427.457 2.334 10 20 IECD COc1ncc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 734049844 ZURIZPJSTZSDAL-LBPRGKRZSA-N 431.404 2.445 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(OC)c(C(=O)N(C)C)c3)CC2)cc1 734491242 AMWPBXXKKHCXSF-UHFFFAOYSA-N 447.557 2.307 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739767338 ZKIBZKSXIYPTGQ-UHFFFAOYSA-N 444.557 2.247 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCO[C@H](C(F)(F)F)C3)cc2F)C[C@@H](C)O1 739923740 XISAGWPOAZBGGQ-LBTNJELSSA-N 433.446 2.319 10 20 IECD CN1CCC(N2CCC(CCN(C)CC(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 750836666 STABUSOLPFMNFE-UHFFFAOYSA-N 429.653 2.497 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3cccnc3N3CCOCC3)CC2)cc1F 753832985 IATHFYKGVZRILG-UHFFFAOYSA-N 429.496 2.098 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 758325185 NBDPAVUPBPEILL-UHFFFAOYSA-N 440.468 2.191 10 20 IECD CCn1cc(C(=O)C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 758862768 OEWXYZSMAREWDP-CYBMUJFWSA-N 445.431 2.432 10 20 IECD CCN1CCOC[C@H]1C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 769080148 YURXGKKPTJLSSJ-KUHUBIRLSA-N 436.464 2.053 10 20 IECD CNC(=O)[C@H](CC(C)C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770120287 AMWUCPIFINBVQW-AWEZNQCLSA-N 425.532 2.145 10 20 IECD CSCC[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 773742697 ZGVJHEIBSVXSLP-QMCVQRASSA-N 434.558 2.442 10 20 IECD O=C(NCCCCCCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 775861779 VCIRGBOAGUUNSO-UHFFFAOYSA-N 437.474 2.384 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 776906138 PIFNQALWMIRJIM-QFBILLFUSA-N 445.564 2.054 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 777899739 NVYJKMWDSQRKCY-INIZCTEOSA-N 446.529 2.045 10 20 IECD CC(=O)N[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 779378690 QGZRJAVYEOYRKI-RBZFPXEDSA-N 436.464 2.493 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCNC4=O)c(C)c3)cc2)CC1 786256600 GYAMBOWOPFPRMG-UHFFFAOYSA-N 435.528 2.123 10 20 IECD O=C(NC1CCN(C[C@@H]2CCCO2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 787104059 FGIWEOXWRXXANQ-FQEVSTJZSA-N 441.528 2.274 10 20 IECD COC(=O)c1cccc(NC(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)n1 787566737 VCRBSMONUVYPNF-UHFFFAOYSA-N 444.399 2.439 10 20 IECD O=C(NCCCN1CCc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787688871 PJVXXNIPCWFSDK-NRFANRHFSA-N 437.540 2.469 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccccc1OCC(=O)NC 788067438 OEKQPCDKZCJEKY-HXUWFJFHSA-N 440.544 2.070 10 20 IECD CN1CCC([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)C2)CC1 789854489 BBXHCZRUPZFLQX-FQEVSTJZSA-N 430.618 2.046 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2F)ccc1O 790406415 PCBJWKMEHSYYBC-UHFFFAOYSA-N 428.385 2.259 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790551499 LQZSKLDTQPJRTM-ROUUACIJSA-N 440.548 2.338 10 20 IECD CN(C)c1ccc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)c(C(F)(F)F)c1 793063766 UPRMACMPHCUWCF-KRWDZBQOSA-N 435.512 2.398 10 20 IECD CCC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716281 BRNLHJAZTQJGBS-SFHLNBCPSA-N 428.577 2.480 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCCO)Cc3ccccc3)CC2)cc1 804315220 HEMJYYBKYYDYHT-UHFFFAOYSA-N 425.529 2.191 10 20 IECD O=C(Nc1cccc2c1CNC2=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 806881578 ANYGRXSHNYEXNZ-UHFFFAOYSA-N 444.438 2.255 10 20 IECD CC(C)(C)OC(=O)NC[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 807289787 JHCVEQDINVUJNK-IBGZPJMESA-N 428.533 2.099 10 20 IECD O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807841495 CGXILZCUBVFEFV-IBGZPJMESA-N 439.512 2.421 10 20 IECD COC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)c1 917180940 DXISFSUABDWQDP-UHFFFAOYSA-N 432.448 2.153 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)cc2F)C[C@@H](C)O1 917714021 LZKBBKAEXLHNRA-ZIAGYGMSSA-N 439.509 2.213 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(F)cc(F)c1)C2)c1cc(O)nc(O)c1 1777852127 CQYDZOHZNUPCIF-VGOFRKELSA-N 447.438 2.212 10 20 IECD CCc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782002840 XNQFXJWPVMPTKU-QFIPXVFZSA-N 445.903 2.466 10 20 IECD O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1cc(O)nc(O)c1 1788427440 YRLFHUMAXNZPMT-UHFFFAOYSA-N 438.400 2.186 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccnnc2)C3)cc1 1799620046 KMMSUQYWFCHDBS-IUTQVRIDSA-N 445.523 2.401 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(C3CC3)on2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992171 LKDINFSSUWQLDJ-YCRPNKLZSA-N 449.467 2.387 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccco1 1816342339 UKFOXRLRNOMGNQ-LBPRGKRZSA-N 433.515 2.169 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)C1=COCC1)CC2 1828200193 MLKKUHTZVLPXNQ-ZABGRMTBSA-N 443.481 2.190 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ncc[nH]2)CC1 1832071240 HTZMBTSNIILQBX-KRWDZBQOSA-N 427.505 2.082 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cnccc2Cl)C1 1844404237 FPLHFYIMRUCSEB-UHFFFAOYSA-N 437.887 2.345 10 20 IECD CSCC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1847841008 AZUNQSDXRUXYDU-ROUUACIJSA-N 428.558 2.370 10 20 IECD Cc1nnc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)s1 1848217422 MLVXASLUZWTQDZ-KBPBESRZSA-N 436.921 2.359 10 20 IECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)Nc1nnc([C@@H]2CCCO2)o1 727505364 XLVPVNPOCMZPNH-INIZCTEOSA-N 447.403 2.492 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](CNS(N)(=O)=O)C3)c2C)cc1C 730569941 CGXFUTZZMXLGBV-LJQANCHMSA-N 432.590 2.399 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCC(=O)Nc3ccccc3)CC2)cc1 733345613 OOYWNOABODLZEM-UHFFFAOYSA-N 425.533 2.145 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1OC 739948967 LRXNAWATNCZEPV-OAHLLOKOSA-N 434.514 2.358 10 20 IECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 743897969 XFGPCHSIZBSQJR-UHFFFAOYSA-N 439.512 2.229 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cc1F 747011789 MHRUYYYGFNAOLH-IBGZPJMESA-N 428.464 2.264 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756711115 IGELPENGVWLANO-SJLPKXTDSA-N 441.532 2.125 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc(OC)c1OC 759102490 NSHCZWASSXERDN-UHFFFAOYSA-N 448.501 2.068 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 759878623 BQXQFGDJJXJDPK-UHFFFAOYSA-N 442.497 2.240 10 20 IECD C[C@@H]1CN(C(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)C[C@H]1O 769129290 RLOBYMXOXYRQBC-DZZGNEQFSA-N 441.372 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@H](O)c3ccc(F)cc3)CC2)cc1 778389293 GCRRBYCNSDFWEI-QPZJKNBESA-N 441.503 2.277 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1 778686478 ZUQCDANHQRWOBX-CQSZACIVSA-N 434.876 2.464 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Br)c(O)c3)nc12 778828374 HUWMLGRKXPUVTB-UHFFFAOYSA-N 436.218 2.437 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1 779709564 WLDYJPVAEOXXCM-FYJQUHEMSA-N 435.524 2.446 10 20 IECD CSCC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nnc2ccccn12 785426447 ZHHVQHZKEFTGPK-QGZVFWFLSA-N 426.546 2.022 10 20 IECD Cc1nc2ccccc2n1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 785498663 ZOTGEIGHFAQQRQ-QGZVFWFLSA-N 435.528 2.175 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1coc(-c2cccs2)n1 785683530 DISCJKHSLLONKO-UHFFFAOYSA-N 426.498 2.172 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 786288097 IXPANIVSLUNZIZ-UHFFFAOYSA-N 439.512 2.478 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3ccccn3)CC2)cc1F 788632832 SHUTUVNLCJGLCY-UHFFFAOYSA-N 427.524 2.468 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 788823857 QSNTZNWTKUOQEC-PMACEKPBSA-N 436.556 2.343 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(C)nn(C)c1C 789841400 WYXFIYKUOXVIHI-IBGZPJMESA-N 445.539 2.021 10 20 IECD Cc1c(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)cnn1C 794015999 GRHKAVKJLBUIFP-UHFFFAOYSA-N 427.533 2.024 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@@H](C)O[C@]4(CCCOC4)C3)cc2F)CC1 797451628 MDSDMAALNSUFAM-WZONZLPQSA-N 434.556 2.447 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1 803130656 AFACYJOEUGPGIE-IBGZPJMESA-N 438.572 2.214 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCCN(C(=O)N4CCCC4)C3)CC2)cc1F 807458936 LKMDAOBLJPNQEU-QGZVFWFLSA-N 433.528 2.346 10 20 IECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807953893 ARERSJIECUXUBE-QGPMSJSTSA-N 434.968 2.223 10 20 IECD O=C1CCSc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 916676324 HBCGATXEZBZGNB-UHFFFAOYSA-N 445.566 2.286 10 20 IECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)N1CCC(C(N)=O)CC1 1321630291 SZPZGQLJQGJBJL-UHFFFAOYSA-N 430.549 2.188 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccc(F)c1)C2)c1cc(O)nc(O)c1 1777847572 FZROVJNEHUOIEH-WZONZLPQSA-N 443.475 2.002 10 20 IECD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)oc2ccccc12 1796903447 UWWWFPKUVFNAAX-YVWYUNDQSA-N 437.452 2.064 10 20 IECD CCOC(=O)C1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1800718806 HDJBWDGNJSBTMP-BTTYYORXSA-N 436.892 2.346 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc([N+](=O)[O-])[nH]1 1804288778 GDPXANHBPRDJNY-ITJFMEAMSA-N 442.428 2.005 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289255 ADBZWVNNMSIJOF-GJYRHAHMSA-N 448.472 2.016 10 20 IECD Cc1cc(/C=C/C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)no1 1810547141 PDMZTMKDIOIZTQ-ONEGZZNKSA-N 426.473 2.347 10 20 IECD Cc1ncsc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722410 ZXGSDTWOKIJYOO-JTQLQIEISA-N 431.499 2.254 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCCCC2)[nH]n1)c1cc(O)nc(O)c1 1817844587 FSFWREGNFVCSML-KRWDZBQOSA-N 442.520 2.398 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1823733569 XHXMMACGCIYNJD-CRAIPNDOSA-N 431.533 2.277 10 20 IECD CN(C)c1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1844938339 LAEUNAKRVAAKRZ-YRNVUSSQSA-N 437.496 2.400 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2n[nH]c3cc(Cl)ccc23)C1 1845025854 DCWZWQZDWGDUOY-UHFFFAOYSA-N 441.875 2.082 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN(c4ccc([N+](=O)[O-])nc4)CC3)CC2)cc1 726715336 NKXVFYUCUKEUCF-UHFFFAOYSA-N 440.504 2.499 10 20 IECD CCCN(Cc1ccccc1O)C(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O 727168313 NHHKTTKAPUTGJA-UHFFFAOYSA-N 432.498 2.236 10 20 IECD CN1CCCc2cc(CNC(=O)NCCCCN3CCN(c4ncccn4)CC3)ccc21 729233041 LTRAIXKAQAFGOJ-UHFFFAOYSA-N 437.592 2.261 10 20 IECD COc1cccc(CNC(=O)c2cccc(C(=O)NCc3cccc(OC)c3O)n2)c1O 729859810 WROOFJOLZZAAAP-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)C(C)(C)C)CC3)cc2F)CC1 730132452 DEJSTLIJQXWKST-UHFFFAOYSA-N 433.572 2.368 10 20 IECD Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 730386080 OCQLVHZPDPKBJA-UHFFFAOYSA-N 437.475 2.411 10 20 IECD CCc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2o1 737138671 KXUZFNNAEFSDIK-INIZCTEOSA-N 449.511 2.347 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 743872896 FEGVNDWDECOOMA-SWLSCSKDSA-N 433.368 2.011 10 20 IECD O=S(=O)(NCC(F)(F)F)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 751261304 NCKGISXBEOBTPE-UHFFFAOYSA-N 438.405 2.057 10 20 IECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753732197 RMDRNIRTYDNZPM-INIZCTEOSA-N 434.472 2.324 10 20 IECD C[C@@H](NCC(=O)N1CCN(C)CC1)c1cc(Br)cc(Br)c1O 756489667 IAMSMIZEBSTKLI-SNVBAGLBSA-N 435.160 2.342 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3nc(-c4ccccc4F)ccc3=O)CC2)cc1 758221273 WYZFQWWZQQLVMK-IBGZPJMESA-N 438.503 2.241 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)N[C@](C)(CCC=C(C)C)C3=O)CC2)cc1 758224471 VBDSHSAYSYBUOR-GBXCKJPGSA-N 444.576 2.235 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4cc(F)c(C)cc4c3=O)CC2)cc1 758231004 NAVZIZVBELOGQY-SFHVURJKSA-N 426.492 2.036 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)c1 758282574 HJINAIPGJAIUGE-UHFFFAOYSA-N 430.486 2.313 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cnc(Cl)c(C)c3)CC2)cc1 760088838 SHGBHLRYHBXBGG-UHFFFAOYSA-N 445.951 2.319 10 20 IECD COc1ccc2c(c1)[C@H](NC(=O)/C=C/c1cnn(C)c1)CCN2C(=O)/C=C\c1cnn(C)c1 760651204 YPRKGCRHGCDUJW-BQPBPNKSSA-N 446.511 2.483 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(-n4cnnn4)c3)cc2F)C[C@@H](C)O1 768510800 FCIBCQQCXCROIG-IYBDPMFKSA-N 440.479 2.110 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1N1CCCS1(=O)=O 773844703 FEASFHLUNGHXMD-INIZCTEOSA-N 444.557 2.417 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1ccc(N(C)C)cc1 773982951 VIEBDJVSYOCUEM-ZBFHGGJFSA-N 431.514 2.230 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnn(CC(F)F)c3)cc2F)C[C@H](C)O1 777899447 YLDHFCFHBLBENJ-STQMWFEESA-N 432.468 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN3Cc4ccccc4C3)CC2)cc1 778246893 RIBDGARENRUWJM-KHPPLWFESA-N 434.540 2.032 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3CCN(CC(C)C)CC3)CC2)cc1 778250085 PGNFFKOHDJIJSS-HJWRWDBZSA-N 428.577 2.137 10 20 IECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)C1=O 778262617 LSLYPVMOORTINY-CEXWTWQISA-N 448.583 2.244 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)CC2)cc1 785802049 GJBJEMVYILLENK-PSBWJHGTSA-N 442.434 2.243 10 20 IECD CN(CCOc1ccc(Cl)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321610 YIAZJCCQLUNNKV-UHFFFAOYSA-N 431.920 2.330 10 20 IECD COc1cc(F)c([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 788323261 KZZGXVDLCVCJFY-OAHLLOKOSA-N 445.491 2.173 10 20 IECD Cc1ccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789799627 NFGTVZCRJAWGLO-QGZVFWFLSA-N 429.492 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(n4ccnc4)CC3)cc2F)C[C@H](C)O1 789826662 PYGPWOUHIPUCAB-IRXDYDNUSA-N 443.523 2.116 10 20 IECD C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832563 AKEHDTDMLZXGJO-ZHRRBRCNSA-N 440.519 2.408 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1Br 797390252 BIBFHHDKRWEIGR-UHFFFAOYSA-N 437.246 2.205 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)C[C@@H](C)c3ccccc3)CC2)cc1 803747146 MJDCGNINNPTJIC-HXUWFJFHSA-N 438.572 2.196 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 804316982 PQHFYJSDYCSXIV-INIZCTEOSA-N 448.564 2.057 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1 806885693 HGXNDGHYUCNTGA-LBPRGKRZSA-N 430.436 2.276 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C2CC2)O1 807771901 YTYWRHRICDZWRD-ALKREAHSSA-N 437.487 2.399 10 20 IECD COC(=O)C1(CS(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 812500927 KDIMGHUNCYUUBR-MRXNPFEDSA-N 430.954 2.273 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917832367 VHEKDIFKIJUTIX-MJGOQNOKSA-N 430.549 2.404 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1 1322459586 RSEUVFVUKIIIOY-YJBOKZPZSA-N 434.395 2.160 10 20 IECD Cc1ccc(F)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777846398 GEDWPNCSEYWQSL-WZONZLPQSA-N 443.475 2.382 10 20 IECD Cc1cc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc2s1 1782296880 FUEJDPUJGNOKFL-OAQYLSRUSA-N 442.497 2.101 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ncccc2n1)c1cc(O)c(O)c(Cl)c1 1797572426 PAWARCDZYFFNNB-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(Cc1ccccc1O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550327 JVSVTFFAWCZDBG-UHFFFAOYSA-N 425.485 2.286 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191566 KQTJDKAQGOAOIU-SGFSRBQDSA-N 446.598 2.304 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)n(C)c2ccccc12 559693291 LHLFSEPKMXBTSO-UHFFFAOYSA-N 434.540 2.252 10 20 IECD Cc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1C[C@@H]1CCCO1 727176638 NIVGYDSYSXITCS-HEUOVEHFSA-N 443.616 2.034 10 20 IECD COCCNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1Cl 729062129 NUWQMAISRRYZAR-LBPRGKRZSA-N 449.891 2.246 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1 729232014 BWLCEKOWVXWHDF-KRWDZBQOSA-N 428.537 2.153 10 20 IECD CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 730671556 CAXSVLWYUYLKQA-HXUWFJFHSA-N 438.576 2.057 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4cc(F)ccc4F)=NO3)cc2)C1 732637426 VEYGLGRFNPOURP-YCRPNKLZSA-N 442.466 2.476 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1F 742802380 XOJWTEKLBOFUFV-CYBMUJFWSA-N 443.447 2.473 10 20 IECD COc1cccc(-c2noc([C@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)c1 743798843 QVYNPZKXBDKWRX-NSHDSACASA-N 432.458 2.313 10 20 IECD CCOc1ccc(N(CC)CC(=O)NN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)cc1 746158611 BYZNJBAEIZCKNO-QHCPKHFHSA-N 440.500 2.419 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCc2ccc3c(c2)CCCN3C)c1 746888975 FORMTHDHHGZBGO-UHFFFAOYSA-N 429.542 2.256 10 20 IECD Cn1ncc2cc(C(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)cnc21 747300806 AXWWWHCWNVEZNN-UHFFFAOYSA-N 446.490 2.154 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(Br)cc3)c2)CC1 748671983 AHCDXXQCFJEWEL-UHFFFAOYSA-N 445.360 2.485 10 20 IECD NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NCCCSc2nccs2)CC1 749731663 XLWALFFDAGEUOE-UHFFFAOYSA-N 447.586 2.082 10 20 IECD CN1CCC[C@H](N(C)C(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)C1 753924387 SUNJKNQPLFSNPT-INIZCTEOSA-N 429.502 2.190 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc(NC(C)=O)ccc3OC)CC2)cc1F 754039620 AMSUMWCNGNJPLB-UHFFFAOYSA-N 437.493 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)cc1F 754211598 HOPDYDIPPAQAJG-UHFFFAOYSA-N 442.447 2.078 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncc(F)cn4)CC3)cc2F)C[C@H](C)O1 759219982 AAEULHHSUSKZSR-HOTGVXAUSA-N 446.502 2.400 10 20 IECD CCN1CCN(CCc2noc(-c3ccc4c(c3)c(C)c(C)n4CCOC)n2)C(=O)C1=O 763312518 QVMYNULNEWZIQE-UHFFFAOYSA-N 439.516 2.188 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](c1cccc(F)c1)c1cnn(C)c1 769749764 VBEUTDMIIOSEMJ-LJQANCHMSA-N 432.477 2.498 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 772947041 QCCIAZMWXWFUQK-GOSISDBHSA-N 438.528 2.269 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@]1(CCO)CCOC1 773057251 COKKLYGBTGTIAH-GPZRYRNASA-N 426.585 2.387 10 20 IECD CCN(Cc1ccccc1)C(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 774328905 GOZHUNIFZOLCAZ-UHFFFAOYSA-N 441.528 2.410 10 20 IECD Cc1cc(C)c2[nH]cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c(=O)c2c1 776123867 RRBWQFICGRJOAV-UHFFFAOYSA-N 439.537 2.310 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 776823612 ROAONFBFJNYLHI-RTBURBONSA-N 432.565 2.190 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c(C)nn(C)c3-n3cc(C)cn3)cc2F)CC1 777655596 FEPNEYDJLJJHIA-UHFFFAOYSA-N 439.539 2.434 10 20 IECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C[C@H](O)C(F)(F)F 778202051 CMNLWYBGCXJOGS-IYOUNJFTSA-N 435.462 2.301 10 20 IECD O=C(N[C@@H]1CCC[C@@H]1CCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 779354503 BKTLOWQLIHUNNV-FZKQIMNGSA-N 449.485 2.382 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1 782785011 BQURQRCPLGJDHX-UHFFFAOYSA-N 428.537 2.250 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(OC[C@@H]2CCOC2)c1 785424002 JURZDYRVQJOOPK-LJQANCHMSA-N 425.529 2.409 10 20 IECD C[C@H]1CN(Cc2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@H](C)O1 785428854 TZLNIMZTSRFPKT-OALUTQOASA-N 438.572 2.294 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 785527021 IMRUFPUTGCEUAR-PWRODBHTSA-N 442.604 2.409 10 20 IECD CC[C@]1(C)CCCN(C(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785530025 ZKCLFPCJAQPFLT-XMMPIXPASA-N 430.593 2.362 10 20 IECD CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789839813 AMPGLBWWNAQBJT-LAUBAEHRSA-N 449.567 2.361 10 20 IECD CCN1CCN(C[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 790216553 XWASVJSKGUETRX-OAQYLSRUSA-N 443.636 2.025 10 20 IECD CCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccn1 793726135 RWKQJCLCDVXLEH-RXVVDRJESA-N 437.544 2.057 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)NCCCSc2nccs2)N2CCOCC2)cc1 793739410 BAYBTMHTFSKPTF-SFHVURJKSA-N 448.614 2.240 10 20 IECD CCn1ncc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C(F)(F)F 799251388 UGINOALDHATTTE-UHFFFAOYSA-N 439.438 2.356 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](Cn1cccn1)c1ccccc1)c1ccc(N2CCOCC2)cc1 803296334 AZLNYMSJWPQOCM-WMZHIEFXSA-N 447.539 2.455 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1 804389683 JMIHJPOZPHTEJI-MRXNPFEDSA-N 447.557 2.259 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cccc(C(=O)NC)c2)cc1F 804852648 CJSFCLWDHFMSBD-UHFFFAOYSA-N 428.508 2.007 10 20 IECD Cn1cnc2c(C(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)ccnc21 805168394 FYNJXKSLBZVSKT-UHFFFAOYSA-N 446.490 2.154 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806847210 KBZXIZDARRPKFM-UHFFFAOYSA-N 431.514 2.277 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc2nccnc2c1Br 806958214 FOFVCRFTLSWIJV-UHFFFAOYSA-N 431.246 2.101 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](CCCO)c1ccccc1 807431245 BBBWNHOMEPBWRA-JOCHJYFZSA-N 425.529 2.112 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)CCCN(C)CCN(C)C)cc2F)C[C@@H](C)O1 812009021 LJVVGGYGEKOUND-RTBURBONSA-N 437.604 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)CSCc3nnnn3Cc3ccccc3)CC2)cc1 913112485 YBGCUPAOZDXFBH-UHFFFAOYSA-N 438.557 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(-c4ccc(C)cc4)nn3)CC2)cc1 915526104 VVCIVNNHMWVCSI-UHFFFAOYSA-N 435.484 2.090 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(C)c(S(C)(=O)=O)c3)CC2)cc1 916040636 AVLMNLDIYFOBSM-UHFFFAOYSA-N 445.585 2.349 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1-c1ccc(F)cc1 916677230 SHUVNNUCTVBQHM-UHFFFAOYSA-N 442.516 2.485 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1cccc(-c2nnnn2C)c1 917439240 HLQKPUHDRILNIP-UHFFFAOYSA-N 442.526 2.465 10 20 IECD O=C(CSc1nnc(Cn2cncn2)o1)Nc1cccc2c1C(=O)c1ccccc1C2=O 921160406 UNUILWMWXWUQJR-UHFFFAOYSA-N 446.448 2.216 10 20 IECD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CC[C@H](CNC(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)C2)cc1 981836075 CPVUMUZQOBDCGL-QOTCRHDVSA-N 425.489 2.287 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)cccc1F)C2)c1cc(O)nc(O)c1 1777850842 KEBBUNUPRLRIDS-OPAMFIHVSA-N 447.438 2.212 10 20 IECD C[C@@]1(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1(F)F 1785399045 WXNNAJLQKLWGAM-ZWKOTPCHSA-N 430.835 2.240 10 20 IECD O=C(CCCn1ccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935466 MGPNUYJQJCGISH-FNLKRUPLSA-N 448.527 2.094 10 20 IECD Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807989761 CMDBCPOSSHSOEH-HRAATJIYSA-N 433.468 2.225 10 20 IECD CCC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1821910315 UKNYIKVRFTUFIF-KGXGESDWSA-N 428.445 2.211 10 20 IECD Cc1[nH]nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825607233 DBHJZWFZRHAIDG-HNNXBMFYSA-N 431.468 2.211 10 20 IECD CN1CCC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)C1 1827427654 GQUAXPFWWGPXAH-PKOBYXMFSA-N 430.549 2.068 10 20 IECD O=C(/C=C/c1cccc(O)c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442506 PJWPWIAJZFJQOF-ZHACJKMWSA-N 444.491 2.402 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2F)C1 1844711910 JSAPRVKCQCIXGQ-UHFFFAOYSA-N 437.374 2.364 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCc2ccccn2)=NN1c1ccccc1 1848264858 HSNSXIILVRINLP-SFTDATJTSA-N 431.496 2.009 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](OCCN4CCOCC4)C3)ccc21 483625491 UNJVMSNRFOLEPD-OAQYLSRUSA-N 429.561 2.468 10 20 IECD CO[C@@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 727036917 AFRJMTDZQGSQPS-LPHOPBHVSA-N 438.528 2.351 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 727672976 SMLHQFDWFQKMCB-UHFFFAOYSA-N 442.516 2.483 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)C1 728210708 MEMCFIYXZKELPK-IBGZPJMESA-N 445.589 2.126 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc4c(c3)C(=O)NCC4)CC2)cc1 735376045 MXSRAZKKPUMWNV-UHFFFAOYSA-N 437.544 2.315 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1=O 735517202 HSTZHIUZGQGPCI-HBMCJLEFSA-N 429.561 2.233 10 20 IECD CCc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1S(N)(=O)=O 735749748 CMCMMVNYKDTOES-UHFFFAOYSA-N 432.546 2.397 10 20 IECD COc1ccc(N2CCCN(C(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)CC2)cc1 742352261 TVBCKQJGWXAKPV-IRFCIJBXSA-N 432.590 2.460 10 20 IECD CCN1CCCC[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 745084061 FPMGLYDXUBRVQK-LLGFUMIMSA-N 435.540 2.473 10 20 IECD Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730684 RVZBJRVQHLXNFH-UHFFFAOYSA-N 429.527 2.345 10 20 IECD CC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)=NN1c1ccccc1 750866892 ISSKBTCQGVHRFX-WMZHIEFXSA-N 447.539 2.228 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1C 751358112 ANFGHXHUICDEBG-OAHLLOKOSA-N 441.937 2.114 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](CC(C)C)N3CCCCC3=O)nc12 756573829 JBIOFTIDVPXGBC-MRXNPFEDSA-N 432.477 2.082 10 20 IECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1F 768183910 CSGLFBUMJVMMLN-UHFFFAOYSA-N 435.550 2.403 10 20 IECD Cc1ncn(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)c1C 771562033 OLMYZYBMAIUUTM-IUXPMGMMSA-N 444.538 2.246 10 20 IECD CCOC(=O)N1CCC(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 775028472 UXUOZYNMMVIYQV-UHFFFAOYSA-N 430.549 2.372 10 20 IECD CC[C@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 776040035 ZNYMIHFMZPJWEX-YJBOKZPZSA-N 440.548 2.119 10 20 IECD Cc1ccnc2c(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cccc12 777932750 FFGTVYFCBLMKRJ-UHFFFAOYSA-N 445.566 2.257 10 20 IECD Cc1cc(Br)cc([C@H](C)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1O 779033654 YQHLSNJAVLXDPN-HOCLYGCPSA-N 426.355 2.047 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 779222435 NFFFHFMZEUYOLI-NHCUHLMSSA-N 448.608 2.119 10 20 IECD Cn1cc(-c2nc([C@@H]3COCCN3C(=O)NCc3ccc(N4CC=CC4)cc3)no2)cn1 780835955 ODFIJFHZGUOJLI-IBGZPJMESA-N 435.488 2.129 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(C(=O)C4CC4)CC3)cc2)CC1 786650980 YDEKLCXDYABRBT-UHFFFAOYSA-N 426.561 2.056 10 20 IECD CC1CCN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 787893382 DPTWGUHCNNKUEA-UHFFFAOYSA-N 430.593 2.110 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@H]1CCN(c2ccccc2)C1 788816145 QBFQWNMUDKABIY-HXUWFJFHSA-N 438.597 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@@H]3CCN(Cc4ccccc4)C3=O)CC2)cc1 789523415 ZATIOKOWRFBTNX-HSZRJFAPSA-N 436.556 2.077 10 20 IECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(F)cc1C 792970635 XFXLFZQTTAJGFL-UHFFFAOYSA-N 443.475 2.402 10 20 IECD O=C(NCCCSc1nccs1)NCCNS(=O)(=O)c1ccc(F)cc1F 799603766 LVISXZANKIRUJV-UHFFFAOYSA-N 436.531 2.181 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1 802610945 ZTEKVVNJFCNASZ-UHFFFAOYSA-N 438.484 2.211 10 20 IECD O=C(NCc1ccc(OCC2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803567737 LEDLRMXVDVMONW-FQEVSTJZSA-N 439.512 2.400 10 20 IECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)O2 806701874 NVGJFMGHZMGOAO-FYGMXOSSSA-N 446.544 2.338 10 20 IECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)Oc2ccccc21 807288011 RCEUPCOMBIFOIM-OAQYLSRUSA-N 434.540 2.425 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(N4CCOCC4)CC3)cc2Cl)C1 807953830 YUMLESYQVYGUKQ-KRWDZBQOSA-N 448.995 2.174 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1CCCN(C2CCC2)C1 808021484 PEIIWTGORBZQOU-CTNGQTDRSA-N 442.604 2.251 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN(c4ccccc4)C3=O)CC2)cc1 814642662 JGVJTROYPQLHAY-QHCPKHFHSA-N 436.556 2.377 10 20 IECD Cc1cc(C(=O)OCC(=O)N2CCN(C(=O)c3ccco3)CC2)c(C)n1-c1ccccn1 914613853 MLRAZWPCYMAFRU-UHFFFAOYSA-N 436.468 2.224 10 20 IECD COc1ccc([C@@H](O)CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 916196566 MEPAJQNELVKGFZ-QHCPKHFHSA-N 442.560 2.249 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(S(=O)(=O)NCCOC)cc1 916649113 IRNCFTRXQWODRH-UHFFFAOYSA-N 448.589 2.409 10 20 IECD O=C(CN1CCN(C(=O)C2CCCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 921192810 AAIJNWIQHMYDCQ-UHFFFAOYSA-N 446.567 2.003 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 1343519670 JLSPXDCMIOUXGM-LJQANCHMSA-N 448.541 2.277 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)n[nH]2)CCO3)cc1 1781754239 VXWRCIAQNHCILS-XMMPIXPASA-N 449.511 2.280 10 20 IECD Cn1c(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc2ccccc21 1796600835 IEQLIRFIXJGUCF-BCDXTJNWSA-N 434.496 2.479 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)c(F)c1)CC2)c1cc(O)nc(O)c1 1816727465 XLJFCXNHARABFR-LLVKDONJSA-N 444.444 2.334 10 20 IECD Cn1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c2cccnc21 1847038029 ZWTBSXTWDSBATC-SOFGYWHQSA-N 448.479 2.221 10 20 IECD COCCNC(=O)Cn1cc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cn1 607582787 NZUCWIZPUPTXGW-UHFFFAOYSA-N 427.505 2.116 10 20 IECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 726277396 NCUXLHVHJGZKLS-PMACEKPBSA-N 432.565 2.026 10 20 IECD COc1cccc(CNC(=O)CNC(=O)c2ccccc2I)c1O 727761008 HIKSBRGWSWZQBM-UHFFFAOYSA-N 440.237 2.052 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)ccc1-n1c(C)ccc1C 729833510 DCLUFUDAPOFVNN-SFHVURJKSA-N 431.558 2.168 10 20 IECD O=C(NCCOCC1CC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 731047407 NZGNUCIUYGINGH-UHFFFAOYSA-N 428.512 2.168 10 20 IECD O=C(NCCCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)cc1 732242872 PPBANMXYBUCOQF-UHFFFAOYSA-N 436.512 2.399 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1 734016952 QBGORZYXKDEFLD-AWEZNQCLSA-N 430.457 2.096 10 20 IECD CC(C)N1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1=O 734167274 QCGSCKRLFUABGM-KRWDZBQOSA-N 428.455 2.351 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)cc1 739923047 CRLSNQIDFJOTGE-JOCHJYFZSA-N 439.512 2.032 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cnn(-c4ccccc4OC)c3)CC2)cc1 742267403 UGYCKTRGLXNYQZ-UHFFFAOYSA-N 428.514 2.400 10 20 IECD COC(=O)c1c(F)ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1F 749174006 VXYNAKNCMQZGQT-UHFFFAOYSA-N 426.441 2.067 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1csc(S(N)(=O)=O)c1 753087192 ZXZGCMZANQHBPV-UHFFFAOYSA-N 439.559 2.398 10 20 IECD CC(=O)N=c1cc[nH]cc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 753472407 DKRBVDGMVKGINJ-UHFFFAOYSA-N 430.376 2.398 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)CC2)cc1 754070502 YUZZTBHJQXRLKE-TZIWHRDSSA-N 448.608 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(O[C@H]4CCOC4)cc3)CC2)cc1F 754213823 WBADOEGCLFJYBN-IBGZPJMESA-N 443.475 2.289 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(S(=O)(=O)CC)c2)cc1C 760344379 LZUDFPAAQIIPAB-UHFFFAOYSA-N 446.572 2.351 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 766201270 QHPZLVJQVKFTDB-UHFFFAOYSA-N 434.333 2.427 10 20 IECD CNC(=O)c1cccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 768521592 KZFKRVXNKUCCTL-HOTGVXAUSA-N 429.492 2.494 10 20 IECD O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCC(CO)CC2)cc1 770279056 SLBNNBYVSZRQKN-UHFFFAOYSA-N 430.570 2.492 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnn(C)c4C(F)F)n3)CC2)cc1 771064435 CIUZPWHRSUYMTJ-UHFFFAOYSA-N 432.431 2.308 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 776904864 IXRSBBAJOOHANY-OAHLLOKOSA-N 436.528 2.453 10 20 IECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 781535600 JSSYTMHFJFUAFL-UHFFFAOYSA-N 447.438 2.437 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCCC[C@H](SC)C3)CC2)cc1 785527661 MRTUFSMXSTWIBC-NRFANRHFSA-N 448.633 2.068 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1Br 786821517 XJTCRTQVEDYAKC-UHFFFAOYSA-N 432.318 2.218 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 788318634 GEZVWFBBKCHOEQ-REWPJTCUSA-N 437.540 2.424 10 20 IECD CCCc1csc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 789729236 QXWYCRKSPVWAQU-UHFFFAOYSA-N 448.545 2.409 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(F)c1 795136208 HKYYICLPOLKJLT-UHFFFAOYSA-N 426.441 2.271 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC 796674120 HKJWDTRJHZOJQT-QGZVFWFLSA-N 442.468 2.334 10 20 IECD CO[C@@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1(C)C 803448942 IUZPSGJUCDLEEP-IAGOWNOFSA-N 425.476 2.303 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1noc(Cc2ccccc2)n1 803661183 SKLVYFOWJYYQCP-AWEZNQCLSA-N 425.464 2.359 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCc2ccccc21 803912024 FJQQNRSUYSBFFK-LJQANCHMSA-N 436.556 2.049 10 20 IECD COCCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 804901049 PAAASWOMODVXKS-AEFFLSMTSA-N 436.984 2.029 10 20 IECD O=C(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Nc1ccccc1 806251364 VFQLLKMXCOHWCJ-LJQANCHMSA-N 425.485 2.045 10 20 IECD COCCn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(=O)cc1C 806513657 MFVISUFKLDOGJM-CALCHBBNSA-N 431.508 2.486 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 807098698 XYKDAFXJJGPXGZ-FCHUYYIVSA-N 425.529 2.028 10 20 IECD COC[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769392 FOMDSCPYRHIXQV-CVEARBPZSA-N 425.476 2.258 10 20 IECD O=C(Cn1cc([N+](=O)[O-])c(=O)c2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 813578777 GAGCWUPBVIDDBV-UHFFFAOYSA-N 440.431 2.202 10 20 IECD C[C@H](C(=O)N1CCN(c2ccccc2O)CC1)N(C)Cc1ccc(N2CCOCC2)cc1 857758637 PMTNRPQWGCRVJP-HXUWFJFHSA-N 438.572 2.398 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)NC(=O)[C@H](C)S4)nc12 918792411 KXPXEKPQCNEVSV-JTQLQIEISA-N 442.453 2.401 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920888671 WGOJQRHTRMOCBB-ROUUACIJSA-N 431.558 2.376 10 20 IECD C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccc(N2CCOCC2)cc1 1318090097 QFFSYAUXDYTKOQ-QGZVFWFLSA-N 432.546 2.112 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(-c2ccc(OC)cc2)n1 1337827316 ZYKSUTHRKYMDJF-SFHVURJKSA-N 425.441 2.196 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)CC1 1826647669 AYCMDYQBAUTDCJ-KNQAVFIVSA-N 439.512 2.460 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1)c1cc(O)c(O)c(Cl)c1 1827386137 FYUJYFHKZHCBAN-UDKBDQPSSA-N 449.916 2.326 10 20 IECD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c(O)n1 1827427786 IIIOSDKLGDTUJF-SFHVURJKSA-N 440.500 2.449 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(F)CCC2)CC1 1832900487 VBEGCRSHQQDBSL-OAHLLOKOSA-N 441.594 2.359 10 20 IECD COc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccc1O 1844946532 GXSAMIVFFNHREC-VMPITWQZSA-N 440.452 2.048 10 20 IECD O=C(c1ccc2nc[nH]c2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037201 FNYZXAYWPXUHHK-QPJJXVBHSA-N 434.452 2.210 10 20 IECD O=C(c1cc(Cl)ccc1F)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847051685 XHXWHUABLFBRNU-UHFFFAOYSA-N 441.937 2.156 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)CC1 726976777 OXMGOEWYVHRNTN-UHFFFAOYSA-N 434.583 2.279 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(CC2CCOCC2)CC1 737037804 RZCKYKLLYJESSF-UHFFFAOYSA-N 434.556 2.041 10 20 IECD CC(C)N(CCCNC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1)S(C)(=O)=O 738299422 PJMVMTQDCVNWLO-UHFFFAOYSA-N 438.638 2.285 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 743164706 YJEZXPDQJCMODO-UHFFFAOYSA-N 436.509 2.017 10 20 IECD O=C(CN1CCC(OC[C@@H]2CCCCO2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 750064570 MBFYFDHNFJIIAC-NRFANRHFSA-N 449.567 2.329 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](C)c2cnn(C)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750560853 XQVIFZNXNJJQLW-CQSZACIVSA-N 444.513 2.005 10 20 IECD COc1ccc(N2CCN(C(=O)COc3cc([N+](=O)[O-])c(C=O)cc3OC)CC2)cc1F 753738901 MQWRPQCCSMBLFP-UHFFFAOYSA-N 447.419 2.291 10 20 IECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753740564 RRBPIMNSKWJFRV-GOSISDBHSA-N 427.542 2.077 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755346766 SLJKJZZUWYBEDY-ROUUACIJSA-N 434.581 2.483 10 20 IECD CN1CCCc2ccc(S(=O)(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 757874174 OKJLUOHSIIEESW-LJQANCHMSA-N 442.585 2.249 10 20 IECD O=C(NCCCSc1nccs1)N1CCN(S(=O)(=O)c2ccccc2)CC1 759602371 UGMNLKZGFADTFA-UHFFFAOYSA-N 426.589 2.341 10 20 IECD COC(=O)c1cn([C@@H]2CCCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)C2)nn1 762571094 KQGIZGVZVQOBFZ-QFBILLFUSA-N 442.520 2.009 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1C(=O)N(C)C 765928170 VPVGANKOEXBVRF-UHFFFAOYSA-N 434.290 2.420 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c1 767153885 CLBCMCOGAVDUQI-NSHDSACASA-N 441.868 2.092 10 20 IECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)C[C@@H](C)O1 768779828 YHOQISIJVATKPZ-BETUJISGSA-N 438.377 2.171 10 20 IECD Oc1ccc(Br)cc1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 769467069 SBSQELFIQKOEMP-UHFFFAOYSA-N 434.338 2.104 10 20 IECD COCc1nc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cs1 771065544 FTAJENNJLCZBAM-UHFFFAOYSA-N 429.502 2.239 10 20 IECD C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 771418928 TZRQDUQQDFFMKX-FQEVSTJZSA-N 435.839 2.016 10 20 IECD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1ccc(O)c(O)c1 782228444 GSYSWKZFHRJWDD-UHFFFAOYSA-N 425.484 2.374 10 20 IECD COc1ccc(Cl)cc1N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438707 GIMKPVSDVSYGPJ-KRWDZBQOSA-N 430.936 2.426 10 20 IECD CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656236 MLDPCEYRTSHCDR-UHFFFAOYSA-N 429.542 2.079 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN4C(=O)N(CC(C)C)C[C@H]4C3)CC2)cc1 787160008 QFIBZFCHIYFIAZ-HXUWFJFHSA-N 429.565 2.451 10 20 IECD CN1CCC(n2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)n2)CC1 787456917 SVPFYKAFRQQANH-IBGZPJMESA-N 441.532 2.002 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cc(C)ccc3OC)cc2F)CC1 789376054 YEMWQWJLJJEMLD-UHFFFAOYSA-N 442.535 2.217 10 20 IECD CO[C@H]1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949550 JQWDDMRKECUZAL-YJBOKZPZSA-N 443.466 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCCC34CCOCC4)CC2)cc1 800607806 ZIKHIMMOVDDHMA-MHNQQFQPSA-N 427.545 2.366 10 20 IECD CN(C)c1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 803662148 SDSYPUPWWLVBPT-UHFFFAOYSA-N 441.551 2.359 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@H]3c3nc(C)no3)CC2)cc1 806620346 TWXDWLMJGLYTPO-FQEVSTJZSA-N 428.537 2.445 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(N(C)C)cc1 807469628 JNWGFWISIHWPSA-YCRNBWNJSA-N 438.572 2.336 10 20 IECD C[C@H](O)C[C@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769740 VKWWDUGGEYHHSN-ZMSDIMECSA-N 425.476 2.135 10 20 IECD C[C@H](OC(=O)C[C@@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808687888 OQZOSIODBBWLCK-KBPBESRZSA-N 434.448 2.391 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2N1 815258711 XXMMOWNHNJBVOX-UHFFFAOYSA-N 444.438 2.369 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(c4ccc(OC)cc4)CC3)nc12 917210962 XMSBBSSUAALOKG-UHFFFAOYSA-N 425.489 2.333 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(C(N)=O)cc3)cc2F)C[C@@H](C)O1 918991220 YDVIBNHYLJIJIH-HUUCEWRRSA-N 443.475 2.011 10 20 IECD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919697911 OBPREFYQYSMWHO-UHFFFAOYSA-N 439.451 2.119 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC3(CCC3)C1)C2)c1cc(O)nc(O)c1 1777851124 BCLOTPPTQYUSJI-UZUQRXQVSA-N 429.517 2.201 10 20 IECD CC1=CC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785505422 HLPWXOLMQYSPSO-WBJHJBSDSA-N 442.512 2.393 10 20 IECD Cn1cccc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)c1=O 1788425447 QLDCIINFTBVSSO-UHFFFAOYSA-N 434.452 2.253 10 20 IECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1805454709 OXGHZDPNTYKRJV-IIBYNOLFSA-N 433.468 2.225 10 20 IECD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c(O)n1 1827427783 IIIOSDKLGDTUJF-GOSISDBHSA-N 440.500 2.449 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)C1CCCC1)CCO2 1834653400 YJNMDGPDWOEDFB-NRFANRHFSA-N 438.908 2.011 10 20 IECD CN1CCC(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 725899554 BGFYZPIDKPTWKD-UHFFFAOYSA-N 448.501 2.173 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1 726720738 PJJDYJFLWSEADV-UHFFFAOYSA-N 437.504 2.080 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 726977084 XCPSYXVLUXFVGQ-UHFFFAOYSA-N 438.571 2.025 10 20 IECD COCCN(Cc1cccnc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727941418 YICJLQQPJKLNLO-FQEVSTJZSA-N 425.533 2.142 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2cccc(OC)c2O)(c2ccccc2)CC1 729859250 LFLOJBRKLNSIKC-UHFFFAOYSA-N 432.542 2.401 10 20 IECD COC(=O)CN(CC(=O)N(C)CC(=O)Nc1ccc(C)cc1)Cc1cc(Cl)ccc1O 731845324 VKJJKVDWODSCLO-UHFFFAOYSA-N 447.919 2.426 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H](N2CCCCC2=O)C1 732888386 MWHLZKRBRDRYHA-SFHVURJKSA-N 432.540 2.473 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F 733314363 RNZURQPNRAMBKZ-UHFFFAOYSA-N 441.550 2.155 10 20 IECD CCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 737131122 MXYAYCVASQDHSR-UHFFFAOYSA-N 439.491 2.411 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(C)c1 743956915 YPWPAKUFMKHHEO-UHFFFAOYSA-N 426.469 2.386 10 20 IECD CCOC(=O)[C@H]1CSCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386603 AZBZYTPCCWZCEF-LJQANCHMSA-N 438.505 2.381 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](C)O[C@@H](C(F)(F)F)C3)CC2)cc1 745784510 WHWZXMJFLKSURK-CRAIPNDOSA-N 430.471 2.178 10 20 IECD C[C@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2N1C 750068053 BMNYAOAWFLEAIG-AWEZNQCLSA-N 426.492 2.494 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc([S@](C)=O)cc3)CC2)cc1 752830214 CVVNQQZCDGLTAN-HKBQPEDESA-N 444.601 2.444 10 20 IECD CC(=O)NC[C@H]1CCn2ncc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2C1 753213037 XMXHWXBJCJHIAV-HKUYNNGSSA-N 426.517 2.109 10 20 IECD COc1ccc(N2CCN(C(=O)CSCC3(CS(C)(=O)=O)CCC3)CC2)cc1 753688564 WVPJXIUIJPZRLD-UHFFFAOYSA-N 426.604 2.292 10 20 IECD COC(=O)[C@]1(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCOC1 755626554 OKLMQORRHFJHIJ-HGZMWJMZSA-N 440.568 2.178 10 20 IECD O=C(COC(=O)[C@@H]1CCc2n[nH]cc2C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 757818377 OMMZVZZVVBPVMJ-CYBMUJFWSA-N 429.432 2.472 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccccc1O[C@H]1CCOC1 760064486 JQCHGLLQIDIWMT-IBGZPJMESA-N 445.541 2.411 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761463863 YMLQPXKWGVIGNF-XJKSGUPXSA-N 446.525 2.473 10 20 IECD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)c1 762267304 CCLPXNXCDAWVPU-UHFFFAOYSA-N 428.485 2.326 10 20 IECD CN(C)S(=O)(=O)c1ccc(CNC(=O)NCc2cccc(Br)c2O)cc1 764763343 KMTADPKDOMXATD-UHFFFAOYSA-N 442.335 2.404 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@H](C)[C@@H](O)C3)c2C)c1 768765364 DLEBSRUSABCTGU-RBZFPXEDSA-N 428.485 2.163 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)cc1 770256179 CDUFWACVRMHGAO-UHFFFAOYSA-N 425.533 2.328 10 20 IECD CCOC(=O)c1n[nH]c(C2CCN(C(=O)NCc3ccc4c(c3)CCCN4C)CC2)n1 770447287 WYMSWKXDESNHDH-UHFFFAOYSA-N 426.521 2.453 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3cc(C)sc3C)CC2)c1O 774859075 SFZWMWSDMAWPDD-UHFFFAOYSA-N 441.531 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3COC4(CCCCC4)O3)CC2)cc1 778419563 MCLQQRBQBQZIBD-VFCOFNOGSA-N 443.544 2.092 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nn(-c4ccccc4F)cc3O)cc2)CC1 787323710 YUTNEMDVSONEJD-UHFFFAOYSA-N 437.475 2.316 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@@]2(N(C)C)CCSC2)cc1 788255959 VOGWWYLAGFHRRP-QHCPKHFHSA-N 444.601 2.428 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H](C)C1 789823380 DLLALMVHIJEIKK-NTLWEQJWSA-N 448.583 2.244 10 20 IECD CCN(CC)[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950022 MABVAUDHGFKNLX-OAHLLOKOSA-N 444.498 2.005 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccc(CS(C)(=O)=O)cc2)C2CC2)cc1 793482174 KGDNHLVWKJLXGV-UHFFFAOYSA-N 443.569 2.105 10 20 IECD CS(=O)(=O)C1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 793999220 RTTGCEHCIQDVPI-JLHYYAGUSA-N 444.625 2.423 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(F)c1 794581055 OJFOOKDTDVFIAF-UHFFFAOYSA-N 436.870 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 796434077 YVTSEWXPNKFMGQ-HXUWFJFHSA-N 449.548 2.436 10 20 IECD Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 798319386 JFXOTRWAJAAKAW-UHFFFAOYSA-N 447.513 2.223 10 20 IECD CS(=O)(=O)c1nnc(COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)s1 803225384 BTXZVVHJOIILDT-UHFFFAOYSA-N 428.447 2.074 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)CCOc1ccccc1F)c1ccc(N2CCOCC2)cc1 803301875 BAIBZIWXWROQRP-QGZVFWFLSA-N 429.492 2.377 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)cc1F 803663507 QKNNUWFTPFIXFY-KRWDZBQOSA-N 446.910 2.473 10 20 IECD CCc1nc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cs1 805192035 HMGHBMFGFOQPOW-UHFFFAOYSA-N 441.601 2.170 10 20 IECD O=C(N[C@@H]1CCCC[C@@H]1N1CCOCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806090355 JVVHGYRNDFMPCH-RTWAWAEBSA-N 441.528 2.274 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(c2cc(F)ccc2F)CC1 806278566 UJERLIWFNGTPAT-UHFFFAOYSA-N 426.514 2.369 10 20 IECD COc1cc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 806466986 IQZKQGHMYZVQID-UHFFFAOYSA-N 425.529 2.158 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)N4CCCC4)C3)cc2F)CC1 806749595 CUCRGMPUSZKTSN-LJQANCHMSA-N 431.556 2.122 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCOCC1 807548037 OXKGDLHJNTYJME-ZBFHGGJFSA-N 425.476 2.304 10 20 IECD CCN(CC)C(=O)CN1CCCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 920920508 HSUZMYUUJNZDIH-FQEVSTJZSA-N 445.608 2.170 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2ccc(OC)cc2)[nH]n1 1116669695 VWMOWLFLKYLKKB-SFHVURJKSA-N 425.441 2.401 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1778346887 JKOKSMDDHWCLBZ-QLLAKKRXSA-N 430.501 2.083 10 20 IECD Cc1onc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1C 1782004543 ZVXCZYXTNMFSCF-HXUWFJFHSA-N 435.864 2.113 10 20 IECD Cc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782005578 OYVUXOZNABNYJO-NRFANRHFSA-N 431.876 2.212 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)O)C[C@@H]32)cc1 1790126160 YJNCAKKSSWDEOS-HQMSXXKGSA-N 425.529 2.068 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1[nH]cc2c1CCC2 1798446877 IIHIFFIKFUNZKE-ZSBFGKGUSA-N 445.903 2.085 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991662 QWZKWADIHODIDQ-DYESRHJHSA-N 446.463 2.090 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cocn2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146628 UOZBQNREITUSKY-SFHVURJKSA-N 447.455 2.497 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3ccc(O)cc3F)sc2C1)c1cc(O)nc(O)c1 1823342347 SQWKOGDEDKSUIG-JTQLQIEISA-N 444.444 2.334 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCO3)sc2C1 1825594428 UROKSEDJDVDIDA-HGSIUPGCSA-N 445.497 2.064 10 20 IECD C/C=C/C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1838111567 CGKRXYVHNJOUBS-QHHAFSJGSA-N 438.528 2.354 10 20 IECD CCOc1ncccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1840980871 UJQHGFHACFPHMW-VQHVLOKHSA-N 439.468 2.128 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CN2CCOCC2)C3)cc1 1845398478 RZOGKRZOPCPWRI-UHFFFAOYSA-N 436.556 2.243 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n(C(F)F)n1 1847039036 ZGRDZHRLWSTBBS-GQCTYLIASA-N 448.426 2.234 10 20 IECD O=C(CSc1nnnn1C[C@@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 16409615 PQQHFZSGDXDJTJ-AWEZNQCLSA-N 449.492 2.358 10 20 IECD CCN(C(=O)[C@H](C)OC(=O)c1sc2nc(C)cc(C)c2c1N)[C@@H]1CCS(=O)(=O)C1 29033589 FJLJFQAHFXQDBQ-QWHCGFSZSA-N 439.559 2.076 10 20 IECD O=C(COC(=O)c1ccc2c(c1)CCCN2)NCc1ccc(N2CCOCC2)c(F)c1 727899291 YAPGIDDYWBXQTG-UHFFFAOYSA-N 427.476 2.494 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(C)c1 728015823 WSSIIMHMQPPWGI-UHFFFAOYSA-N 428.488 2.264 10 20 IECD CO[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 728083009 SZBYMESOXANTPF-OAHLLOKOSA-N 435.458 2.352 10 20 IECD C[C@@](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)(C(N)=O)c1ccccc1 744394635 LFJIQDGJDFMVST-VWLOTQADSA-N 427.460 2.391 10 20 IECD CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)CC1 748485503 HSYDBVMKDKBOFS-UHFFFAOYSA-N 431.514 2.068 10 20 IECD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NCc1ccccc1O 748486298 OWOIAHVEMBPQTA-UHFFFAOYSA-N 431.514 2.130 10 20 IECD C[C@@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749848627 WCDQGVBJILJQEG-YLJYHZDGSA-N 428.577 2.480 10 20 IECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CCC[C@@]34NC(=O)N(C)C4=O)cc2)CC1 752010418 PFIYIQRTQDLFPM-WZONZLPQSA-N 427.549 2.443 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2COC(=O)NC2CCCC2)c1 753007194 OWWGVHKWLHFTOF-INIZCTEOSA-N 439.534 2.427 10 20 IECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 753457010 KSPLEYZFJPDNJL-UKPGIYTDSA-N 445.589 2.396 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(-c4ccc(F)cc4)n3)CC2)cc1F 753740953 ZXBROFIVCFXBNQ-UHFFFAOYSA-N 426.423 2.482 10 20 IECD COC(=O)[C@@]1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCOC1 755626552 OKLMQORRHFJHIJ-ADYSOMBNSA-N 440.568 2.178 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(C4(C)OCCO4)CC3)CC2)cc1 756681798 JGZNXKCZVAILHA-UHFFFAOYSA-N 432.565 2.002 10 20 IECD C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 760213372 ODAMYRMSRURJRY-INIZCTEOSA-N 425.533 2.318 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](S(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 763640350 GIWLBAGPQUVLRV-UXLLHSPISA-N 427.542 2.158 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)c2)CC1 768014973 DAORNPVGSLFMCM-UHFFFAOYSA-N 430.530 2.463 10 20 IECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769857294 FXYQDVZSMFQKAX-VXGBXAGGSA-N 446.572 2.148 10 20 IECD C[C@@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCO1 770266404 REKKUNUEVWAFNP-CHWSQXEVSA-N 435.458 2.399 10 20 IECD C[C@H]1C(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(=O)N1c1ccccc1 772874964 HVQOWJGEHDOSJQ-INIZCTEOSA-N 440.475 2.136 10 20 IECD O=C(O)c1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 776434944 RZTLAWNZYZOLJC-UHFFFAOYSA-N 440.499 2.066 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc(O)n1 777136161 BNWNACSWELUCTJ-GASCZTMLSA-N 431.464 2.322 10 20 IECD O=C1OCCN1c1ccc(S(=O)(=O)NCCCSc2nccs2)cc1[N+](=O)[O-] 777945602 OEVMELNPMXUOHU-UHFFFAOYSA-N 444.516 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccc(F)c(F)c3)CC2)cc1 778264874 HEIWPFZBQNCXMV-HJWRWDBZSA-N 445.466 2.373 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)ccc21 778618050 HAIOHMNPWMIEHX-UHFFFAOYSA-N 448.523 2.243 10 20 IECD O=C(NCc1ccc(O)c(O)c1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 778914269 GMCVXQPEWDPZML-UHFFFAOYSA-N 436.394 2.087 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 781443298 MHXJIYZLEQSLII-QGZVFWFLSA-N 442.468 2.334 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 785296598 OGACQYBMMGYERP-BZUAXINKSA-N 427.501 2.397 10 20 IECD COc1ccccc1[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nccn1C 785644766 SGMYLWBTUMPBSM-FQEVSTJZSA-N 439.491 2.156 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CC34CCOCC4)cc2F)C[C@@H](C)O1 786456422 IJGJCCQHQJFNCA-SOLBZPMBSA-N 434.508 2.415 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1 787107285 RGYZARLWJPWFPQ-JOCHJYFZSA-N 430.593 2.251 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2nc(F)c(F)cc2F)CC1 788929927 NJNGAZHNIUQWSO-UHFFFAOYSA-N 447.461 2.064 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)cn3)cc2F)C[C@@H](C)O1 789829026 ZZXYGTUHSCEWHL-OKILXGFUSA-N 434.899 2.420 10 20 IECD COc1ccc(CNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)c(O)c1 794373929 PGIGXGHDVJCRLK-UHFFFAOYSA-N 431.493 2.494 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1F 803661376 ZBUHBHWEBMQPRO-LJQANCHMSA-N 446.910 2.425 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688085 UWHQUMIIZBHOAH-VQIMIIECSA-N 444.576 2.447 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cc(C)cc(Cl)n3)cc2F)CC1 805008049 YUOVDHADIJBDMR-UHFFFAOYSA-N 447.942 2.257 10 20 IECD CC[C@H](NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1ccncc1 805740161 SLALDFLUDLPLOK-SFHVURJKSA-N 442.516 2.024 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 807098701 XYKDAFXJJGPXGZ-YADHBBJMSA-N 425.529 2.028 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C 807246651 NQBWJBVCICPENR-CTNGQTDRSA-N 431.577 2.439 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCc2ccccc2C1 808853917 KLWRYWWNGQZVJH-UHFFFAOYSA-N 432.568 2.420 10 20 IECD CN1CCN(c2cc(CNC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccn2)CC1 916389604 AHHXAPMHPYXQPK-NRFANRHFSA-N 439.560 2.430 10 20 IECD O=C(CCCN1C(=O)CCC1=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456462 DLWBHNNENSZWFH-UHFFFAOYSA-N 427.423 2.087 10 20 IECD Cc1cc(NC(=O)NCc2ccc(N3CCSCC3)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 916672159 BSRYNCICGDMDKO-GOSISDBHSA-N 449.602 2.426 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C(=O)OC)Oc3ccccc32)cc1 918428974 GFXSKIAYJOPHFZ-FQEVSTJZSA-N 425.485 2.116 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920922562 FFEZDSFNJSXMFH-AWEZNQCLSA-N 428.445 2.256 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2 1782007472 RZSBACNARSGDDF-QFIPXVFZSA-N 445.903 2.325 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)nn1C 1800716651 PSUKYTBFSGOBOA-CLLJXQQHSA-N 434.880 2.059 10 20 IECD Cc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1807994802 BVLUBAICMZCJNO-AUUYWEPGSA-N 439.497 2.286 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(O)cc1 1811933311 XVMRLUGXPLKWSG-HRAATJIYSA-N 434.452 2.227 10 20 IECD O=C([C@H](O)c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426169 NKKDWCGVXCMYLX-DENIHFKCSA-N 439.512 2.460 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)C3CC3)CC2)CC1 1838820257 ZPMMPJGOFUFUGK-GQCTYLIASA-N 430.501 2.225 10 20 IECD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1841345392 FHHDZTFCPLNTDW-CHWSQXEVSA-N 436.892 2.158 10 20 IECD CC(C)(C)OC(=O)NCCCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841767921 CWKNFTGAKDXRSP-UHFFFAOYSA-N 448.520 2.005 10 20 IECD C[C@H](NC(=O)CSc1nnnn1CC(F)(F)F)c1ccc(N2CCOCC2)cc1 729948195 GEFQSXVACWNWKH-LBPRGKRZSA-N 430.456 2.042 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(CC(F)F)CC3)cc2F)CC1 730124515 AKGPCPPTSYXYLN-UHFFFAOYSA-N 427.515 2.496 10 20 IECD COc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 734490071 AMFMHLIKPRUOBZ-UHFFFAOYSA-N 447.557 2.054 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1 734703595 QDLAPYGSOCQWRE-UHFFFAOYSA-N 437.544 2.018 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(CN4CCCCC4=O)CC3)CC2)cc1 735871666 FQPFWKCYHZKFID-UHFFFAOYSA-N 428.577 2.068 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCCN3Cc3ccccn3)CC2)cc1 741139427 RPXAQRWDVHLSCI-XMMPIXPASA-N 437.588 2.383 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)NC(=O)OC(C)(C)C)cc1 742755023 UNNHCAGOSTUMHL-APWZRJJASA-N 430.549 2.446 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)o1 751365573 FFTVWGGIESNWSV-GOSISDBHSA-N 435.546 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)N=c3cc[nH]cc3I)CC2)cc1 760028987 MBEWSYGPQUNLTP-UHFFFAOYSA-N 438.269 2.471 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(OCCF)c1 760096851 PBFKWWIFKFSNSY-UHFFFAOYSA-N 429.492 2.499 10 20 IECD CN(C)c1ccc(CNC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cc1 762485756 XIZZJHXRVSPLED-UHFFFAOYSA-N 427.486 2.316 10 20 IECD CCC[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768521913 LQTCLNUWZULCMJ-KIMHZCHSSA-N 434.512 2.166 10 20 IECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 769320678 UHPBIEQLKJCMDR-CTNGQTDRSA-N 432.584 2.475 10 20 IECD Cn1cnnc1[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770165448 SOOKNSVBXWTDEZ-AWEZNQCLSA-N 433.515 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@](C)(O)c3ccccc3)CC2)cc1 779346586 PAFBNCDLEKYJSL-ZOGNMOHXSA-N 437.540 2.314 10 20 IECD O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1O 780402103 NNPCARRHFGBWBY-UHFFFAOYSA-N 426.350 2.395 10 20 IECD O=C(Nc1cccc2c1OCO2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768535 ZJXUQFYKWLXBSV-HNNXBMFYSA-N 431.876 2.494 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 787736130 IQTHBURINVPSLW-QFIPXVFZSA-N 434.540 2.383 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCCN1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 787904455 SMIICAQINUJAPK-WOJBJXKFSA-N 430.593 2.471 10 20 IECD CC(C)COC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccco1 788321062 SILWBUYZFOFCMT-HXUWFJFHSA-N 429.517 2.263 10 20 IECD COCc1ccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789813253 QZQFOLPGXIJZAI-FQEVSTJZSA-N 445.491 2.382 10 20 IECD CCCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H](COC)C(=O)O 797710131 SRUQGXOSVZWCOQ-ZRGWGRIASA-N 425.501 2.461 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C 799254302 SVXIPDUYYVOPDL-NRFANRHFSA-N 438.528 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCc4ccccc4OC3)CC2)cc1 801442531 XKBKNKXTVCPDGL-CBUFDYBVSA-N 435.524 2.410 10 20 IECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803299503 LRMVLPBGNICWCB-IERDGZPVSA-N 425.533 2.106 10 20 IECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803308673 HSZHVFDWADUPQI-IRXDYDNUSA-N 448.564 2.120 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-c4nc(O)n[nH]4)c3)CC2)cc1 803404430 PGAMSSPNISVZAU-MDZDMXLPSA-N 448.483 2.029 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CSCCN2Cc2ccccc2)cc1F 803663848 CCFJBXNIIKSPAX-IBGZPJMESA-N 444.576 2.242 10 20 IECD C[C@H](Oc1ccc(C=O)cc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 803965550 GIIXGRKIXLFVAL-INIZCTEOSA-N 444.459 2.102 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804315462 LTJIABLDKFPTTI-DEOSSOPVSA-N 445.560 2.218 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(N4CCCCC4)CC3)CC2)cc1 804317154 UDFDOUYVMXCLSH-UHFFFAOYSA-N 428.577 2.257 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(=O)NCCCSc2nccs2)cc1 806278452 SLEFYBGJTBBWBL-CQSZACIVSA-N 441.600 2.029 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3ncn(C)c3=O)c2C)cc1 815267951 JWSLZPIIIVBCNM-UHFFFAOYSA-N 426.473 2.204 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2cnccn2)CC1 862391769 RQBSQKCSZOTSAY-INIZCTEOSA-N 441.491 2.401 10 20 IECD CCCNC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309649 CWZPKJWVRGGBQB-UHFFFAOYSA-N 438.528 2.260 10 20 IECD O=C(CCc1nc(-c2cccs2)no1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339231 COMSZJABIQHLCM-UHFFFAOYSA-N 446.554 2.282 10 20 IECD C[C@H](NC(=O)NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(N2CCOCC2)cc1 920872202 PLKNCPRIVKEAHA-IBGZPJMESA-N 438.576 2.230 10 20 IECD COc1cc(OCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1[N+](=O)[O-] 921075714 HYKOGNJJCTVVBG-UHFFFAOYSA-N 433.436 2.399 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)cc1F 1319514028 NTFGGYSSIMYLPW-GOSISDBHSA-N 440.519 2.498 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)o1 1779585904 MRSJHQCDKSSYBE-HXUWFJFHSA-N 435.864 2.113 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cncc(C(F)(F)F)c1 1796601399 CRCHIWCWCJUUQJ-QDMKHBRRSA-N 436.390 2.472 10 20 IECD CC(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1798669982 QOOCBHODIDIJHL-IVWMJMPLSA-N 448.907 2.115 10 20 IECD COc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1OC 1800565391 RCLPZIFOOPRNMK-BTTYYORXSA-N 445.447 2.215 10 20 IECD O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827106241 CLACWVARBJZGKH-CYBMUJFWSA-N 428.470 2.401 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCOC3)sc2C1)c1cc(O)c(O)c(Cl)c1 1827175965 ARCSPKZMUVBEDY-MWLCHTKSSA-N 437.905 2.470 10 20 IECD CCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1842635231 DMBGCMPDFGVTKO-INIZCTEOSA-N 447.532 2.147 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2cc3cccnc3cc2F)C1 1845141161 YDMUDTCXEQMTMV-UHFFFAOYSA-N 436.443 2.240 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C(=O)OC)[C@H]3C(=O)OC)ccc21 511318235 CVJIMAYNHQNXDD-PXNSSMCTSA-N 430.501 2.471 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 731131477 JXUNPOAVRQXQFS-UHFFFAOYSA-N 438.528 2.303 10 20 IECD COCCN(C(=O)/C=C/c1cnc(C)s1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 732727233 GZXWVQDVYUBRHS-CMDGGOBGSA-N 441.513 2.037 10 20 IECD Cc1cc(C(=O)COC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c(C)n1-c1ccccc1 746915719 PTANXLOTVPEUKP-UHFFFAOYSA-N 432.436 2.481 10 20 IECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 751186135 HIMWTHHGQMMRQN-DAXSKMNVSA-N 437.426 2.095 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(c4nc[nH]n4)CC3)cc2F)C[C@@H](C)O1 751500324 ZGGIFKIOLKMARK-HZPDHXFCSA-N 430.528 2.053 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncccc1OCC(F)(F)F 752514724 KZSHTBLHDMBHSE-UHFFFAOYSA-N 443.447 2.188 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 752657251 ZHWZTVXEYCRHLR-UHFFFAOYSA-N 432.546 2.038 10 20 IECD CC(C)Nc1ncccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 754502196 DNVWXBPDHMGJCX-UHFFFAOYSA-N 430.480 2.351 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(CS(C)(=O)=O)c3)CC2)cc1 758163415 FUAKEOSLXRQEBY-UHFFFAOYSA-N 445.585 2.182 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)cc2F)CC1 759261771 YZMPSHWOYVRKBW-UHFFFAOYSA-N 444.532 2.288 10 20 IECD CCCn1nc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 760011852 QHNYNMHGHBNALV-UHFFFAOYSA-N 432.496 2.359 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc4c(n3)CCCC4)CC2)cc1 769028921 IILJZNTYESCJNJ-OUKQBFOZSA-N 434.540 2.490 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 769164022 TZHWNPRZXXRQJR-BJKOFHAPSA-N 444.620 2.462 10 20 IECD Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 770350523 NFMCWSCTMKVGHC-DYESRHJHSA-N 445.539 2.176 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 774356124 IBFWDVBRNNTGHK-LJQANCHMSA-N 449.511 2.039 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(OC)c(OC)c3)CC2)cc1 774666643 CJPPSUVPEORMSC-UHFFFAOYSA-N 427.501 2.114 10 20 IECD O=C(NCCOc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774867350 PHTJMVRBCMCVNH-UHFFFAOYSA-N 436.556 2.030 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 778234143 MLLJPCWRUXGTFP-KNLQKXEQSA-N 442.604 2.384 10 20 IECD CCOC(=O)c1c(NC(=O)CN2CCO[C@H](C(=O)NC)C2)sc(C)c1-c1ccccc1 782097424 BDXZUTFXYZYETK-INIZCTEOSA-N 445.541 2.286 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4cc(C)cc(F)c4)nn3)CC2)cc1 788743314 RVWPAZCPAKKVPN-UHFFFAOYSA-N 438.507 2.275 10 20 IECD COCCN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789824901 LACYJKTZPQHEBL-IRXDYDNUSA-N 447.507 2.324 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(F)cc2Br)ccc1O 790406760 GWKUHBQDKBQJDN-UHFFFAOYSA-N 439.284 2.003 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(Cl)c2C)cc1 797431530 QZAANNHLHSLSHD-UHFFFAOYSA-N 433.895 2.024 10 20 IECD CN(C)Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 799252538 AHFAFVWRFQTXGD-UHFFFAOYSA-N 430.936 2.493 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCCC3=O)cc2Cl)C1 803122252 PEWVUUUEGINVHT-HZPDHXFCSA-N 434.968 2.320 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3cc(C)ccc3C)CC2)cc1 803751304 UIBVJRCXWCMYHD-UHFFFAOYSA-N 438.572 2.209 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCOC4(CCSCC4)C3)CC2)cc1 804317635 KOASAWOURMCKMX-GOSISDBHSA-N 447.601 2.341 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3C[C@H](N4CCOCC4)C[C@H]3C)cc2F)C[C@@H](C)O1 804969367 PSZNHRMGTHBNTP-FTEYMNFISA-N 434.556 2.444 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809243006 FZZGCBNMVZSGDV-APWZRJJASA-N 432.565 2.473 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CSCCN1Cc1ccccc1 809455671 ITRMUDCKSOKOAY-QFIPXVFZSA-N 440.613 2.445 10 20 IECD CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCCC2)c1 813397867 KGKKPCREJZIBIJ-UHFFFAOYSA-N 436.555 2.357 10 20 IECD NC(=O)CCCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 915284825 LOCYNPLGDNQIAS-XYOKQWHBSA-N 442.360 2.032 10 20 IECD O=C(NC[C@@]1(N2CCOCC2)CCSC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916636639 HMHVRIBFPQCZQL-UGKGYDQZSA-N 435.590 2.291 10 20 IECD COc1ccc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)c1 917016587 XDCVCVKTZKMVTH-UHFFFAOYSA-N 431.508 2.428 10 20 IECD COCCc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 917930214 NAPXOMFQOXIRPQ-IBGZPJMESA-N 431.558 2.056 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 919972777 AZIGZJHWUGJAAI-QFIPXVFZSA-N 441.597 2.450 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1OC 921018911 BJCTUHKMHATRGS-UHFFFAOYSA-N 436.515 2.443 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc(OC)c(OC)c1 921061008 JIPBPTIUHLMEQI-UHFFFAOYSA-N 447.557 2.063 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccn1)C1=NN(c2ccccc2)C(=O)C1 1794488974 YSYQAPWJORFWLA-NUZGMZIFSA-N 445.523 2.445 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c(O)c1 1799770123 IVEIBCVRYCKLBE-HBCWATKFSA-N 446.887 2.282 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465168 RAQKHBKXNJLOGK-NSAZKJPHSA-N 449.486 2.238 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1 1815542640 LJESSTQSUJBKDS-SNVBAGLBSA-N 431.346 2.422 10 20 IECD Cn1cc(F)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818385144 NQHZBPNLXOPMBE-AWEZNQCLSA-N 428.424 2.313 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831906302 QJBRHFJGRNKQGU-LAUBAEHRSA-N 440.544 2.434 10 20 IECD O=C(C1CCN(c2ccccc2)CC1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248944 WHCKYKZBMOZSDM-UHFFFAOYSA-N 436.512 2.226 10 20 IECD C[C@H]1CCc2c(C(=O)N3CCCC34CN(C(=O)C3=NN(c5ccccc5)C(=O)C3)C4)n[nH]c21 1843727485 CCGYIYRPUSSUMJ-HNNXBMFYSA-N 446.511 2.069 10 20 IECD CCOC(CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)OCC 1845502214 AKLXMCSDKXVCJA-UHFFFAOYSA-N 426.897 2.357 10 20 IECD O=C(c1cc(O)nc(Cl)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033956 QUYJRGVVGUBARC-HWKANZROSA-N 445.859 2.088 10 20 IECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735520175 XJHFAUFNVDZAJT-KBMIEXCESA-N 449.507 2.293 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCOC1 743555946 DLYBJXVSQNMWSH-FUHWJXTLSA-N 428.512 2.167 10 20 IECD COc1ccc(N(C)CC(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)c(OC)c1 752109294 FMGVKZSERBZWAE-UHFFFAOYSA-N 425.529 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)C3CCN(C(=O)c4cccnc4)CC3)CC2)cc1F 753742105 OSYBZWKNYPHBQX-UHFFFAOYSA-N 426.492 2.430 10 20 IECD Cn1cc([C@H](O)CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 762527100 MBJKSVRTUOBPGJ-QVTJDRNWSA-N 436.584 2.313 10 20 IECD COc1ccc2c(c1)CCCN2CN1C(=O)N[C@@](C)(c2ccc(S(C)(=O)=O)cc2)C1=O 766342629 VBVRYXCNPGHQJF-QFIPXVFZSA-N 443.525 2.276 10 20 IECD O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br 776434656 IOBONBDDDGDVBB-UHFFFAOYSA-N 428.220 2.236 10 20 IECD CCC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)N1CCc2sccc2C1 785421081 AMNXJXUEENKQJR-LJQANCHMSA-N 442.585 2.300 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nnn(-c4ccc(C)cc4)c3C)cc2)CC1 786257175 YEOPSDUAXWVCLC-UHFFFAOYSA-N 432.528 2.483 10 20 IECD CCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 787207808 FZLICDKROCFWJO-UHFFFAOYSA-N 429.492 2.118 10 20 IECD C[C@@H]1CCCC[C@H]1OCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787985254 AXVNZEYKUHKQDG-IIBYNOLFSA-N 435.540 2.115 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1 788812276 BKWQCWDSMFSHFN-OAQYLSRUSA-N 436.556 2.124 10 20 IECD COc1ccc(CNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c(O)c1 793089529 UYMPLXWCQPZKJR-SFHVURJKSA-N 445.491 2.057 10 20 IECD CCOC(=O)C1CCC(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 793673736 GNLMDLZSZAEIGV-UHFFFAOYSA-N 431.533 2.018 10 20 IECD CO[C@@H]1[C@H]2C[C@@H]3CN(CC(=O)c4cc(C)n(-c5ccc(S(N)(=O)=O)cc5)c4C)[C@@H]1[C@H]3C2 796329564 LTMLVCHYNMAROL-HWGBFJKVSA-N 443.569 2.279 10 20 IECD CCn1c(-c2ccc(-n3cnnn3)cc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 801956733 AFOSCPJTBKGEJO-UHFFFAOYSA-N 449.494 2.415 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 803132637 LCEBTPYIRUYRPR-GOSISDBHSA-N 432.565 2.474 10 20 IECD CC[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 805636309 MXYWGNJQJXBNKE-FQEVSTJZSA-N 444.620 2.498 10 20 IECD COC(=O)C[C@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 805816814 OMHMUNCVRWDHLH-SFHVURJKSA-N 428.485 2.312 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1C(=O)N(C)C 807386920 QJDVYWDUHMDYCJ-UHFFFAOYSA-N 434.290 2.420 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)CN(C)C 807605865 XGVPGKWSLRUGGG-HZPDHXFCSA-N 440.535 2.466 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808771319 WWNQXTWTPMXSBQ-APWZRJJASA-N 432.565 2.473 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@@H](c2ccccn2)C1 808853672 BCXWMIYWZOYLFY-JOCHJYFZSA-N 447.583 2.246 10 20 IECD CCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919971418 WZOGWVCBTTWSFW-UHFFFAOYSA-N 435.521 2.015 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)CC1 1319382195 QAVQOPZTGIKKMT-LJQANCHMSA-N 433.549 2.453 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1 1325764773 WHKBAGVOIRDWDO-KRWDZBQOSA-N 436.468 2.460 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)Cc3ccc(C(N)=O)cc3)cc2F)CC1 1338672541 PVGKZLIHNLNBJC-UHFFFAOYSA-N 427.524 2.408 10 20 IECD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)n(C)n1 1788424242 LSFGMJPSFKIUHE-UHFFFAOYSA-N 437.456 2.296 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccn2cncc2c1 1804286255 PRYUEUWHQFJIHA-YBXVHQAYSA-N 448.479 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1[C@H]2SC=C[C@H]21 1804289820 WBWSPVIKKTYHNK-ATPXADIUSA-N 428.510 2.330 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@]1(F)Cl)CC2)c1cc(O)nc(O)c1 1816728792 VFPCDSWTRHBSES-NMIRZEMHSA-N 426.857 2.100 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncon2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821291847 HEZOQXIVNLPBGV-LBPRGKRZSA-N 432.824 2.477 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)CC1 1828688738 QJDCUIABYBPEAL-LJQANCHMSA-N 439.516 2.183 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(C(=O)N4CCCCC4)CC3)CC2)cc1 57886620 OZLRWSFDRJAMDX-UHFFFAOYSA-N 428.577 2.068 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)n(C)c2ccccc12 509553843 IATRIQRIJPJDDZ-IBGZPJMESA-N 447.583 2.430 10 20 IECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 730681762 UOZVCEVTUUNIRW-UHFFFAOYSA-N 435.427 2.074 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 730810169 BZCXKEXLIXGJMT-BETUJISGSA-N 426.466 2.297 10 20 IECD COc1ncc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 734049843 ZURIZPJSTZSDAL-GFCCVEGCSA-N 431.404 2.445 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 734701487 ALCHKQBKWRNKRH-CALCHBBNSA-N 425.533 2.325 10 20 IECD CCNC(=O)C(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 746300978 IGRWQOQAQAOQEY-UHFFFAOYSA-N 425.532 2.147 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn(C(C)(C)C)c3)cc2F)CC1 746395386 UFWDLQOEBKBJGS-UHFFFAOYSA-N 430.528 2.174 10 20 IECD O=C1C[C@@H](Cc2ccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)C(=O)N1 747551405 CNPXBXLMXPCFQT-QGZVFWFLSA-N 440.475 2.189 10 20 IECD NC(=O)c1ccc(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 753477703 JPUHINWCNYZDNN-UHFFFAOYSA-N 442.427 2.285 10 20 IECD C[C@H](c1ccccc1)N(CC(=O)N1CCN(CC(=O)N(C)C)CC1)Cc1ccccc1O 757276021 MKLAXPIQTHVVSN-HXUWFJFHSA-N 438.572 2.188 10 20 IECD CCS(=O)(=O)N1CCC(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 758741970 IHBMOWSRRUJBOZ-IBGZPJMESA-N 439.578 2.145 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C(=O)[C@H]2C1 761635104 HXEMMHVBWBRCEN-UKPHBRMFSA-N 437.443 2.473 10 20 IECD COc1cccc(CNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)c1O 769508201 RGKWLJQLXGDIAV-UHFFFAOYSA-N 433.530 2.449 10 20 IECD COCCN(CCOc1ccc(F)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769784950 OZMXJDSUWPTFBT-UHFFFAOYSA-N 426.466 2.070 10 20 IECD CCO[C@@H](C)c1noc(CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)n1 775725350 MRDGMNUKSVPHHL-IBGZPJMESA-N 428.581 2.237 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 776054308 FGXJQDKOFVIKNN-KRWDZBQOSA-N 435.575 2.118 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc2c1OCCC2=O 780046786 GZVIUEYOTLVJKD-UHFFFAOYSA-N 437.496 2.115 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(I)cc1 785297125 LTBKVFNFGNEWNR-SNVBAGLBSA-N 440.237 2.388 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(C(=O)C(C)(C)C)C3)cc2)CC1 786659046 GMUSGUVCKYIXGP-HXUWFJFHSA-N 428.577 2.256 10 20 IECD O=C(c1ccccc1)c1ccc(O)c(CN2CCC[C@H](N3CCCS3(=O)=O)C2)c1O 788388139 PPJHZZJIAGFJQB-KRWDZBQOSA-N 430.526 2.329 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 788393742 BRMIMTCVIGXETL-KRWDZBQOSA-N 441.528 2.373 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1 788978638 QDAIYPFPVAKVLG-JOCHJYFZSA-N 436.556 2.456 10 20 IECD C[C@H](O)C[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789820936 RABFBGFHKWDCGC-DWRORGKVSA-N 435.540 2.208 10 20 IECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833263 FZAMFEFZHAQNMT-IBGZPJMESA-N 448.583 2.174 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 789950253 MUFCJLRYUGOWDJ-UHFFFAOYSA-N 443.466 2.091 10 20 IECD Cc1ccc(S(=O)(=O)Nc2ccc(O)c(Cl)c2)cc1S(=O)(=O)N1CCOCC1 790404498 MAXQCMNSXSQLKO-UHFFFAOYSA-N 446.934 2.176 10 20 IECD Cc1cc(C)cc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793719894 NAQLAWZLYBAHDM-NRFANRHFSA-N 436.556 2.280 10 20 IECD CN(Cc1ccc(Cl)cc1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735036 WUNANPUJTMPVLC-SFHVURJKSA-N 442.947 2.317 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N(C[C@H]1CCOC1)C1CC1 803448109 HRHDXMWKBMWXNP-OAHLLOKOSA-N 437.487 2.401 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCC[C@@H]1N1CCOCC1 806088065 LTRJWJUMUVPKBY-YADHBBJMSA-N 430.593 2.249 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 806276936 XAFXLUPHKYAHKF-UHFFFAOYSA-N 433.534 2.425 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1 807100329 JEWSFKRUMZWPCM-FQEVSTJZSA-N 437.588 2.004 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C1 807101686 AOBLILCXKDJGJY-LPHOPBHVSA-N 432.565 2.439 10 20 IECD C[C@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290870 CWDONCVGPULLME-QGZVFWFLSA-N 425.558 2.041 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(CCCOCC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807672670 FRSPUKOBSMOHDX-MRXNPFEDSA-N 444.498 2.043 10 20 IECD C[C@@H](NC(=O)C(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674124 GLEBHAVJGWOVSE-CYBMUJFWSA-N 428.480 2.206 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H]4CN(C(C)=O)C[C@@H]43)cc2F)CC1 808357767 OKWBPQUQSFLWOW-RZUBCFFCSA-N 445.583 2.414 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cnn(CCF)c3)cc2F)C[C@H](C)O1 808570144 OJFYVYGSMSAQTH-GJZGRUSLSA-N 436.459 2.079 10 20 IECD Cc1nc(Cn2nnc(NC(=O)C(=O)N(CC3CCCC3)c3ccc(N)cc3)c2C)no1 815594363 MYRAWBOAIOJMKI-UHFFFAOYSA-N 438.492 2.070 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](CSC)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 872160623 IYXFVMINQFNNAT-HSALFYBXSA-N 445.585 2.251 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 916383521 KPPUAALABODJRZ-IBGZPJMESA-N 439.578 2.287 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2)cc1OC 917759369 OYHQIIVTGUYSQP-UHFFFAOYSA-N 428.488 2.044 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3cccc(F)c3)CC2)cc1 920256074 PSQCMABQDPGWSF-MDZDMXLPSA-N 427.476 2.234 10 20 IECD CC(=O)N1Cc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2C1 1327643644 VAFGIUXMLFODLS-UHFFFAOYSA-N 442.541 2.105 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCC(F)(F)F)C2)c1cc(O)nc(O)c1 1777849012 IIVHHFFNDMDRFO-AUUYWEPGSA-N 445.438 2.353 10 20 IECD Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1807991567 QCLWAXPLBZOBOW-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccnc(F)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993172 FGAVWODDBGSDAE-QRWLVFNGSA-N 437.431 2.055 10 20 IECD C[C@@H](Oc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550457 KREOBAZUYMFJFC-MRXNPFEDSA-N 440.500 2.200 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)CC1 1826653215 AYCMDYQBAUTDCJ-DENIHFKCSA-N 439.512 2.460 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)C(=O)N(CCc2cccs2)C1=O 16878867 LZYBPIGBXYXHNA-UHFFFAOYSA-N 442.541 2.008 10 20 IECD C[C@H](NC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1ccc(N2CCOCC2)cc1 109180478 IMPXLJZNFCUNNL-KRWDZBQOSA-N 435.532 2.055 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CCN(C(=O)OCC(C)C)CC3)nc12 726204715 ASQRXFBBTDVJMX-UHFFFAOYSA-N 448.476 2.159 10 20 IECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)C1CCCCC1 727308538 OJAKCRNUNVRIDM-FXAWDEMLSA-N 428.577 2.480 10 20 IECD CCS(=O)(=O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 727718882 SPCKTQVDKRPUJK-ACCUITESSA-N 432.614 2.280 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732451543 VVMYQYDBHXKHLF-FUHWJXTLSA-N 447.580 2.443 10 20 IECD CCS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 732537530 YDOICXSKPYNJGR-INIZCTEOSA-N 447.532 2.251 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 735392823 JMTYPCYEFSWWRZ-UHFFFAOYSA-N 442.541 2.351 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1 740812161 VIUFVMAUEAVWEQ-UHFFFAOYSA-N 436.519 2.005 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)s3)cs2)c[nH]1 743046520 VPWDPOAOFQTDNQ-UHFFFAOYSA-N 440.528 2.423 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H](C)N1CCOCC1 751060643 IEJTZNJSMJIGFM-UONOGXRCSA-N 439.559 2.094 10 20 IECD CC(C)(C)OC(=O)N(CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CC1 753108712 SZNPSMYOMDIBPX-QGZVFWFLSA-N 430.549 2.404 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1 761250923 RLGMVPCCDNVBEK-UHFFFAOYSA-N 441.575 2.344 10 20 IECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1cccc(N2CCCC2)c1 764088355 USNCOAVJGNEVFZ-CQSZACIVSA-N 446.529 2.121 10 20 IECD NC(=O)c1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 764355392 ZVKLTBXBKJDPCY-UHFFFAOYSA-N 436.434 2.369 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCN3CCCO[C@@H](C)C3)cc2F)CC1 764409403 RMZJMJLGNJHNAK-IBGZPJMESA-N 435.588 2.268 10 20 IECD CC(=O)NC1(c2noc(CCC(=O)NCCc3ccc(O)c(O)c3)n2)CCCCCC1 768899603 JWVUYGAZLBQZPF-UHFFFAOYSA-N 430.505 2.458 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772909918 LTEINGUXGUMOKX-UHFFFAOYSA-N 449.548 2.244 10 20 IECD COc1ncc(/C=C/C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 775136244 VGHCYZVKBHDWRA-RMKNXTFCSA-N 443.415 2.456 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccc(Cl)cn4)CC3)CC2)cc1 779222023 SJEZGLMMHSCUFU-NRFANRHFSA-N 445.995 2.049 10 20 IECD Cn1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C(F)(F)F 782105939 XTPZGPYPKNYEMW-CYBMUJFWSA-N 426.395 2.291 10 20 IECD COC(=O)CSCc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785292840 AUEJRRGPNFDWKB-CYBMUJFWSA-N 432.498 2.190 10 20 IECD CSCC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2ccccn12 785599330 BFIQUNUQQTWBBX-GOSISDBHSA-N 440.573 2.364 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(C(F)(F)F)n1 786275532 OETMXHALOMXIGA-UHFFFAOYSA-N 426.370 2.331 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](OC(F)F)C3)cc2F)C[C@@H](C)O1 789824607 JVHFTQHYOLLHTM-FMKPAKJESA-N 443.466 2.286 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677303 LZIXCVIFPKBJBW-FCHUYYIVSA-N 447.576 2.008 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)[C@@H]1CN(Cc2ccccc2)CCO1 806282258 JGPLRDBMAQEMTO-AEFFLSMTSA-N 448.614 2.147 10 20 IECD CCNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806494134 LPPZQONXQXKURV-AZUAARDMSA-N 445.564 2.199 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O 808565534 LVTXXKGRRSURFJ-IBGZPJMESA-N 427.476 2.187 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cn2n1 810349882 MXYXJZSDSAWVRA-OKILXGFUSA-N 440.479 2.045 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCCC1 813670644 WZCVNAXIVHDFPQ-UHFFFAOYSA-N 442.553 2.330 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918436791 DNFGXFDKOTUWPZ-UHFFFAOYSA-N 447.582 2.288 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(N2CCCC2)nc1 918439084 RKTPYGVDDRIQHM-UHFFFAOYSA-N 425.558 2.490 10 20 IECD CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCN(C)CC3)c(F)c1)CC2 1116753301 OHVGIYYQTNDYRZ-UHFFFAOYSA-N 432.565 2.438 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)CC1CCCC1)CCO2 1785508725 JZVVFPINUJMWJC-AVAOGFIGSA-N 430.501 2.227 10 20 IECD CC(C)(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1786385091 PWQRVAZSSBIDDA-SNYJDTOOSA-N 432.517 2.233 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1798967350 PLFWDYOPOTZHFX-APZHPHOLSA-N 438.480 2.028 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(C3CC3)on2)C1 1841178822 JUAAKRQISZASHM-FNORWQNLSA-N 425.441 2.199 10 20 IECD O=C(c1n[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250744 JYLPFYIKGSXACY-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n[nH]1 1844779730 LELHGPPOZUYNEY-UHFFFAOYSA-N 434.500 2.143 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3N2)C1 1845855546 CQSRAIOWBLRBSN-KOEDOTQGSA-N 435.480 2.057 10 20 IECD CSc1ccc(CC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1846497669 LIANCHCRYRTDPK-UHFFFAOYSA-N 449.623 2.015 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(CC(C)(C)O)CC2)c([N+](=O)[O-])c1Br 732030937 UQMFYFPELQTKCX-UHFFFAOYSA-N 433.259 2.167 10 20 IECD C[C@@H](CS(C)(=O)=O)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 733246245 KCDUWQOWQILXGO-GJSJWPQCSA-N 432.614 2.279 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 739082375 SKTVSWYVRJYKPN-UHFFFAOYSA-N 439.512 2.478 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742755461 XIUOUGZFGVTYSJ-MAUKXSAKSA-N 439.578 2.259 10 20 IECD CCN1CCN(C[C@@H](C)CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 745807235 AXAYZTHKAPZMDY-FQEVSTJZSA-N 448.631 2.040 10 20 IECD COCC(=O)NC1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745905717 QJVDDYWBGPSJQA-MRXNPFEDSA-N 440.491 2.193 10 20 IECD CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 746757118 DWIREQNVBWTPJF-HXUWFJFHSA-N 436.572 2.429 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(F)cc2I)c1 750254639 DYWBQHTXMRBMAP-UHFFFAOYSA-N 444.200 2.399 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3[C@@H](O)C(F)(F)F)CC2)cc1 750634424 KDDYZBVVVAOTBT-RBUKOAKNSA-N 444.498 2.305 10 20 IECD Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751212119 BXPDCLBGDQTGRH-UHFFFAOYSA-N 439.515 2.247 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751291663 NWRHBVRXILVXRD-LPHOPBHVSA-N 448.541 2.275 10 20 IECD COc1cc(N2CCN(Cn3nc(C)c4cc([N+](=O)[O-])cnc43)CC2)cc(OC)c1OC 758955409 PFTDYFZFKGJUAW-UHFFFAOYSA-N 442.476 2.453 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccncc4)CC3)cc2F)C[C@@H](C)O1 760892131 JBCMKOISGAFSBW-RTBURBONSA-N 441.551 2.273 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c(OC)c1 761290310 NWWOAWAPJPRADT-GFCCVEGCSA-N 444.531 2.211 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)NCc2cccc(Br)c2O)cc1 765731749 MGNSUXJOOXBXIS-UHFFFAOYSA-N 427.320 2.312 10 20 IECD CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)C1 765734845 VVDWSMWNPJITIG-FQEVSTJZSA-N 439.534 2.237 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(Br)nc1 766182584 SJOPSYDEURYRPG-UHFFFAOYSA-N 439.335 2.401 10 20 IECD CC(C)[C@@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768516503 DTCOHJKPNBLJOX-VBURHUQHSA-N 433.524 2.477 10 20 IECD CC(C)C(=O)NCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768558111 IUVQYWNNLHNCRL-UHFFFAOYSA-N 425.532 2.099 10 20 IECD C[C@@H]1CN(S(=O)(=O)N2CCN(Cc3ccc(N4CCCCC4)cc3)CC2)C[C@@H](C)O1 768778414 OVFVNCWLPNDEMG-WOJBJXKFSA-N 436.622 2.149 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(C(F)(F)F)ccn3)cc2)C1 772946443 NADBEVYAHVYKEJ-AWEZNQCLSA-N 449.433 2.057 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCCCC3)cc2F)C[C@H](C)O1 787752497 VFXVPTKCADLHQO-SQNIBIBYSA-N 434.556 2.046 10 20 IECD CC(C)(C)c1csc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789797345 BRACZYLXPGALAM-UHFFFAOYSA-N 448.564 2.391 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)c3nccs3)cc2F)C[C@@H](C)O1 789834240 LGEZIUOQVHRPML-KFWWJZLASA-N 434.537 2.432 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCC[C@@H]3COC(=O)NC(C)C)CC2)cc1 796706862 AELVGVPJFSQGBI-HXUWFJFHSA-N 432.565 2.333 10 20 IECD O=S(=O)(NCCNCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1Cl 800895059 YBAHTFYSPLTUFV-UHFFFAOYSA-N 427.929 2.384 10 20 IECD COc1nccc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 801725320 NDRSRHPOQWIWAS-UHFFFAOYSA-N 438.467 2.063 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 804004805 QNELRCFPEGVNBZ-QFIPXVFZSA-N 436.556 2.407 10 20 IECD CCC(=O)c1ccc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(S(N)(=O)=O)c1 804644429 IIEYAAYETZWRNX-UHFFFAOYSA-N 444.557 2.207 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC[C@H]2c2cnn(C)c2)cc1F 804852502 JEWFWXKRKRVVAA-IBGZPJMESA-N 433.553 2.338 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1F 804852844 OSPRORMADAVKQF-HXUWFJFHSA-N 445.539 2.239 10 20 IECD COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 804969489 QPOHZGOMEWSCAM-GOSISDBHSA-N 433.402 2.299 10 20 IECD COC1(CO)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 807953974 CXXNZVMCOGKXPZ-INIZCTEOSA-N 437.968 2.192 10 20 IECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@H](C)O1 807954409 QYVUZNNYYSQIQJ-RYRKJORJSA-N 437.968 2.455 10 20 IECD COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 808029425 MSGPWHFHRDIQLD-IEBWSBKVSA-N 432.565 2.473 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(OC(C)(C)C)nc1 808865047 ABEMHGFNPOHZHK-UHFFFAOYSA-N 440.544 2.370 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 810109723 FKVICUIVNPKWSO-SOUVJXGZSA-N 440.521 2.296 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1 815450986 VXLQFFRHVWFFRX-UHFFFAOYSA-N 441.181 2.160 10 20 IECD Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918634987 VTBCZRQOJNWSFR-UHFFFAOYSA-N 437.475 2.387 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(-c4ccc(Cl)cc4)nn3)nc12 919091746 BNYIBJXEQRNIDE-UHFFFAOYSA-N 442.819 2.203 10 20 IECD COc1ccccc1[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N1CCCC1 919805915 APTMWADGFWDHNW-SFHVURJKSA-N 433.530 2.339 10 20 IECD COc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1OC 920418340 LKAALYMJUBUCJR-UHFFFAOYSA-N 446.529 2.249 10 20 IECD COC(=O)CC(C)(C)N(C)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 1319620149 QMXVKQKNTBWWGY-UHFFFAOYSA-N 435.546 2.198 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](Cc4nccn4C)C3)CC2)cc1 1322657110 QIXZGVLFCMYRDY-FQEVSTJZSA-N 440.592 2.215 10 20 IECD Cc1ccc(SCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1778088669 KCPRWOVGQZXRQJ-QFIPXVFZSA-N 443.525 2.037 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2ccccc2N1 1801413424 CGVHDYNPXRPMLP-WHVLKBAJSA-N 449.507 2.492 10 20 IECD O=C1CC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)c(O)c(Cl)c2)CC3)C1 1828068613 UMBGYQSIMTVGFM-JTQLQIEISA-N 435.889 2.413 10 20 IECD COc1ccccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844869313 PYJKQJFNWQBOLE-UHFFFAOYSA-N 432.480 2.305 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COc2ccccc2O1 1848075543 BYHOJNGBRULRKH-YZVOILCLSA-N 444.871 2.407 10 20 IECD Cc1cccnc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848161166 PLXNVTLNJOACKG-JMICBVPHSA-N 437.496 2.355 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1 737135197 VRKZKXMMETVUPJ-UHFFFAOYSA-N 431.514 2.164 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1O 737283975 JAJFWTVMJDEDQM-ZIAGYGMSSA-N 431.464 2.408 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)c1sccc1S(=O)(=O)N1CCC(O)CC1 745496073 GAUSHZMVVPNZNH-UHFFFAOYSA-N 449.598 2.424 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)c1ccc(OC)cc1 746109978 YVMJCHAGDRZYKD-UHFFFAOYSA-N 435.521 2.194 10 20 IECD Cn1ncnc1COc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1 746630516 CNTMXFMJRPADRC-UHFFFAOYSA-N 427.530 2.473 10 20 IECD CN1CCCc2cc(CNC(=O)NCCC(=O)N3CCN(c4ccccn4)CC3)ccc21 748461835 ODPICEOEFJUJEF-UHFFFAOYSA-N 436.560 2.002 10 20 IECD Fc1cc(CNC(=S)NCC(F)(F)F)ccc1N1CCN(c2ncccn2)CC1 751001170 QICZDHUQAXOCFQ-UHFFFAOYSA-N 428.459 2.469 10 20 IECD COc1ccc(N2CCN(Cn3nnc(-c4ccc(OC)c(OC)c4)n3)CC2)cc1F 754013051 LIKVZXQBFCUTJF-UHFFFAOYSA-N 428.468 2.285 10 20 IECD C[C@@H](CO[C@H]1CCOC1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 754045110 HYBQDUOFHKWWNH-JSGCOSHPSA-N 426.516 2.178 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc(OC)c1OC 759405856 OHIJWOWUKZQLJW-UHFFFAOYSA-N 449.454 2.069 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c(C)n1-c1ccccc1 760886158 OWJHASKNGNZNBS-UHFFFAOYSA-N 444.495 2.367 10 20 IECD C[C@H]1CCS(=O)(=O)CCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 763196111 QWIOMKUGVPBAFA-ARFHVFGLSA-N 427.542 2.158 10 20 IECD O=C(CNS(=O)(=O)c1ccc(Cl)s1)NCc1cccc(Br)c1O 765747011 JSNRFOTVZYXZBM-UHFFFAOYSA-N 439.740 2.464 10 20 IECD NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NCc1cccc(Br)c1O 766201222 PVIJEFWVGYAELP-UHFFFAOYSA-N 449.710 2.151 10 20 IECD CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 767976829 BLWXRPBUTSOIHQ-QGZVFWFLSA-N 439.528 2.333 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2cccn3c(O)nnc23)NC(=O)OC(C)(C)C)cc1 780955734 SWAUZVHVXRZITD-QGZVFWFLSA-N 440.504 2.497 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782557333 CCGSPQJBHLYOQZ-UHFFFAOYSA-N 435.498 2.487 10 20 IECD Cc1csc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 788614065 ZHDSUOXJFOENQH-GJZGRUSLSA-N 434.537 2.179 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848108 ZKMPXDSQZAWADQ-SFHVURJKSA-N 447.601 2.294 10 20 IECD CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793726148 RXZIKYAMNWFEML-NHCUHLMSSA-N 436.556 2.142 10 20 IECD CC(C)NC(=O)C(=O)N1CCN(Cc2c(O)ccc3cc(Br)ccc23)CC1 798190520 SDWIPFXEVMXUSN-UHFFFAOYSA-N 434.334 2.477 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc(OC)c(OC)c3)CC2)cc1 804317931 TVGHILZDQJPXPS-UHFFFAOYSA-N 441.528 2.456 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(Cc3ccccc3)OC)cc2F)CC1 805007717 YNLSNPWYCQMYTG-UHFFFAOYSA-N 428.508 2.174 10 20 IECD Cc1c(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 813683192 WUIIVROTMMTRSG-UHFFFAOYSA-N 434.257 2.493 10 20 IECD COCCn1cnnc1SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917157641 OMQOFJDVWPIOMS-HUUCEWRRSA-N 437.541 2.086 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3csc(-c4cnn(C)c4)n3)CC2)cc1 917300778 OPKFKOXRBLASKD-UHFFFAOYSA-N 441.513 2.058 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)cc2)C1 917833024 KNRJZJZUWAYUQI-NHCUHLMSSA-N 434.540 2.053 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc1OC 1115865074 RIJMSNHOYXSKQG-UHFFFAOYSA-N 439.515 2.142 10 20 IECD CN1CCN(c2ccc(CNc3cccc(S(=O)(=O)N4CCOCC4)c3)cc2F)CC1 1321893567 VCETYYBIRFACMF-UHFFFAOYSA-N 448.564 2.211 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O 1342915632 JIIXTYAZDWTKAQ-SJORKVTESA-N 446.887 2.395 10 20 IECD O=C(/C=C/c1cc2ccccc2o1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1778110102 QYESDKYUTQGNIJ-QQHIZMLBSA-N 449.463 2.396 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCSCC1)C2)c1cc(O)c(O)c(Cl)c1 1799770070 DUFWGRMZAPDXDT-XOIINTDNSA-N 440.949 2.098 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncc(F)cc1F)CC2)c1cc(O)nc(O)c1 1816720046 DKZKYUPATQLHGO-JTQLQIEISA-N 447.423 2.162 10 20 IECD C[C@@H](CC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291688 ZAMXJIZOSFVNNN-IINYFYTJSA-N 449.895 2.292 10 20 IECD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1827425133 XYTZRDFMHNHGOZ-MAUKXSAKSA-N 431.533 2.277 10 20 IECD O=C(c1ccc2nn[nH]c2c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502071 LHNFPYCKEQCNEU-UHFFFAOYSA-N 427.848 2.153 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(SC)c3)CC2)cc1 56966391 ZMETVBCMJBVGEH-UHFFFAOYSA-N 428.558 2.294 10 20 IECD CCCCS(=O)(=O)N1CCC(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 107820378 NXXBKLAADPZSKW-UHFFFAOYSA-N 437.606 2.324 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccnc(OC3CCOCC3)c2)n(C)c2ccccc12 515147984 PPMIOBTWVDVOGD-UHFFFAOYSA-N 436.512 2.372 10 20 IECD CCOc1cccc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 730119664 NYAUMZOWOSLULJ-UHFFFAOYSA-N 443.523 2.488 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCN(CCS(C)(=O)=O)CC3)ccc21 731650605 IELXVZRSWQHKOA-UHFFFAOYSA-N 435.590 2.143 10 20 IECD CCCN(CC(=O)NN1C(=O)N[C@@](C)(c2cccc(OC)c2)C1=O)Cc1ccccc1O 733794617 NZXIWCPJFVQKQF-QHCPKHFHSA-N 440.500 2.111 10 20 IECD O=C(CSc1n[nH]c(-c2ccccn2)n1)NCc1ccc(N2CCOCC2)c(F)c1 735233843 GMFYYLDAXPACLP-UHFFFAOYSA-N 428.493 2.251 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(O)c(Br)c3)cc2)C1 742049895 HKMQQCKOGNPNJN-ZDUSSCGKSA-N 433.306 2.181 10 20 IECD O=C(Nc1cnn(Cc2ccncc2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 746363083 LALUYCVMZKPPSE-HXUWFJFHSA-N 435.484 2.178 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CNC(=O)OC(C)(C)C 749872916 XSRJRJLLEYCQOV-AEFFLSMTSA-N 447.580 2.348 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)n1cccn1 750873968 CDNAPGAUIHZQIM-GHTZIAJQSA-N 427.549 2.176 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)S(=O)(=O)CC4)cc2)C1 764234209 JAUMDBNWHDTZJC-KRWDZBQOSA-N 442.541 2.040 10 20 IECD O=S(=O)(Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)c1cccc2nonc12 765028052 IKPGAWNUBBOLSF-UHFFFAOYSA-N 442.906 2.462 10 20 IECD COc1ccc2c(c1)CCCN2Cn1nc(CCC(N)=O)n(C[C@@H]2CCCO2)c1=S 766342579 UMPDOOUUBQXOSZ-KRWDZBQOSA-N 431.562 2.430 10 20 IECD C[C@H]1CCC[C@H](C)C12NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 772876237 OVONIUUXGKMQSR-HOTGVXAUSA-N 446.523 2.025 10 20 IECD C[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774538237 OISMFOZHWPBMLV-RXVVDRJESA-N 436.556 2.142 10 20 IECD COC(=O)[C@@H]1CCCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 781343729 GAMUNXPYEHRFLM-FQEVSTJZSA-N 447.557 2.342 10 20 IECD C[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1 784362854 WFEXBLPSOZUJCS-VLCRHTCISA-N 427.545 2.142 10 20 IECD C[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N(C)Cc1ccccc1 788320905 RILUIZGNFDSDMB-FQEVSTJZSA-N 438.572 2.166 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 788910466 LCZGQUMFCDXNSQ-PKTZIBPZSA-N 437.540 2.254 10 20 IECD COC(=O)c1cc(F)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 790530218 HFGFWMSTKMHROF-UHFFFAOYSA-N 437.418 2.455 10 20 IECD COCC[C@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 794835620 ZQVPJLYHNXKWTD-AWEZNQCLSA-N 426.516 2.132 10 20 IECD CS(=O)(=O)[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 800633209 MOHVOVDLPSQAHH-PCRWRXJSSA-N 444.625 2.375 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N(C)C)c1ccc(N2CCOCC2)cc1 803296776 HEKHKRGERGBHGL-HTAPYJJXSA-N 442.535 2.259 10 20 IECD COCCN(Cc1scnc1C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803301152 XZOPRQKNJUQESE-INIZCTEOSA-N 446.573 2.141 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 803306179 SSKVLXXJUKESKT-MAUKXSAKSA-N 443.466 2.270 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H]1COC2(CCCCCC2)O1)c1ccc(N2CCOCC2)cc1 803312105 VIJLCEFXHFBIGS-NQIIRXRSSA-N 445.560 2.283 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cc1F 803663552 RZWAQAAGTDXCGS-UYAOXDASSA-N 434.462 2.348 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc(C2CCOCC2)cs1 806862436 LQGRZQKHLIZQNU-UHFFFAOYSA-N 430.530 2.129 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O 807096411 IDFFJUDVGMACGT-LJQANCHMSA-N 426.492 2.128 10 20 IECD CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCC(CO)CC1 807768300 GRPFYHBTKMNWQS-CGZBRXJRSA-N 439.503 2.383 10 20 IECD Cc1onc(N)c1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 809838669 BJCCBXKOPDBPAM-HNNXBMFYSA-N 439.538 2.176 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(CO)C[C@H]3c3ccccc3)CC2)cc1 812016713 NWNWOCCIUQPMMO-ZCYQVOJMSA-N 438.572 2.283 10 20 IECD Cc1cccc([C@H](CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)NC(N)=O)c1 917834951 VECRAIXTMCDAEX-FPOVZHCZSA-N 437.544 2.113 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC3CCN(CC4CC4)CC3)CC2)cc1 918058596 UZFIBIPUZHGIEX-UHFFFAOYSA-N 429.609 2.381 10 20 IECD COCCn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1797067945 VXNBXIRBBGYNBQ-QDMKHBRRSA-N 448.907 2.160 10 20 IECD Cn1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1Cl 1827428159 KFKGALIPAFJNKQ-INIZCTEOSA-N 447.923 2.427 10 20 IECD COc1cccc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845500824 SQGRJETVHMLCLX-UHFFFAOYSA-N 431.876 2.215 10 20 IECD CC(=O)N1CCC[C@@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 10703977 JCKKBFGAOZZFFV-OAHLLOKOSA-N 434.448 2.202 10 20 IECD CCCCN(C)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 209239655 YAPDKRLHDNBMFR-BOPFTXTBSA-N 435.571 2.465 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21 437004582 BOQGJGJKGZMQRT-UHFFFAOYSA-N 428.514 2.073 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)cc2F)CC1 730194986 VCRRWPHHMVYBMX-WDSOQIARSA-N 444.551 2.148 10 20 IECD CN(CCN1CCCC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 733039965 YKDUGFPGSHCTNQ-UHFFFAOYSA-N 441.555 2.180 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(CC(=O)Nc2nncs2)CC1 733958346 FBUWTRPMHAXIOR-UHFFFAOYSA-N 430.559 2.404 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccncc2F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741376892 DYTSOCUBUBXFAR-UHFFFAOYSA-N 431.445 2.315 10 20 IECD CCNC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 741804679 JUXOZBHNDJIHAV-HNNXBMFYSA-N 434.496 2.136 10 20 IECD CS(=O)(=O)N1CCC(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 742799720 MYWFCVMNTCIZED-HNNXBMFYSA-N 431.505 2.045 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 749639902 NKFWIEHKTZZUDN-UHFFFAOYSA-N 430.480 2.247 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1F 753740009 XSPUQRULUNADBE-QGZVFWFLSA-N 425.460 2.002 10 20 IECD O=C1Cc2cc(S(=O)(=O)NCc3cccc(Br)c3O)cc3c2N1CCC3 766198975 BNKIHVUPEDTNDW-UHFFFAOYSA-N 437.315 2.469 10 20 IECD COc1cc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c(O)cc1C 768445645 SFMCNKKHYBDJSN-UHFFFAOYSA-N 448.541 2.377 10 20 IECD O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771416147 LFLJSFBMCBNZDO-LIRRHRJNSA-N 438.527 2.322 10 20 IECD COc1ccc(N2CCC(NCc3ccccc3S(=O)(=O)N(C)CCO)CC2)cc1 772986801 YVGMNOQHTFBGCR-UHFFFAOYSA-N 433.574 2.067 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(S(C)(=O)=O)[C@@H](C)C3)c2C)cc1 776608474 WZEFNLMJINGDSH-INIZCTEOSA-N 447.557 2.029 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](Cn3ccnc3)C(C)(C)C)CC2)cc1 778244344 CQJQDXVHWYWHEH-VFCOFNOGSA-N 439.560 2.328 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778326773 RDPUIFVICHDICV-ZHACJKMWSA-N 441.528 2.477 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CCC[C@@H]1CCO 779540399 QZWSISPTXRYHEK-QUCCMNQESA-N 442.539 2.293 10 20 IECD CC(C)CN1CCO[C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 785413759 IINPPBOOFBWTDM-QFIPXVFZSA-N 430.593 2.108 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1 788013652 ICEQMIVIFIAZLI-HXUWFJFHSA-N 438.572 2.458 10 20 IECD COc1cc(Br)cc(CNCc2ccc(S(=O)(=O)CCO)cc2)c1O 791006868 QANZLRNJJYBOSA-UHFFFAOYSA-N 430.320 2.219 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3c(F)c(F)cc(F)c3F)c2)CC1 795318134 GPXOBLOMUXBTOB-UHFFFAOYSA-N 438.424 2.279 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@H]1COC(=O)N[C@@H]1CCOC1 796529323 GYMQZEZRTRDQBE-CTNGQTDRSA-N 432.565 2.081 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](c3ccc(F)cc3)c3cnn(C)c3)ccc21 803686851 IOOAFTKNJCZKCP-JOCHJYFZSA-N 435.503 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOc4cc(O)ccc4C3)CC2)cc1 804567128 IROMTNZOZMRYAY-HJWRWDBZSA-N 437.496 2.027 10 20 IECD COc1cccc2c1OC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2 804674812 MKKNJCCPUCJMNO-MOPGFXCFSA-N 440.496 2.028 10 20 IECD C[C@H](NC(=O)NC[C@H](N1CCOCC1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 804988523 CRGBDQDZVZGNIT-YJBOKZPZSA-N 430.471 2.147 10 20 IECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 806180109 KAHKKRGNUVNIEA-PMACEKPBSA-N 428.577 2.399 10 20 IECD CCN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1)CC(F)(F)F 807291192 UMMCEUYYTYTJND-SFHVURJKSA-N 438.494 2.412 10 20 IECD COc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807291929 QJALNJGIYAIUSL-UHFFFAOYSA-N 434.540 2.032 10 20 IECD Cc1cc(F)c(S(=O)(=O)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 814802567 NGWIKIAETRKMHI-UHFFFAOYSA-N 442.459 2.339 10 20 IECD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1 815097044 LQXCBONMEFYXNC-QHCPKHFHSA-N 425.529 2.359 10 20 IECD NC(=O)c1ccc(CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)cc1 917020962 DSTVIMMKXOMDCK-UHFFFAOYSA-N 440.519 2.042 10 20 IECD CCc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 919391483 IUJPGDHGIPBMKU-GJZGRUSLSA-N 430.480 2.265 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1C[C@H](C)O[C@H](C)C1 921203347 FZLPKWXWGLQKIL-MXKPZRPRSA-N 430.593 2.138 10 20 IECD C/C=C/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783222776 LLRABKLFIRPHLO-SMOHMGIOSA-N 442.512 2.463 10 20 IECD O=C(CC(F)(F)C(=O)O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788569278 ZZDXPODRSGQNAJ-UHFFFAOYSA-N 435.383 2.351 10 20 IECD COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1795511945 SQGPYSDRYAQSLX-BCDXTJNWSA-N 425.485 2.386 10 20 IECD Cc1cscc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1796581953 XFUMURKCCRXBGT-VBUUTPMESA-N 444.509 2.090 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798600613 BBARNVGTVVFECK-REBRKWNGSA-N 437.924 2.308 10 20 IECD COC1(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1813672418 BNMNXFNGSWQFFW-IIBYNOLFSA-N 440.500 2.167 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccno2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146438 IBYYHXQFPJEHMP-QGZVFWFLSA-N 447.455 2.497 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2ccnn2c1 1821509919 LRABLQPJXYCEKI-KRWDZBQOSA-N 447.455 2.483 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821687085 JFSSZUHEMOAWAA-FZMZJTMJSA-N 447.448 2.083 10 20 IECD O=C(Cn1cncn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736459 DTJOUVCGOZGMCU-QGZVFWFLSA-N 447.923 2.276 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H]2CCC(=O)NC2)C3)cc1 1845397755 PMKVJNATBQRCPG-FQEVSTJZSA-N 434.540 2.437 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(N2CCNC2=O)ccc1F 303838660 SEJZVGYNIHJHHL-UHFFFAOYSA-N 430.455 2.386 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(NS(C)(=O)=O)cc3F)ccc21 728294456 CWGXPCCSCOJFLB-UHFFFAOYSA-N 427.523 2.058 10 20 IECD C[C@H]1CN(C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 729597910 UEWLXJZFNVILRU-WSTZPKSXSA-N 434.556 2.446 10 20 IECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 731125758 MBDNGVBEKRFXNR-UHFFFAOYSA-N 435.484 2.370 10 20 IECD O=C(CN1CCN(c2cccc(F)c2F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 734486430 MFFNPSZJBLQVLL-UHFFFAOYSA-N 448.489 2.379 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1 734686989 AIEYYRVZFXZWGD-UHFFFAOYSA-N 446.573 2.286 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 735394832 UNLSIWHZDAMFRI-UHFFFAOYSA-N 440.500 2.275 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccccc1CN1CCOCC1 741151218 YBFXCGXPCRHUBN-UHFFFAOYSA-N 425.529 2.400 10 20 IECD COc1ccc(C[C@H](CO)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1O 745649167 QYQLQQBVAUZUNQ-SFHVURJKSA-N 447.507 2.027 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](O)[C@H](C)c3ccc(C)cc3)CC2)cc1 745753402 CKCLVYOSTJHCPJ-JPYJTQIMSA-N 426.513 2.360 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1C 745938958 MFHMTXTWNMMDGV-CYBMUJFWSA-N 443.472 2.360 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)C1 746146311 FBMBZIOMLNKRAG-HXUWFJFHSA-N 436.556 2.279 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccccc3Br)c2)CC1 748674972 SCJIXVZZDCXJME-UHFFFAOYSA-N 445.360 2.485 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 750276499 JAPSQRNYCOIFJI-DJAUYKNWSA-N 436.622 2.196 10 20 IECD CC[C@H]1CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)[C@@H](CC)CN1C(C)=O 752911231 ZWZGONSJNLOMLA-SFTDATJTSA-N 445.608 2.248 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 759370058 NHUFNVMPNZAMKU-UHFFFAOYSA-N 433.599 2.397 10 20 IECD CCc1noc2ncc(S(=O)(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc12 762573982 HGXCFNGUHUFCMN-UHFFFAOYSA-N 429.502 2.288 10 20 IECD CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 765255066 OUSPXALQGBOXOK-APWZRJJASA-N 430.574 2.147 10 20 IECD C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 765896465 IYQKFXNWILIEGV-INIZCTEOSA-N 430.014 2.336 10 20 IECD CC1(C)NC(=O)N(CCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1=O 768916456 QXBNQMHCPAVZFR-MRXNPFEDSA-N 436.940 2.237 10 20 IECD C[C@@H]1CN(C(=O)c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@@H](C)O1 769710194 ILASPWMSZGSDGU-ZIAGYGMSSA-N 447.513 2.265 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccnc(S(N)(=O)=O)c3)c2C)cc1 772436482 LDUPIPFIIYDMLT-UHFFFAOYSA-N 427.482 2.485 10 20 IECD C[C@@H]1COCCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 772996971 FUQRGFOLPIBXLW-QGZVFWFLSA-N 428.512 2.263 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@](C)(C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 774841131 SUQBUICPGGLMAW-AQKDONEWSA-N 448.539 2.412 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)c(C)cc3C)c2)CC1 780408090 WEBZGTHTJHYIFE-UHFFFAOYSA-N 431.514 2.471 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cn(C)nc3-c3cnn(C)c3)cc2F)CC1 780618864 HWHXHOXZBGAQFG-UHFFFAOYSA-N 425.512 2.032 10 20 IECD Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789558912 FNOXNRXCWHPBGZ-UHFFFAOYSA-N 437.475 2.411 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 789812624 NUFDXRUORWXXKT-OAQYLSRUSA-N 445.466 2.018 10 20 IECD Cc1nc2cc(F)c(F)cc2n1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 793127746 XCJROHMEHWRAON-UHFFFAOYSA-N 448.495 2.174 10 20 IECD COc1ccc(N2CCN(CCN[C@@H](C)c3cc(S(N)(=O)=O)c(C)cc3C)CC2)cc1 794806652 UHJIBVFWCKLVMQ-IBGZPJMESA-N 446.617 2.432 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccnc1OCC(F)F)c1ccc(N2CCOCC2)cc1 803307717 LACJXNQKWNNHRT-OAHLLOKOSA-N 448.470 2.056 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1 805155198 WOFDPVQHMQBQOJ-UHFFFAOYSA-N 429.517 2.096 10 20 IECD O=C(Nc1ccc2c(c1)C(=O)OC2)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808939497 IPATWFATZWUOKM-QGZVFWFLSA-N 443.887 2.435 10 20 IECD C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920882033 KREHTDHDVZLFDB-AWEZNQCLSA-N 433.486 2.326 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc(CN4CCC[C@H]4C(N)=O)c3)CC2)cc1 920928349 OZTSFDMOCVRANE-QFIPXVFZSA-N 437.544 2.499 10 20 IECD CC1(C)CC(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)C1 1784030642 JKGSAYSIDWSFMF-DOHLAZSCSA-N 430.501 2.083 10 20 IECD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)ccc1F 1794354658 MVRIVMJQKZKLNX-IVWMJMPLSA-N 449.866 2.111 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1804329947 AUGUDWDZZWJWGJ-LLLHUVSDSA-N 431.583 2.289 10 20 IECD CC[C@@H](C)[C@H](N)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809714200 XYSHDRRPBZUSSW-QOWAEHBASA-N 445.560 2.421 10 20 IECD O=C1CC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)C1 1823410080 ZSHQTLABSPQYLT-YERXGYGTSA-N 440.456 2.211 10 20 IECD COc1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccc1O 1844945261 SVPMICCFSNXJCM-UHFFFAOYSA-N 448.479 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(Cc4ccccc4)c3)CC2)cc1 21997628 LGERAHPCIZKVGS-UHFFFAOYSA-N 434.496 2.446 10 20 IECD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565853 GPCNWINFBVOVKS-FEBSWUBLSA-N 445.466 2.180 10 20 IECD C[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2O1 730018570 XOYRNMBRVQEPIF-WBVHZDCISA-N 429.542 2.190 10 20 IECD O=C(NCCCNC(=O)c1cccc(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 732242521 YTLVLWONBFVZOK-UHFFFAOYSA-N 432.471 2.421 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](N4CCCC4=O)C3)CC2)cc1 732444412 UCNYINBYYZNXIX-OAQYLSRUSA-N 443.592 2.004 10 20 IECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 732595106 MRFCZEQGKRNCKR-MOPGFXCFSA-N 438.528 2.461 10 20 IECD O=S(=O)(NC[C@@H]1CCCO1)c1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1 742710678 NYMTYQDLPHGLLH-QFIPXVFZSA-N 445.585 2.270 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747074780 HTPJVOHKZSQXCM-OLZOCXBDSA-N 443.477 2.013 10 20 IECD CN(C)S(=O)(=O)c1ccsc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407231 TVUWKKDQJTZHMB-UHFFFAOYSA-N 441.550 2.029 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N1CCCC[C@@H]1C(N)=O 749700614 CXTLNRXPYQMJDW-OAHLLOKOSA-N 430.530 2.300 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 751227082 CORBQINHQKLREV-UHFFFAOYSA-N 440.468 2.191 10 20 IECD CCN(CC)S(=O)(=O)c1cc(NC(=O)COC(=O)c2cccc(O)c2O)ccc1C 758548802 VPBUBFOOORNPAS-UHFFFAOYSA-N 436.486 2.232 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1C 759088484 FKDXTJGZRGZTDR-UHFFFAOYSA-N 430.479 2.483 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3COc4cc(OC)ccc43)nc12 760609726 AGVJJXDYQIBRAO-GFCCVEGCSA-N 427.413 2.230 10 20 IECD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761983456 RUZXYELWDMZELC-RDJZCZTQSA-N 431.986 2.090 10 20 IECD C[C@H](Nc1cnn(CC(=O)N(C)C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 762536667 BJDDHNNFRMYYNU-AWEZNQCLSA-N 445.479 2.186 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2 763282546 YOWQBSVPUCOFAR-OAHLLOKOSA-N 432.542 2.392 10 20 IECD O=C(Cc1ccc(O)cc1)NCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765549989 ASQLKXXPDLLAFL-INIZCTEOSA-N 433.455 2.438 10 20 IECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NCc1cccc(Br)c1O 766198900 ANPGZYWHGNWWHK-UHFFFAOYSA-N 443.319 2.278 10 20 IECD CCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 768942685 NVYUEJRHJBROCC-SFHVURJKSA-N 438.528 2.432 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)[C@@H]3CCCC[C@@H]3C(=O)OC)cc2F)CC1 772648420 CWNKCBJDIMZCRC-FXAWDEMLSA-N 441.569 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOCC4(CCCC4)C3)CC2)cc1 775431420 YCMMUMWAFGTTOW-HJWRWDBZSA-N 427.545 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@H]3c3ccc(C)o3)CC2)cc1 778283294 FDUXQOJFROOMFF-GLCJEOIMSA-N 439.512 2.402 10 20 IECD COc1ccc(N2CCN(CCNC(=O)/C=C\C(=O)Nc3ccc4n[nH]cc4c3)CC2)cc1 778668395 VWOVOAIXRWUUIR-HJWRWDBZSA-N 448.527 2.005 10 20 IECD O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1ccccc1S(=O)(=O)NC1CC1 780701650 WTLIEZOAPRZBMT-UHFFFAOYSA-N 435.571 2.206 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCC[C@@H](C)CC3)CC2)cc1 785529013 UJZOMRURKUYAGR-UXHICEINSA-N 430.593 2.409 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCN(c2ccccc2)CC1 788012267 CBFHKYPCEZBCGD-OAQYLSRUSA-N 449.599 2.230 10 20 IECD Cc1csc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 788614063 ZHDSUOXJFOENQH-GASCZTMLSA-N 434.537 2.179 10 20 IECD Cc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789833553 GYBSCFMEZHACSE-UHFFFAOYSA-N 443.519 2.249 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc4c(c3)CCCN4C)cc2CC1 790183306 KLRKQRNMMZNECY-UHFFFAOYSA-N 427.570 2.495 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1 802021241 QVXATJMJUSPGCD-NRFANRHFSA-N 436.512 2.451 10 20 IECD COc1ccc(C(N)=O)cc1S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 802889868 ZTIMQXGKBDVLDN-UHFFFAOYSA-N 445.472 2.459 10 20 IECD COc1ccccc1N1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 803423866 FSVROMGMUHPCBB-UHFFFAOYSA-N 434.540 2.473 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nc(-c2ccccc2)no1 803663719 XXNFZZLBJMTHNH-AWEZNQCLSA-N 425.464 2.478 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687783 PPIHSKSTPRLONX-APWZRJJASA-N 444.576 2.447 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2CCC(OC)CC2)cc1F 804852659 LQCWIFUKODNDCH-UHFFFAOYSA-N 436.572 2.294 10 20 IECD O=C(NC[C@@H]1CSCCS1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806468022 RCGMYHYBJNMSON-XJKSGUPXSA-N 445.557 2.338 10 20 IECD COc1ccc(C(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1[N+](=O)[O-] 917364083 CPBUSYCJZFMNMA-QGZVFWFLSA-N 443.456 2.247 10 20 IECD CC(=O)N1CCc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 917917281 FHFOZRIULSWFIH-UHFFFAOYSA-N 433.505 2.050 10 20 IECD COC(=O)c1ccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918007381 YAQCGEQFPHZTNZ-FQEVSTJZSA-N 438.528 2.217 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 918437469 HSERNQVLPFYFHB-UHFFFAOYSA-N 430.486 2.412 10 20 IECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1 919807751 CYRIWZYPCZXYPY-QGZVFWFLSA-N 446.529 2.378 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](CO)CC3CCOCC3)cc2F)CC1 1321226956 GFXVRHVJSWAJGF-FQEVSTJZSA-N 436.572 2.192 10 20 IECD Cc1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)c1 1786104081 NIXADBSAYVSYOA-AXHNFQJDSA-N 445.903 2.362 10 20 IECD CCC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786297012 NRQXXIUESAORQH-CYBMUJFWSA-N 426.473 2.155 10 20 IECD CC(C)(C)c1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cn1 1796601222 GYGJCYPWMXALFH-QDMKHBRRSA-N 425.489 2.146 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cnccc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992938 FBGIWSJFJYGLMM-VLIAUNLRSA-N 437.431 2.055 10 20 IECD CC(C)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1810433131 LOWHAGSJODTOFF-AKCHCHLHSA-N 428.489 2.021 10 20 IECD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1(O)CCC1 1814423246 ZLVUFFYUDSSSAM-WFASDCNBSA-N 429.477 2.073 10 20 IECD C/C=C/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828247487 SWHAPSSDFNPAGW-OIHBSNPPSA-N 436.584 2.048 10 20 IECD CC(C)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132893 YHXCYJFBXDZCHB-UHFFFAOYSA-N 439.560 2.007 10 20 IECD CC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1836668854 PFEIJHYHXYFDNV-KRWDZBQOSA-N 440.924 2.134 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2CCSCC2)C1 1847108390 XDRXKWVYAXRLRI-UHFFFAOYSA-N 426.542 2.126 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](C)(c4ccc(C)cc4)C3=O)CC2)cc1 3555654 KUBLSUSDYAKTHG-DEOSSOPVSA-N 436.512 2.119 10 20 IECD COc1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 727664815 BTYXMDCNJPCVDP-KRWDZBQOSA-N 426.473 2.164 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](N3CCCCC3=O)C2)c1 732796820 JBBQNUOJLFOTSV-QFIPXVFZSA-N 429.561 2.404 10 20 IECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)c1 734019073 UILHWVDGURXLII-UHFFFAOYSA-N 440.468 2.396 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 735200595 WKRIUBLPBJIPFE-PMERELPUSA-N 431.558 2.211 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CN(Cc2ccccc2)CCO1 741278784 NHKYDRRWFXOZRX-HSZRJFAPSA-N 427.520 2.304 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 742288597 ISOFKGGNFODSMN-UHFFFAOYSA-N 425.551 2.204 10 20 IECD O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804825 BQHPJYSPTDLXGT-CZUORRHYSA-N 434.530 2.293 10 20 IECD CCOC(=O)C1=C(CN(CC)Cc2cc(Br)ccc2O)NC(=O)N[C@H]1C 743870792 BHCPNBNFHSLFAT-NSHDSACASA-N 426.311 2.495 10 20 IECD COC(=O)COc1c(C)cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 752294352 MQHIHCBIGXGIIQ-UHFFFAOYSA-N 446.525 2.342 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N(CCCCO)C1CC1 755935663 FCBIFCVPOUSWMA-UHFFFAOYSA-N 442.539 2.389 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc(F)c1F 756150218 NJAKWZFGENJRGB-UHFFFAOYSA-N 426.441 2.271 10 20 IECD CCOC(=O)CSc1cncc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 758933838 BMBUKHBVXRRVFJ-UHFFFAOYSA-N 448.545 2.484 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3sc(C)nc3C)CC2)cc(OC)c1OC 759411224 DHLCVGUKYRLRJW-UHFFFAOYSA-N 434.518 2.073 10 20 IECD COc1nc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)ncc1Br 769334031 YDWYGXYUGFIEHB-UHFFFAOYSA-N 448.365 2.407 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](CO)[C@H](C)c3ccccc3)CC2)cc1 771425265 YUYKOXFHDIYAMY-XXBNENTESA-N 426.561 2.281 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 772446319 MMGGKABMKZOWIJ-RBUKOAKNSA-N 441.576 2.121 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 774804690 BRQGSJCBWQCHLI-QZTJIDSGSA-N 445.539 2.075 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1Cl 775265304 YWPFYIQCZHKXQF-UHFFFAOYSA-N 432.833 2.271 10 20 IECD O=C(NCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 778916307 CEJBQSAQVSNTGJ-UHFFFAOYSA-N 430.526 2.304 10 20 IECD CCOC(=O)c1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781442902 JDPKYBTUGHXIOE-UHFFFAOYSA-N 425.485 2.297 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCC3CCC(C)CC3)CC2)cc1 785530254 NIVUMAKNFOGWND-UHFFFAOYSA-N 430.593 2.266 10 20 IECD C[C@H](NC(=O)C(=O)NCCCc1nc2ccccc2[nH]1)c1ccc(N2CCOCC2)cc1 788458300 CSEMUJVKFKELES-KRWDZBQOSA-N 435.528 2.326 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCCO1 789956710 XLYVXPAVEOLBNZ-QGZVFWFLSA-N 443.466 2.186 10 20 IECD CC(C)c1ncc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 803303677 SHOMWVNIFSHMJW-QGZVFWFLSA-N 425.533 2.272 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc4c[nH]nc4c3)CC2)cc1 803562625 AZNLMUDPUTYQCJ-CMDGGOBGSA-N 433.512 2.135 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCc4c(cnn4-c4ccccc4)C3)ccc21 803686484 BIFQFOAAFICJCD-UHFFFAOYSA-N 429.524 2.456 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN3CCOC[C@H]3C)cc2Cl)C1 807955324 SZJMLCZJESYOPV-DLBZAZTESA-N 436.984 2.029 10 20 IECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 808835452 CCHPHYNZTXBXNM-CTNGQTDRSA-N 431.577 2.384 10 20 IECD CN(Cc1cnn(C)c1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919783988 YOBYPXSWKLMYSU-UHFFFAOYSA-N 438.511 2.017 10 20 IECD C[C@@H](NC(=O)CCNS(=O)(=O)c1ccccc1F)c1ccc(N2CCOCC2)cc1 920880706 HMYXUQLKLCQBEZ-MRXNPFEDSA-N 435.521 2.208 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CC2)cc1 1324627723 YKCFPPJMHXGQAT-SFHVURJKSA-N 431.558 2.409 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccs3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242016 GHTNVACPCHLSCA-WBIUFABUSA-N 437.905 2.115 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)N1C[C@H]2C[C@H]2C1 1800718441 YNENQVZHHNNNFZ-ABYAABTBSA-N 433.936 2.343 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803978637 ORXUOJBLVQGREL-ULMKCPKDSA-N 441.459 2.276 10 20 IECD Cc1cc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)no1 1804286399 SZSUZOVTBXXQRT-OAWROYCLSA-N 439.468 2.465 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994033 DQYLORLSDKXZSX-KKSFZXQISA-N 434.452 2.227 10 20 IECD CO[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1826163739 PUYVUTRJSIMJBG-SCZZXKLOSA-N 425.894 2.468 10 20 IECD O=C(c1cnc(Cl)nc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424660 LVWBJTDCWZPZKW-MRXNPFEDSA-N 445.907 2.483 10 20 IECD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cnn1C 1827427201 SAWWDBANGHQLTR-SFHVURJKSA-N 427.505 2.082 10 20 IECD COc1cccc2c1C[C@@H](C(=O)N1CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C1)CC2 1843250730 IHXQBPFYCVQTQW-INIZCTEOSA-N 437.496 2.124 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1 729048657 FZFOSQCDJVDBBO-QGZVFWFLSA-N 426.517 2.500 10 20 IECD Cc1cc(C(=O)N2CCN(Cc3nnnn3-c3ccccc3)CC2)c(C)n1-c1ccccn1 730776744 LAKIVGXDUNRMAI-UHFFFAOYSA-N 442.527 2.423 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1F 731409307 QBPCUSBTJHULSP-UHFFFAOYSA-N 427.480 2.117 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)NCc1nc[nH]n1 732116304 ICTYZXFBTJJVMM-WZUFQYTHSA-N 438.332 2.085 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCCN(C(N)=O)C2)NC(=O)OC(C)(C)C)cc1 742751413 UNJSOKVDNKHFGN-AEFFLSMTSA-N 433.553 2.225 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958287 QAEHXSVYGCVEOV-UHFFFAOYSA-N 445.541 2.213 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)ccc3O)cc2F)C[C@H](C)O1 745072009 KXADHKQYCHTCJD-KBPBESRZSA-N 432.448 2.324 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN([C@H](C)C(F)(F)F)CC3)CC2)cc1 749561828 IRIUEMXCCJQGQX-QGZVFWFLSA-N 443.514 2.095 10 20 IECD COC(=O)CC1(CS(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 752236398 VALJXBNHTDFVLA-HUUCEWRRSA-N 428.526 2.202 10 20 IECD COC(=O)C[C@@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 752336920 KFZSBLNENPHDPM-HUUCEWRRSA-N 436.464 2.053 10 20 IECD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(-c2nc[nH]n2)no1 752647573 CIEOIGKEPPFQEO-MRXNPFEDSA-N 444.471 2.027 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1 752689279 QLDRGQAOBZEEAH-SNVBAGLBSA-N 433.939 2.454 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](c3ccccc3)N3CCN(C)CC3)CC2)cc1F 753749185 YTMRMVJNNIGTBM-QHCPKHFHSA-N 426.536 2.472 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@@H]3COC4(CCCC4)O3)CC2)cc(OC)c1OC 759296040 ADWXUTDBMADFBW-QGZVFWFLSA-N 435.521 2.230 10 20 IECD O=C([C@@H]1CN(S(=O)(=O)c2cccc3nonc23)c2ccccc2O1)N1CCCCC1 765036469 HGSHXBCANGMSLG-KRWDZBQOSA-N 428.470 2.192 10 20 IECD CS[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H]1N(C)C 765266621 BEZIURVGLKCLMS-HOCLYGCPSA-N 441.600 2.372 10 20 IECD O=S(=O)(c1ccc(F)c(Cl)c1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768443003 VPRBRIOIOJWDNT-GOSISDBHSA-N 442.896 2.117 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c1 770160041 TXAFHLKRTFRXIP-UHFFFAOYSA-N 432.502 2.105 10 20 IECD COc1nc(O)cc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 770518641 DQZOZHJKMDZDON-LLVKDONJSA-N 447.403 2.150 10 20 IECD O=C(Cc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1)N1CCOCC1 771877839 GGEUJRRYHWLWDP-UHFFFAOYSA-N 443.887 2.416 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 781449556 MPNPVFBKXHYTMI-UHFFFAOYSA-N 443.525 2.290 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCc1nc2ccccc2[nH]1 788461920 UKDPTZKHBFPJKB-UHFFFAOYSA-N 435.528 2.107 10 20 IECD O=C(NCCCNc1ccccn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788643802 LHFVGUPQRSJJJN-INIZCTEOSA-N 447.486 2.386 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1cccc(F)c1 789862532 VBNFOOOHMKCJOL-OAQYLSRUSA-N 444.576 2.414 10 20 IECD CC[C@H](C)[C@@H](C)N(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CC1 793735178 XDXSGAFJEJUPBQ-SCTDSRPQSA-N 428.577 2.430 10 20 IECD CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1[N+](=O)[O-] 801135654 YJKSBQOPWASMOL-UHFFFAOYSA-N 435.527 2.482 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(N(C)C)cc1 803136192 YYQXOPXJKVXZBH-HRAATJIYSA-N 438.528 2.364 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOc2cccc(F)c2C1)c1ccc(N2CCOCC2)cc1 803302494 PZQIDFNBAKEJNP-INIZCTEOSA-N 427.476 2.261 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc(N2CCOCC2)cc1 803308159 BEPFPAHOPRXKKR-MYGHRHJXSA-N 443.569 2.096 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCc4ccc(C)cc43)CC2)cc1 803747817 VTBLZPVMSVJFRQ-QHCPKHFHSA-N 436.556 2.046 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1 807695284 SNKZDNBNSRIZKC-MRXNPFEDSA-N 447.333 2.293 10 20 IECD O=C(N[C@H]1CCC[C@@H]1CCO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768169 DMISUULGHBJIHC-RKVPGOIHSA-N 425.476 2.040 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 807769867 JIJYAHJJLOASHA-AXUOBQJMSA-N 449.498 2.447 10 20 IECD CCSc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccn1 807816330 SVQNJSQBAWXMIP-UHFFFAOYSA-N 428.558 2.305 10 20 IECD CN(Cc1ccccc1O)C(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2 917310377 UUPOZODWHRPGDB-UHFFFAOYSA-N 434.514 2.271 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc([N+](=O)[O-])o3)cc2F)C[C@@H](C)O1 918848240 CGBWEKIHIBOFES-CHWSQXEVSA-N 435.408 2.414 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)cc2)C1 919754313 PIBMSMZFJJWTHS-UTKZUKDTSA-N 438.503 2.197 10 20 IECD Cc1cc(NC(=O)CCNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 920092350 SULUZMUXEQNKRB-UHFFFAOYSA-N 439.495 2.357 10 20 IECD C[C@H](NC(=O)NCC1(NS(C)(=O)=O)CCCCC1)c1ccc(N2CCOCC2)cc1 920920129 AZRGCURREGHHHP-KRWDZBQOSA-N 438.594 2.136 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nnc(C(C)(C)C)n2c1 1116646313 AABXDAIBLPXHLV-HNNXBMFYSA-N 426.473 2.342 10 20 IECD C[C@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1341538558 OVGMJSXUFMTRLC-FQEVSTJZSA-N 431.600 2.096 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H]2C[C@@H](O)C2)CCO3)cc1 1781753289 KRVFKKHLSSRWBP-HOKHCIIBSA-N 437.540 2.309 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)C1=NO[C@@H](c2ccccc2)C1 1796600953 VDOWWLBQXQSLOW-SFNKJDCFSA-N 436.468 2.262 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808467655 JFSAAOJNFFDKKJ-BEFAXECRSA-N 441.438 2.145 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccccn3n2)[nH]n1)c1cc(O)nc(O)c1 1817845497 NIXQTGVLMQZGGC-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428155 KFHSYVSSCFUEBC-MAUKXSAKSA-N 446.548 2.031 10 20 IECD C[C@H](Cc1ccccn1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846525526 RSZJWCMUHQSITR-MNDMWVCDSA-N 437.496 2.294 10 20 IECD O=C(CSc1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847769100 XNCWBUKQBJTQHM-GJZGRUSLSA-N 435.452 2.379 10 20 IECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccc(N(C)C)cc3)c2)C[C@@H](C)O1 15135010 JDIOAEHSEPIZAG-CALCHBBNSA-N 431.558 2.481 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](n4ccnc4)C3)CC2)cc1 728741052 MKJYNPFSQGCDDD-OAQYLSRUSA-N 426.565 2.451 10 20 IECD CCN1CCN(c2ccc(CNc3cccc([N+](=O)[O-])c3S(N)(=O)=O)cc2F)CC1 730108231 IHGAKCNAVSAFFL-UHFFFAOYSA-N 437.497 2.135 10 20 IECD CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)o3)cc2)CC1 731017157 YZKMKCZBFRFKIA-UHFFFAOYSA-N 447.557 2.467 10 20 IECD CCc1cc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n[nH]1 736653776 STRADKMJAPSFHA-UHFFFAOYSA-N 438.511 2.227 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2cnn(C)c2)CC1 746669499 VRVVDPBYLRDHNR-MRXNPFEDSA-N 443.507 2.345 10 20 IECD O=C(NC[C@H]1CCC[C@H](O)C1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748320962 QHOYYRYUDPNHTJ-BBRMVZONSA-N 449.485 2.382 10 20 IECD CS(=O)(=O)CC1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 752004399 GSJJBFBOUQGISE-UHFFFAOYSA-N 449.495 2.166 10 20 IECD C[C@H]1[C@H](C)CCN1CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 752318193 IGHPWDGSVWFAGU-BCZDJZIOSA-N 447.582 2.463 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3c(S)nc4ccccc4c3=O)CC2)cc1F 754028453 SHSGHHCLCPMWBT-UHFFFAOYSA-N 428.489 2.182 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C4CCC(C)CC4)CC3)CC2)cc1 754042969 GOZZWNXKLQBTIS-IWAAJCSBSA-N 430.637 2.374 10 20 IECD CN(CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OCc1ccccc1 756668423 ZBCOULQSMJNINU-HXUWFJFHSA-N 438.528 2.273 10 20 IECD COCCc1noc(CN(C)[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 758802959 PVGTXUJLPHHOAZ-CQSZACIVSA-N 448.479 2.493 10 20 IECD Cc1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)n(-c2ncccn2)n1 768012847 ZFKLJQIBGGVAOM-UHFFFAOYSA-N 432.440 2.437 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)N3CCc4ccccc43)CC2)cc1 778239135 QAMIVAUCGVHYFW-YVNCXZRQSA-N 448.567 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@]3(O)CCCc4ccccc43)CC2)cc1 778296222 VPGOHVXGZQVBFV-JYSHFMIGSA-N 449.551 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3c3cn(C)nc3C)CC2)cc1 778326310 NGBRFNGIIWKPIE-GMAFFVFYSA-N 437.544 2.306 10 20 IECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 782097956 OYCCSNXEZAURNG-SECBINFHSA-N 448.225 2.271 10 20 IECD COCn1nc(C)c(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)c1C 789728756 WOJKEVLTHZAWPT-UHFFFAOYSA-N 425.492 2.143 10 20 IECD COC[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789821544 TXGUPYRXBAQWFQ-JENIJYKNSA-N 435.540 2.331 10 20 IECD CC(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793723895 OGQDACDPMHAGLD-PMACEKPBSA-N 428.577 2.289 10 20 IECD CC(C)n1cnnc1CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 795626367 TUXJGVLDFOGSBQ-CALCHBBNSA-N 432.544 2.360 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c(O)c1 797387128 DZGUKFJORSCBAE-UHFFFAOYSA-N 425.485 2.211 10 20 IECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803308096 SWBPUXAPBNCROI-OXJNMPFZSA-N 439.512 2.349 10 20 IECD C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450524 JULQIFGXLFBJNW-GJZGRUSLSA-N 425.476 2.304 10 20 IECD CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806282918 YJSQJTOBGPQPOC-ZDUSSCGKSA-N 428.580 2.115 10 20 IECD O=C(NCC[C@@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807320455 JOEBWWLNOUYDJK-WBVHZDCISA-N 425.476 2.448 10 20 IECD CCOC[C@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770589 NAGQSVPAFOMNEL-JKSUJKDBSA-N 425.476 2.258 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 807847250 ULMYCYCJWSTHPS-OAQYLSRUSA-N 436.556 2.061 10 20 IECD COC[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@H]1CCCO1 809451432 RLEMGHPFHDPJKN-NHCUHLMSSA-N 429.517 2.185 10 20 IECD CN1C(=O)NC2(CCN(Cc3cc(Br)cc(Br)c3O)CC2)C1=O 809749123 BWAJWGNMEMTDFS-UHFFFAOYSA-N 447.127 2.433 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(CO)C[C@H]3c3ccccc3)cc2)C1 812011327 ZFEZIIXRBAYFDT-JLRUASKGSA-N 436.556 2.354 10 20 IECD CN(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917086909 NKKZDYUHNBRHOE-UHFFFAOYSA-N 438.481 2.433 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCc2cc(F)c(F)cc21 918442279 DGUOVWPSEAKSDI-UHFFFAOYSA-N 429.467 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 920252025 FRPPMIJVUSXWOO-VDZCTEQFSA-N 448.567 2.291 10 20 IECD CC(C)C(=O)Nc1ccc(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920636964 QIBCQDCJGCWITK-UHFFFAOYSA-N 434.470 2.398 10 20 IECD CC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C[C@@H]21 1783961216 DQJLMLGATJJDPY-UDIDDNNKSA-N 439.556 2.458 10 20 IECD CCc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795322162 ZSMUOGGARPLQOW-RRJKNOHSSA-N 427.457 2.319 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1C 1797110827 WHWBJCBAGYCFMH-FNLKRUPLSA-N 433.512 2.378 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cc1 1802080228 HPHCEMIEWSNYHL-APZHPHOLSA-N 438.480 2.028 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1824886331 CTYCEUROQMCXED-XBFCOCLRSA-N 441.488 2.206 10 20 IECD O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429730 QOLLGLVFIUGZPO-YRXWBPOGSA-N 429.517 2.294 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)CCC3CCC3)CC2)CC1)c1cc(O)nc(O)c1 1834985947 RSONAERRRIKKJF-UHFFFAOYSA-N 430.549 2.258 10 20 IECD O=C(c1ccc2nccnc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037930 XEBDJYQNHKFAMV-QPJJXVBHSA-N 446.463 2.277 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)n(C)c1 108431376 FMRDUUZICFCWCU-UHFFFAOYSA-N 448.589 2.417 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(C(=O)NCc3ccco3)c2)c1 115735224 IIGZDPVHOKPUQE-UHFFFAOYSA-N 443.481 2.217 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](C)NC(=O)C3CCCCC3)nc12 727530391 ADEZKQYVETYLSX-CYBMUJFWSA-N 432.477 2.130 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCN3C[C@H](C)O[C@@H](C)C3)cc2F)CC1 730115672 XNLAXIOVWNOLHU-OALUTQOASA-N 435.588 2.266 10 20 IECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 736070620 ZHGQXYYWCZRDJD-LMNJBCLMSA-N 443.592 2.225 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(S(=O)(=O)C(C)C)cc3)CC2)cc1 742921175 ZHNCLLGHPABVSG-UHFFFAOYSA-N 445.585 2.429 10 20 IECD COCCN1CCC(N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 743485793 PRRPHJJSVDCFSU-INIZCTEOSA-N 435.524 2.489 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 743955090 HMIHGUWCYITAKJ-UHFFFAOYSA-N 443.525 2.066 10 20 IECD COc1ccc(C[C@@H](CO)CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1O 745778360 BCZQQTRKVAERIQ-IEBWSBKVSA-N 443.544 2.449 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@@H](C)N3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2)CC1 746237565 OVDLUVUQUSXHIE-WEUUYRGXSA-N 425.529 2.090 10 20 IECD O=C(NCCCOC[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748043545 XTXJDQIAFLTTFN-AWEZNQCLSA-N 440.543 2.428 10 20 IECD CCc1cccc(NC(=O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 748461473 LIJRCBRHDLWSBZ-LJQANCHMSA-N 437.544 2.389 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccccc2O)c(C(=O)N2CCCCC2)cc1OC 748482133 QHWIMSHAOQHWAK-UHFFFAOYSA-N 441.484 2.290 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(N(C)C)n1 750217052 ZVGCSJYQTICKHF-HOTGVXAUSA-N 443.523 2.464 10 20 IECD O=c1ccc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2o1 751227862 MQOFDCRPNPUZKF-UHFFFAOYSA-N 432.473 2.372 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2 751265390 MSFGEIUSWREPKP-UHFFFAOYSA-N 430.373 2.363 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C(=O)[C@@H]4CSCN4C3=O)c2C)cc1 752913739 WTVJNRNNGISYKO-KRWDZBQOSA-N 427.482 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C)c(C(=O)N(C)C)c3)CC2)cc1F 754213403 RVQCIMQDVIPWEZ-UHFFFAOYSA-N 442.491 2.132 10 20 IECD COC(=O)c1cn(C2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)nn1 759246030 JDCAZIDPGGMEID-INIZCTEOSA-N 442.520 2.009 10 20 IECD COC(=O)CCc1csc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 769014632 ZHZQACYKMVDXMD-OAHLLOKOSA-N 445.545 2.272 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)c1 769636760 IMCCVIRJMRWJKM-UHFFFAOYSA-N 432.502 2.190 10 20 IECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1 770318075 ZGWWULUUEUUGJJ-INIZCTEOSA-N 432.546 2.073 10 20 IECD CC(C)c1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 780820739 KRZXPEOCVHKTQN-SFHVURJKSA-N 433.484 2.452 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)Cc2ccc(Br)s2)cc1 785438282 BNFLJURCIOGFNN-UHFFFAOYSA-N 440.363 2.214 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1 785442424 KQBUKBLMHJNSOB-HSZRJFAPSA-N 430.549 2.228 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc([N+](=O)[O-])c3C)cc2)CC1 786122263 PKLALELVWKODGP-UHFFFAOYSA-N 432.502 2.050 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCCC1 786627545 LNBWNTBNOAYXSE-QFIPXVFZSA-N 448.583 2.295 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 786668491 VNVJXACZBFCLKC-MRXNPFEDSA-N 427.501 2.034 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](O)Cc4ccccc43)cc2F)C[C@@H](C)O1 789352024 CYTZTDOQKOHBFZ-FUHIMQAGSA-N 427.520 2.479 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1 789862929 YSJVKAKJCWTPSL-UTKZUKDTSA-N 435.615 2.027 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H](C)c1cccnc1 793722971 MBIWDKMHSXWNFQ-XLIONFOSSA-N 437.544 2.009 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccc(N2CCOCC2)cc1 803304087 CSPSQOIHIPWLEX-OXQOHEQNSA-N 429.542 2.362 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCOc2ccc(F)cc21 805602523 KVXOYEUGYKMJOD-HXUWFJFHSA-N 427.476 2.261 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(Cl)cc4c3OCC(=O)N4)ccc21 806878958 QGSAKBCOVVLASB-UHFFFAOYSA-N 428.876 2.308 10 20 IECD COc1ccc(N2CCCN(C(=O)NC3C[C@@H]4CC[C@H](C3)N4CC(=O)N(C)C)CC2)cc1 807513344 APVSDQMSGDQSFT-VCSGRIEYSA-N 443.592 2.001 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3C[C@@H](c4ccccc4)OC3=O)CC2)cc1 808589891 HLQJDUKYMLABQJ-RTWAWAEBSA-N 438.480 2.191 10 20 IECD O=C(CN[C@@H](C1CC1)[C@]1(CO)CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 815289693 JEHXCPYQPLVZJS-LOSJGSFVSA-N 434.492 2.310 10 20 IECD CNC(=O)[C@H]1CN(C(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c2ccccc2O1 918296680 YKDSKSUGDWCZRY-OAQYLSRUSA-N 449.463 2.054 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCN(c4nccs4)CC3)cc2)C1 920812181 LYXMSBLRAZQFTR-GOSISDBHSA-N 442.589 2.267 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC([C@@H]3C(=O)Nc4ccccc43)CC2)c1 1324753866 ZBOGVULEQSLZAJ-IBGZPJMESA-N 429.498 2.352 10 20 IECD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c(Cl)c1 1785034167 VWXWQANCPUEUSD-OAQYLSRUSA-N 431.876 2.212 10 20 IECD CC(C)N(C)CC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792315932 IMTSRKAFEVECLU-UHFFFAOYSA-N 448.614 2.321 10 20 IECD Cc1c[nH]c(C)c1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1793272507 ZBQDNAGEHZFMDT-MUJYYYPQSA-N 448.614 2.063 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(F)c1 1793792912 JYAGUOXFWDETRA-KOTZLPFRSA-N 427.432 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2cc(Cl)ccn12)c1cc(O)nc(O)c1 1796522375 PQRCWEYXUKUJOS-QDMKHBRRSA-N 441.875 2.360 10 20 IECD COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c(O)c1 1810546454 HVVZNAUZQWLGHI-UHFFFAOYSA-N 441.484 2.366 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(O)cc1 1811933319 XVMRLUGXPLKWSG-KKSFZXQISA-N 434.452 2.227 10 20 IECD Cc1nn(C)c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815390548 SQLDYBCPNSQAHA-OAHLLOKOSA-N 439.476 2.186 10 20 IECD CC(C)N[C@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(C)C 1843001558 AWFIBQYCDFVSDY-XSBJJCPUSA-N 431.533 2.043 10 20 IECD COc1cscc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441723 RTSSNLXFIOEJEM-UHFFFAOYSA-N 438.509 2.367 10 20 IECD Cc1cncc(CCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847033941 PROJHHJNTSIGQM-VMPITWQZSA-N 437.496 2.356 10 20 IECD O=C(c1c(F)cccc1Cl)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055455 LEOCMIGCFKGQLD-UHFFFAOYSA-N 441.937 2.156 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCC(O)CC3)c2C)c1 26858708 UGWDCMVHTQBFTN-UHFFFAOYSA-N 428.485 2.307 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 728582021 LRMHUMUCQLVRAS-UHFFFAOYSA-N 440.468 2.457 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 729793511 QYNRCXCORLKFHQ-SJLPKXTDSA-N 448.541 2.294 10 20 IECD CC(C)[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 734270671 WKMSZXBVKFWZBL-KRWDZBQOSA-N 428.455 2.208 10 20 IECD O=C1CCc2cc(OC[C@@H](O)CNC(=O)NCc3ccc(N4CC=CC4)cc3)ccc2N1 741090962 SOLLXBDCVKMOPR-FQEVSTJZSA-N 436.512 2.187 10 20 IECD O=S1(=O)CCN(c2ccc(CNC(=S)N[C@@H]3CCOc4ccccc43)cc2)CC1 741491706 LCHURHQQOVTBAH-LJQANCHMSA-N 431.583 2.409 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN(C)S(=O)(=O)CC 745569419 HXGDSCWHFOKDFA-UHFFFAOYSA-N 436.372 2.358 10 20 IECD CCS(=O)(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 748091215 HAZIXIARHNBTJP-UHFFFAOYSA-N 447.557 2.031 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(OCc4ccccc4)cn3)nc12 759051968 AHEKWHJFPAPOPD-UHFFFAOYSA-N 449.423 2.338 10 20 IECD C[C@H](CC(=O)N1CCOc2cc(N(C)C)ccc21)NS(=O)(=O)c1cccnc1Cl 760678858 NHIWYLWOFHIQBM-CYBMUJFWSA-N 438.937 2.284 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 766343169 MYMYAMQVFQLWCE-UHFFFAOYSA-N 443.500 2.146 10 20 IECD CC[C@]1(C(C)C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768517805 VCQRPBKVJTUOMD-VBURHUQHSA-N 448.539 2.412 10 20 IECD CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769807452 BJNHWYGTNPQHOV-AWEZNQCLSA-N 429.539 2.433 10 20 IECD O=C(Cn1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1)NC1CCCC1 772456168 AQOBTKMKOJFMJH-HXUWFJFHSA-N 426.517 2.469 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@H](N2CCNC2=O)C1 782971765 NKIZYOIROHMFOV-RDJZCZTQSA-N 437.491 2.456 10 20 IECD Cn1cnn(-c2ccc(NC(=O)C(=O)N(CC3CCCC3)c3ccc(N)cc3)cc2)c1=O 784110835 GZBSVOACYKROAN-UHFFFAOYSA-N 434.500 2.315 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3ccc(-n4cncn4)cc3)CC2)cc1 785394849 DQRKNAGJFGAGHY-KRWDZBQOSA-N 448.527 2.238 10 20 IECD COc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 785849769 AIOMGXLLZCCOHW-UHFFFAOYSA-N 434.443 2.093 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccnc1OC1CCCC1 787260294 XBPGYYUTCODPNG-UHFFFAOYSA-N 438.528 2.172 10 20 IECD CS(=O)(=O)c1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1Cl 788340060 WIRLADNKQAMRGZ-UHFFFAOYSA-N 433.964 2.437 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(Cc3cscn3)CC2)cc1 788951959 PBQOTMNUJIZRSV-UHFFFAOYSA-N 429.590 2.340 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCn4cccc4[C@H]3C)cc2F)C[C@@H](C)O1 789822325 ABBYHFLCNQLCLS-BRWVUGGUSA-N 428.508 2.460 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]3(C)CCCO)cc2F)C[C@@H](C)O1 789823079 YRKSLTKPDNSWEM-MFEFFIJZSA-N 435.540 2.209 10 20 IECD Cc1ccc2c(c1)CCN(C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2 789834227 KXSBMHJMBVTZGM-UHFFFAOYSA-N 425.504 2.296 10 20 IECD COc1ccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c(O)c1 794382444 XCYDIRGYRALPRO-GOSISDBHSA-N 438.571 2.426 10 20 IECD CO[C@@H]1[C@H]2C[C@@H]3CN(CC(=O)NCc4ccc(N5C[C@H](C)O[C@@H](C)C5)c(F)c4)[C@H]1[C@H]3C2 796321057 SKZODCBJKXQWKB-DAJTUIRZSA-N 431.552 2.411 10 20 IECD CCOc1ccc(NCc2cc3c(cc2O)OCO3)cc1S(=O)(=O)N1CCOCC1 796404567 ATOYRGHRUGMNKG-UHFFFAOYSA-N 436.486 2.153 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CCO)Cc3ccccc3)CC2)cc1 799811547 KSOVATPAJKEGCY-RJRNSMGGSA-N 437.540 2.010 10 20 IECD CC(C)[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803448843 FIFJHONPULFGQN-GOSISDBHSA-N 425.476 2.256 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4ncccc4Cl)C3)ccc21 803685886 NWUWGSAMVROUDE-QGZVFWFLSA-N 427.936 2.129 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804316655 HLJQFSJYURTXRT-KRWDZBQOSA-N 445.560 2.218 10 20 IECD COc1ccc(F)cc1CN1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807678334 WIZVWFROIVTJFG-QGZVFWFLSA-N 442.535 2.422 10 20 IECD CN(CC1(N(C)C)CCC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771591 WCOWOLJVOCTYAN-MRXNPFEDSA-N 438.519 2.316 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 808345709 GGMPJAXELVQWEU-PKTZIBPZSA-N 444.620 2.374 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1 809795252 OJONXAPZRWAVPA-BHDDXSALSA-N 425.529 2.452 10 20 IECD COC(=O)C12CCC(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)(CC1)CC2 814577666 NXOSGLBVNMELES-UHFFFAOYSA-N 434.558 2.051 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC4(CC3)OCCCO4)cc2F)C[C@H](C)O1 815156452 IBEIKOQIPBMPFJ-ROUUACIJSA-N 435.540 2.285 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 918612342 IZBHKWIMMRCGRX-UHFFFAOYSA-N 448.401 2.002 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)CCOC)cc3)CC2)cc1 1320024592 WJFSIYHAYUTHEE-UHFFFAOYSA-N 432.542 2.468 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1326063685 YFGLOTDVQXMMJR-INIZCTEOSA-N 442.896 2.183 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2 1782001837 CYIYXKRDSAYGOD-OAQYLSRUSA-N 447.875 2.374 10 20 IECD Cc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)c1 1790243564 XYNXXAYQTYRATM-RFUYNDQBSA-N 445.903 2.362 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@H]1CCOC1 1803354266 QDJXEEQYLSLFGP-PXEDIVGCSA-N 430.501 2.272 10 20 IECD O=C(NC[C@H]1CCN(C(=O)COc2ccccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990237 GZMHFEQSJPAESI-HXOBKFHXSA-N 448.479 2.286 10 20 IECD Nc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)s1 1826993784 BXLYNFZIFJLKIP-CQSZACIVSA-N 431.518 2.079 10 20 IECD O=C(COc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423712 DDWBXZQVTCYBIL-IBGZPJMESA-N 440.500 2.200 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 1846302791 GRLZSKWPKPPENO-UHFFFAOYSA-N 444.469 2.010 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)COC2CCCCC2)=NN1c1ccccc1 1847441006 MFLXPQBPAPSMNB-SFTDATJTSA-N 438.528 2.330 10 20 IECD O=C(CCNCc1ccc(N2CCOCC2)cc1)N1CCN(c2ccc(F)cc2)CC1 237855038 OXKACCXMEAUPTC-UHFFFAOYSA-N 426.536 2.491 10 20 IECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 303854444 LHFLVVMANKFLTM-GOSISDBHSA-N 434.556 2.481 10 20 IECD CCN(CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 726196064 HJRORDWODUBSHG-UHFFFAOYSA-N 448.501 2.315 10 20 IECD CCOC(=O)c1ccc(N(CC2CC2)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 728167455 YNXVXBJAGWTORH-UHFFFAOYSA-N 429.498 2.104 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1OC 739948965 LRXNAWATNCZEPV-HNNXBMFYSA-N 434.514 2.358 10 20 IECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 741087367 WPHJMBUWXJYQMK-JOCHJYFZSA-N 430.512 2.402 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 742805607 MXAKTDXHGDLZGX-NSHDSACASA-N 431.486 2.396 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746272332 LZMFNBNINUYPDI-NRFANRHFSA-N 435.528 2.227 10 20 IECD C[C@H]1CCCN(C(=O)C2CCN(C(=O)CN3CCOc4cc(N(C)C)ccc43)CC2)C1 746492169 AWMMOBXOJUMVFM-SFHVURJKSA-N 428.577 2.449 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C(C)(C)CO)CC1 747839993 GOXWWHBHCBJBCZ-INIZCTEOSA-N 435.524 2.178 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4ccccc4C)CC3)CC2)cc1 753996956 ZFSOZFLWGKFGGK-VWLOTQADSA-N 438.616 2.304 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)cc1 755202346 NXINRLWLTDUCRR-UHFFFAOYSA-N 448.527 2.381 10 20 IECD COC(=O)[C@@]1(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCOC1 755626555 OKLMQORRHFJHIJ-LVMGUKCRSA-N 440.568 2.178 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 768213893 VTOSJEVFBXEQJD-PMACEKPBSA-N 432.584 2.284 10 20 IECD NS(=O)(=O)c1ccc(N2CCN(Cc3cc(Br)ccc3O)CC2)cc1 768251295 AIPSVQCWQBPPHD-UHFFFAOYSA-N 426.336 2.124 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cs1 768916410 QERXJYAQGSQAAY-CQSZACIVSA-N 429.951 2.149 10 20 IECD O=C1C[C@H](Cc2ccc(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc2)C(=O)N1 772057794 PZVGQEDEYWZCOL-ZDUSSCGKSA-N 427.844 2.220 10 20 IECD C[C@H](NS(=O)(=O)CCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccc(N(C)C)cc1 773084289 NYFWDFGHRLHOIC-HNNXBMFYSA-N 443.566 2.193 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN[C@H](C)c1ccc(N3CCOCC3)cc1)n2C 775254454 JJMYVAZJUIVOJP-MRXNPFEDSA-N 440.548 2.323 10 20 IECD CCNC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778221008 FKBXTKPOODGAFD-QXMHVHEDSA-N 436.512 2.288 10 20 IECD CC[C@@]1(O)CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 779335765 LQZRQWWKPPUREV-LJQANCHMSA-N 435.458 2.088 10 20 IECD Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)c4ccc(C)c(O)c4O)CC3)cccc2c1 780880557 BKVOCKNIVIFGTD-UHFFFAOYSA-N 441.509 2.410 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)cc1 784557766 LMAJIHBYHAVFAU-UHFFFAOYSA-N 427.501 2.355 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 785438246 BASIZCHVTLADTF-KRWDZBQOSA-N 430.499 2.428 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 787198045 MLFGWCVWQNBOPK-QZTJIDSGSA-N 439.560 2.002 10 20 IECD C[C@H](CN1CCCCC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 787753357 YIJYGKMZVQBELH-MRXNPFEDSA-N 438.519 2.364 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCN(C(=O)c2ccsc2)CC1 788913846 ZUSLZWIQUMKJQP-UHFFFAOYSA-N 440.569 2.339 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 788930539 BXSNLUKBACWWTO-JOCHJYFZSA-N 429.561 2.480 10 20 IECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC12CCC2 793723462 XAJFFPPCQCCHDO-HKUYNNGSSA-N 426.561 2.043 10 20 IECD CCOC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 795289354 GFLBYCSMRDJURS-UHFFFAOYSA-N 428.488 2.044 10 20 IECD C[C@@H](NC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1)c1ccc(N2CCOCC2)cc1 797652638 LUQHRMGZIGGHMZ-OAHLLOKOSA-N 433.534 2.051 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)c1 799774320 UOLYQBGDYCIELX-VIFPVBQESA-N 429.292 2.302 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21 803448321 OGLSWXMXQDUGNU-OTWHNJEPSA-N 437.487 2.447 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1noc(Cc2ccccc2)n1 803661184 SKLVYFOWJYYQCP-CQSZACIVSA-N 425.464 2.359 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@H]1CCc2c(O)cccc21 804400101 NJILHDDTMWYYGO-QHCPKHFHSA-N 448.567 2.344 10 20 IECD CN1CCC(N2CC[C@@H](NC(=O)C(=O)N(Cc3ccccc3O)C3CCCCC3)C2)CC1 806209710 GRNRCUFICYLCCS-HXUWFJFHSA-N 442.604 2.338 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCOCC1 807548036 OXKGDLHJNTYJME-HOCLYGCPSA-N 425.476 2.304 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 807674487 LSUALOGNJQNDSV-KRWDZBQOSA-N 440.519 2.444 10 20 IECD CCC(=O)N1CCCC[C@H]1c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809464383 FCXVPOCJVSFGDO-IBGZPJMESA-N 441.532 2.433 10 20 IECD CN(C)C(=O)COC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 913359964 ANRLSZUDZDYYGI-KPKJPENVSA-N 443.344 2.282 10 20 IECD CCc1[nH]c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1C(=O)OC 917834156 WTAHGZXHJYHYPV-MRXNPFEDSA-N 426.517 2.304 10 20 IECD COc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC 918000514 JOORTJQVAXGDPW-LJQANCHMSA-N 440.544 2.447 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4ncsc4c3)cc2)C1 918464756 CMQSSZYGEIGSFU-OAHLLOKOSA-N 437.525 2.253 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 1116510312 RJBFRMRQOHBTHU-PMACEKPBSA-N 427.526 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)c3n[nH]cc3I)CC2)cc1F 1116649704 AHJFVSDUKNNCGD-UHFFFAOYSA-N 430.221 2.124 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)CC1 1805363889 TYGLQRWNVSINPO-JKSUJKDBSA-N 435.615 2.124 10 20 IECD CCOCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1816886159 BBMGQERJAKRCAU-LOWQCSRCSA-N 430.461 2.269 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1cc(O)nc(O)c1 1817846291 PJWFFNCCKYEUTD-CQSZACIVSA-N 426.408 2.370 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1 97496890 QBPNJNNUOOGFRF-UHFFFAOYSA-N 425.455 2.390 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)cc3F)cc2)CC1 726977243 ZRCIORTVWJURMV-UHFFFAOYSA-N 432.926 2.192 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 731074473 NZQLLLBTNHDZET-UHFFFAOYSA-N 441.560 2.333 10 20 IECD CCS(=O)(=O)C[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 733642699 RTWKAXLMAHBHNH-CYBMUJFWSA-N 437.484 2.164 10 20 IECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 734065444 BRXWYPIQBIGIPG-HJPURHCSSA-N 446.498 2.373 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(Cl)c1 737245745 OZFPACGUZOFVSO-UHFFFAOYSA-N 435.933 2.138 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1 742490864 FWJYJVWBFPBKTC-UHFFFAOYSA-N 449.555 2.235 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC([C@@H](O)C(=O)OC)CC3)c2C)cc1 749535640 SNRUIZNFHZLXHE-JOCHJYFZSA-N 442.512 2.309 10 20 IECD COC(=O)C1(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCCC1 770237804 ATVPHUOVSJHDDV-IAGOWNOFSA-N 435.540 2.473 10 20 IECD C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1 770318209 ZGWWULUUEUUGJJ-MRXNPFEDSA-N 432.546 2.073 10 20 IECD O=C(CN1CCN(c2ccccn2)CC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771053165 MDJMVOCMJGZQBC-HXUWFJFHSA-N 443.979 2.343 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(NC(N)=O)cc4)n3)CC2)cc1 771059281 ZLRWSXLFLPHZEX-UHFFFAOYSA-N 436.472 2.127 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1)c1ccc(N(C)C)cc1 773847909 UQCAWQLLCBKZMY-AWEZNQCLSA-N 448.520 2.248 10 20 IECD CCOCCOC1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 777518174 GLFFROHEOAIDBH-UHFFFAOYSA-N 426.516 2.132 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC)c(F)c3)CC2)cc1 778232654 LPLHOJWZYCBLQA-MDZDMXLPSA-N 427.476 2.364 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(CN4C(=O)CCC4=O)cc3)c2)CC1 781048090 UYMXAOMNFHJZBQ-UHFFFAOYSA-N 434.496 2.256 10 20 IECD CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 783505406 WHGHIGRWWULNIP-QGZVFWFLSA-N 449.567 2.457 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1 785575783 XAJVQZAAQJZOGJ-HSZRJFAPSA-N 438.572 2.339 10 20 IECD O=C(NCc1ccc(O)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 786625409 HYPIUDRYBPKUJU-UHFFFAOYSA-N 437.418 2.180 10 20 IECD CCOCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787514661 QVYBXGSVCLUSJO-UHFFFAOYSA-N 443.519 2.256 10 20 IECD CCN(Cc1ccc(OC)cc1OC)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324872 YXTAWJQCSVHRPZ-UHFFFAOYSA-N 441.528 2.205 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 788823859 QSNTZNWTKUOQEC-VQTJNVASSA-N 436.556 2.343 10 20 IECD CCC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(O)c(S(=O)(=O)NC)c2)c1 794593303 BHBMGWYRMXKLHH-UHFFFAOYSA-N 432.907 2.347 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccnc(F)c2F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795670564 YITBRGAXSBENKZ-UHFFFAOYSA-N 449.435 2.454 10 20 IECD CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nncn1C 796187740 RGQICAGWNIYZJG-WHSLLNHNSA-N 432.544 2.171 10 20 IECD COc1cncc(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)c1 799183112 BVJQKJULGIQOIO-UHFFFAOYSA-N 440.528 2.386 10 20 IECD COCCN(Cc1scnc1C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803301154 XZOPRQKNJUQESE-MRXNPFEDSA-N 446.573 2.141 10 20 IECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803308091 AFEXDSHRDPAGGH-HRAATJIYSA-N 439.512 2.349 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3cc(C)cc(C)c3)CC2)cc1 803752621 RUTHAEQQKKGNAD-UHFFFAOYSA-N 438.572 2.209 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)cc1 804317661 LFKMXFJJELHMAX-UHFFFAOYSA-N 426.473 2.313 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)CC2)cc1 806334884 XCMYPDNVXOBIQG-NFBKMPQASA-N 429.609 2.476 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1 807372975 OGHFYINNZUPDKQ-KRWDZBQOSA-N 432.542 2.418 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2nc(F)c(F)cc2F)CC1)c1ccc(N(C)C)cc1 807672387 YNSMYKMCPAEYSQ-CYBMUJFWSA-N 435.450 2.091 10 20 IECD CC(C)N(C)C[C@@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 811866343 KKKRSZNYHGNBJR-GOSISDBHSA-N 443.571 2.470 10 20 IECD O=C(COC(=O)C1CCC1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 825188219 NXTJQIGDOBDUJU-SXGWCWSVSA-N 448.522 2.076 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)cc1 914689118 ZLHGKJAYDLGVHS-UHFFFAOYSA-N 437.610 2.089 10 20 IECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(NC(C)=O)cc3)cs2)cn1C 914789618 NCRZTMJLTPESCK-UHFFFAOYSA-N 433.515 2.267 10 20 IECD CCN(CC)c1ccc(CNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 916502913 BKWZWZVZWJCYRL-UHFFFAOYSA-N 446.573 2.428 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 917833935 DMHQAPMTNFMION-RTBURBONSA-N 426.561 2.186 10 20 IECD O=C1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2N1 1320058808 PMEFRAMXSPWXOY-UHFFFAOYSA-N 429.542 2.259 10 20 IECD O=C(COC(=O)c1cnn2ccncc12)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1322077440 WSLSVVMYGAWSQJ-UHFFFAOYSA-N 426.388 2.300 10 20 IECD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1)n1cccc1 1799770339 NSCHPMSVTMTSBM-LJGDNWOOSA-N 433.892 2.017 10 20 IECD COCCn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715008 UJEFVYRRBYTFNS-QDMKHBRRSA-N 448.907 2.160 10 20 IECD Cc1nn[nH]c1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1810319381 DFXNOMBBXAAVPE-UHFFFAOYSA-N 433.896 2.336 10 20 IECD CN(C)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814550174 ABRLWUVZWOZRGC-LLVKDONJSA-N 438.937 2.385 10 20 IECD C[C@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816013863 BAHBBOUBSUSCIN-CJNGLKHVSA-N 439.476 2.055 10 20 IECD O=C(CCc1ccc[nH]1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722016 APHQHJATOGKVCJ-CYBMUJFWSA-N 427.486 2.136 10 20 IECD Cn1ncnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1825720362 JYPJGTNVKQLFLC-MRXNPFEDSA-N 447.923 2.427 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)CC1 1827082598 YGWSCMMCWHWYMR-KRWDZBQOSA-N 447.923 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccon1)CC2 1828198833 LUXKMXLMFBESBK-GSQGTZRGSA-N 442.453 2.187 10 20 IECD CC(C)N1CCC(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1841873703 SXLMLLACKHGXNO-FNORWQNLSA-N 443.544 2.140 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccc3c[nH]nc23)C1 1843271653 DRTLEXLZUOKSOW-SOFGYWHQSA-N 434.452 2.210 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2nnsc2C2CC2)C1 1843542941 ABFDOQHQIKUPOL-FNORWQNLSA-N 442.497 2.063 10 20 IECD CCN1CCN(CCCCNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 303250478 ARHJWYIEWQEVQZ-UHFFFAOYSA-N 448.631 2.185 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c(OC)c1OC 482902727 WGHDNIMIZSQGAG-UHFFFAOYSA-N 439.512 2.488 10 20 IECD COC(=O)c1csc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1 727251568 XOKVEOYTHYVBRW-UHFFFAOYSA-N 448.511 2.435 10 20 IECD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 727608970 FQIWBEHRZRTXAB-KRWDZBQOSA-N 446.573 2.334 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NCc2ccc(N(CC)CC)cc2)C1 728948115 DPKZSVYPSYXPRK-LJQANCHMSA-N 432.565 2.476 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1 729065768 DTDFHFYRWOYVQU-CQSZACIVSA-N 447.513 2.001 10 20 IECD COCCCN(Cc1cc(F)cc(C(C)=O)c1O)c1c(O)nc(=O)n(CC(C)C)c1N 750817254 LUVYGHNHNIOSTH-UHFFFAOYSA-N 436.484 2.278 10 20 IECD COC(=O)C[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 752336914 KFZSBLNENPHDPM-CABCVRRESA-N 436.464 2.053 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN1CCN(c3ccc(OC)c(F)c3)CC1)n2C 753856931 JMKTZCJWUMQDOK-UHFFFAOYSA-N 444.511 2.106 10 20 IECD O=C(N[C@H]1CC[C@@H](CO)CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 757911126 ZQRVLTFFZZYMPE-OKILXGFUSA-N 449.485 2.382 10 20 IECD COc1ccccc1CNC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759876723 BVOWAZACYPSYIB-UHFFFAOYSA-N 429.517 2.159 10 20 IECD COc1cc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc(OC)c1OC 759877224 DMDNPQNOGJFNPO-UHFFFAOYSA-N 442.560 2.217 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccnc(C(=O)N(C)C)c3)CC2)cc(OC)c1OC 759989467 XYAWAYKUVJCGPT-UHFFFAOYSA-N 443.504 2.163 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H]1CCCS1(=O)=O 766349313 GERRHXNRUAAYSY-JFBXQDQPSA-N 444.625 2.423 10 20 IECD COC(=O)COc1ccc([C@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 767874239 FQQGRXKOJMFYIT-SFHVURJKSA-N 441.528 2.246 10 20 IECD NC(=O)CN(Cc1ccccc1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769826022 PPVSJOQDDVOZQP-UHFFFAOYSA-N 445.522 2.382 10 20 IECD COc1nc(O)cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)n1 770518591 CUGWLFHOJXTRBU-UHFFFAOYSA-N 439.424 2.409 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1nc(-c2ncccn2)no1 777829022 TXHPHVGGNKZHGE-UHFFFAOYSA-N 431.836 2.020 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC2)cc1 778248250 SOYAIUDQIDCREF-KHPPLWFESA-N 438.484 2.167 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)cn1 781645990 HDQUPPDEOYWNGE-UHFFFAOYSA-N 429.487 2.380 10 20 IECD Cc1noc(COc2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)n1 785302613 DRRPMEGJAUXTKK-GFCCVEGCSA-N 426.429 2.054 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C2CC2)cc1 787428968 AOYKVTDRDNTXAN-UHFFFAOYSA-N 435.572 2.419 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2F)C[C@@H](C)O1 789821537 TVWXRLLMPZNZCC-RWQYCXNXSA-N 445.535 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H]3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 789835924 RNKXOXFFZMVICF-JZXOWHBKSA-N 433.524 2.273 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789863801 IHIJYMIQSLEAJI-UHFFFAOYSA-N 428.558 2.356 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1 801527331 JXENCXYIMWDNOB-YVSHKSEASA-N 437.540 2.367 10 20 IECD C[C@@H](NC(=O)C(=O)NCCN(C)Cc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803299435 LFLQRXXBCWCLAK-GOSISDBHSA-N 442.535 2.088 10 20 IECD O=C(NCc1nccn1C(F)F)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449276 UMFZWRZUSPBCBX-UHFFFAOYSA-N 443.401 2.281 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](N3CCCC3)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 805768418 IWJOREDMLGKIOG-GCJKJVERSA-N 444.601 2.483 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cn4cccc(C)c4n3)CC2)cc1 806536690 BVJJZEDYHLOJTF-UHFFFAOYSA-N 435.528 2.095 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccc2c(c1)CCN2Cc1ccccc1 809538945 WXRVGULSCSEKGQ-JOCHJYFZSA-N 441.597 2.375 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)O[C@H]1CNOC1 819749255 OYEBUPILUDVCCS-FIJZOYEMSA-N 429.317 2.097 10 20 IECD COc1cc(C(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)ccc1C 917063193 IVBNIWLVULXETA-UHFFFAOYSA-N 438.572 2.486 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4O)CC3)cc2)C1 918117667 HOPDIFGQPMDFFZ-IBGZPJMESA-N 437.544 2.126 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918140410 MVIAYYLYXCPUAF-GASCZTMLSA-N 435.521 2.277 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)s1 918744730 NKKYIBUSDZJDNO-UHFFFAOYSA-N 439.628 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(NC(=O)c4ccsc4)CC3)CC2)cc1 920090249 UNZWVEVCANGCPR-UHFFFAOYSA-N 442.585 2.300 10 20 IECD COc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)ccn1 1323930635 IPNUTMWWASKXDF-UHFFFAOYSA-N 443.481 2.185 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2[nH]ccc2s1 1797670152 QXOYUGDRNDJDES-ZSBIGDGJSA-N 448.595 2.342 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1 1803651600 ANEBDZYVDYDCOH-GTHHWVDSSA-N 426.448 2.100 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814185998 WKAXITFREPRNLH-UVFQYZLESA-N 448.614 2.384 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817846056 HHAIXVULQWANSY-HNNXBMFYSA-N 426.433 2.386 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848397 HHAVEALUUGUWIO-IRXDYDNUSA-N 442.520 2.395 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(Cl)nc2)CC1 1823630462 SOYHRMYOLDAQAH-INIZCTEOSA-N 445.907 2.483 10 20 IECD Cc1cc2cccc(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)c2[nH]1 1843738252 SBLFNSVYPMSCHH-UHFFFAOYSA-N 442.566 2.154 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 726039530 UKWWDWSXESEJDS-OALUTQOASA-N 445.560 2.172 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2)C1 736006366 QFJUBYMHPHPHMX-HXUWFJFHSA-N 428.577 2.040 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 739079455 HOVBPJXXZSJRJD-QGZVFWFLSA-N 439.512 2.445 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1NC(=O)OC(C)(C)C 740928758 SHSFGKNMUQFMFD-SWLSCSKDSA-N 427.523 2.139 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C(C)C)N3C[C@@H](C)O[C@H](C)C3)CC2)cc1 741019346 FWAGTJODMZUSQR-PWHSHALESA-N 447.576 2.021 10 20 IECD COc1ccc(N2CCCN([C@H]3CC(=O)N(Cc4ccc(C(=O)O)cc4)C3=O)CC2)cc1 742266547 LKUPKQYNTUUUAG-NRFANRHFSA-N 437.496 2.233 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCCN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 743363589 ULOFOHLBTSBVDL-NHCUHLMSSA-N 431.625 2.484 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1 743560912 WPYBOWWKWZPJSK-HXUWFJFHSA-N 438.528 2.002 10 20 IECD CC(C)COC(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 749177653 CLAVVZOUPIGKHY-UHFFFAOYSA-N 436.528 2.407 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCc2c[nH]nc2C1 750809321 SPTNDNBYPQXTDY-UHFFFAOYSA-N 443.441 2.023 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(CO)C[C@H]3c3ccccc3)CC2)cc1 753078926 BRTASTIENAERHU-QYYBQBOYSA-N 449.551 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(NS(C)(=O)=O)cc3)CC2)cc1F 753843562 VOAFGGMLHXBORE-UHFFFAOYSA-N 436.509 2.238 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCCC(=O)N4)CC2)cc1F 754210979 CMANOGRDBVKBQL-UHFFFAOYSA-N 440.475 2.396 10 20 IECD C[C@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1ccc(Br)cc1O 756523170 BIRWUZLOXCHFFD-AWEZNQCLSA-N 434.338 2.334 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](c3ccccc3)c3nccn3C)CC2)cc1 758200488 ZGLVYPAYDUYBRP-VWNXMTODSA-N 435.572 2.291 10 20 IECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 764252002 DUTQULMPCGXDSS-INIZCTEOSA-N 446.573 2.427 10 20 IECD C[C@H](NC(=O)C(=O)NCC1(N(C)C)CCCCCC1)c1ccc(N2CCOCC2)cc1 775221561 FVSKYROAFZSKDX-IBGZPJMESA-N 430.593 2.471 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)CC2)cc1 777230710 ANBHGLDZCZQMIN-SFHVURJKSA-N 433.597 2.152 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3ccccc3Cl)CC2)cc1 778327854 HEHSZIYWFCZSFK-ZJVMWOEPSA-N 443.931 2.403 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 779090145 GDUYBGXLPNJBMP-UHFFFAOYSA-N 448.520 2.425 10 20 IECD C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc([S@@](C)=O)cc1 782502882 XWEHQSZYSQGENH-BEIWTESXSA-N 433.549 2.367 10 20 IECD C[C@]1(c2ccccc2)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789799602 KHFWLBCPIYTYDS-XMMPIXPASA-N 441.503 2.053 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@H]1CCCC(F)(F)C1 789834213 KNLXAQKOWGCPGR-HNNXBMFYSA-N 427.467 2.345 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cnc1C 793388477 MKVUPEJKFTZGKM-UHFFFAOYSA-N 429.502 2.288 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN(C)c1ccccc1F)c1ccc(N2CCOCC2)cc1 793829548 VPAJVRQMVVRNQW-GOSISDBHSA-N 442.535 2.482 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061655 OAZMPCQHZXFFBI-IEBWSBKVSA-N 431.499 2.220 10 20 IECD COCc1ccc(OC)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 795556918 OSTATOULWKYZMX-UHFFFAOYSA-N 433.530 2.344 10 20 IECD CCOC(=O)c1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc(S(C)(=O)=O)c1 797633949 YDBNULYUUZYJAK-GFCCVEGCSA-N 436.486 2.431 10 20 IECD C[C@H](NC(=O)C(=O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccc(N2CCOCC2)cc1 803302674 SMDSMJJAVLCRBI-MTNREXPMSA-N 449.555 2.281 10 20 IECD CCc1nc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cs1 805010032 RXTOXXPRIRYKRS-HNNXBMFYSA-N 447.580 2.480 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 806844644 PZMIPFKWYBVJNE-LJQANCHMSA-N 426.565 2.008 10 20 IECD C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288868 AVZKSKZHSYSMLF-PKOBYXMFSA-N 442.560 2.441 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1ccc2c(c1F)CCNC2=O 807512945 CYYJGSGMPRSQJC-UHFFFAOYSA-N 426.231 2.379 10 20 IECD Cc1nn(C)c2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc12 812957374 SHNWVJVVUDNOLO-UHFFFAOYSA-N 425.464 2.112 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2c(c1)NC(=O)CNC2=O 815797515 SJUOMZNOVRKQSY-UHFFFAOYSA-N 432.274 2.499 10 20 IECD CCNC(=O)COc1ccc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)cc1OC 915849982 LGGQFUPLJZDCPZ-XNTDXEJSSA-N 438.527 2.276 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccnc3-n3cccn3)CC2)cc1 916197141 VKFPMOOBOKIDKL-UHFFFAOYSA-N 449.559 2.287 10 20 IECD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)C1 917127300 BCXAGQLCCHXYLY-ZIAGYGMSSA-N 445.570 2.349 10 20 IECD CN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1cccc(Br)c1 917310435 VKMXNJDNLHDGTM-UHFFFAOYSA-N 427.320 2.482 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(OC)c1 918017821 JCLJRELNEAUGCH-SFHVURJKSA-N 426.517 2.405 10 20 IECD COCC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918295703 SSJKVVIAILKEED-LJQANCHMSA-N 441.484 2.123 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cc3F)cc2)C1 918463922 PEYPKYNRYGNRSE-CQSZACIVSA-N 432.883 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(N(C)C)c3)cc2F)C[C@@H](C)O1 919154008 UONCMDHAANOGKG-HZPDHXFCSA-N 444.507 2.374 10 20 IECD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)oc2ccccc12 1777748184 YKVPVQOREJZBJS-QHCPKHFHSA-N 437.452 2.305 10 20 IECD Cc1ccc(OC(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)nc1 1799868273 WRIZLUIDHNCBTG-BJWYYQGGSA-N 440.500 2.306 10 20 IECD O=C(NC[C@H]1CCN(C(=O)COc2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990241 GZMHFEQSJPAESI-UZUQRXQVSA-N 448.479 2.286 10 20 IECD CC[C@H](NC)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809952754 FYLQWBNHZQFSKC-IBGZPJMESA-N 439.560 2.009 10 20 IECD O=C(COc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1813692679 AHUKLARUUJMJMR-ZDUSSCGKSA-N 440.481 2.254 10 20 IECD CCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1816555667 YONKCCTZWJPKBW-OAHLLOKOSA-N 425.449 2.052 10 20 IECD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)no1 1820741445 KONDZPUZIUJRGN-SNVBAGLBSA-N 429.458 2.039 10 20 IECD CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1827441620 VFAJNNFCFBODSK-ZXCPCRMDSA-N 438.600 2.128 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1ccno1 1834185545 TXPVABAOBGMCGZ-UHFFFAOYSA-N 448.907 2.238 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccnc2S)C1 1841063058 RWOXRPLPTSEZPR-FNORWQNLSA-N 427.482 2.018 10 20 IECD CCOC(=O)CN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)Cc1ccccc1 109315084 FMOGMEXWYQEOBQ-UHFFFAOYSA-N 425.529 2.409 10 20 IECD CN1CCC[C@@H](N2CCN(CC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2)C1 261467509 WENGAORBQGILIE-GOSISDBHSA-N 446.551 2.112 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(S(C)(=O)=O)nc3)cc2F)CC1 730110657 QNJQFBXCSCJEBN-UHFFFAOYSA-N 435.525 2.088 10 20 IECD COC(=O)c1ccc2c(c1)CN(C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 730121643 WHSVMDQMNNMDHN-IBGZPJMESA-N 436.512 2.400 10 20 IECD Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 737132322 ZDAOLVPLWTVPNV-UHFFFAOYSA-N 445.539 2.364 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCCn3cccn3)cc2F)C[C@@H](C)O1 743225477 ZYTDGKRIKCNNTM-IAGOWNOFSA-N 432.496 2.276 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 749553598 JBSRDDXABJFUTA-NSHGMRRFSA-N 434.556 2.303 10 20 IECD CN(c1ccc(CNC(=O)NCCNS(=O)(=O)Cc2ccon2)cc1)C1CCCCC1 750278534 VSUUKSHFQIMBRU-UHFFFAOYSA-N 449.577 2.362 10 20 IECD CC(C)c1nncn1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751066192 DDQRKKBVMZKESF-UHFFFAOYSA-N 435.531 2.399 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(OC)c(C(C)=O)cc3OC)CC2)cc1 758233883 XIRQRBJNTRVDCM-LJQANCHMSA-N 444.528 2.477 10 20 IECD COc1cc(N2CCN(C(=O)c3cncc(-c4cnn(C)c4)c3)CC2)cc(OC)c1OC 759221158 OFZHRCHRYGHZKA-UHFFFAOYSA-N 437.500 2.470 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)C[C@H](C)C3)cc2F)C[C@H](C)O1 764228642 MURYEPXCKBZEBT-PMPSAXMXSA-N 427.542 2.015 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1 764250962 BANNAAUIHRVWBS-UHFFFAOYSA-N 429.542 2.460 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(Br)nc3)CC2)cc1F 766519667 WBMNHNOLVJUGSN-UHFFFAOYSA-N 437.269 2.279 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3nc(O)c4sccc4n3)CC2)cc1 767961478 ZNSDBAMAFCUAPO-KRWDZBQOSA-N 443.573 2.020 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)NCc3ccc(N4CCCC4)cc3)C2)cc1 768247608 RDAQCSXGEBAVPA-UHFFFAOYSA-N 444.557 2.168 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1 769978868 RJNLVJLMVCILGR-UHFFFAOYSA-N 431.445 2.365 10 20 IECD C[C@H](NC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(N(C)C)cc1 775404272 MJFHRLGKGJADGH-HRAATJIYSA-N 435.528 2.480 10 20 IECD C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc([S@](C)=O)cc1 782502886 XWEHQSZYSQGENH-JTBPQFFMSA-N 433.549 2.367 10 20 IECD COc1cc(OC)cc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785432631 GBKKDMYXLWYWRS-SFHVURJKSA-N 440.544 2.029 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 787199737 RFFQXMCUNMIODF-KRWDZBQOSA-N 426.517 2.067 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cc2F)CC1 787206451 IBWZHBYFVWKXJE-LJQANCHMSA-N 447.599 2.362 10 20 IECD C[C@@H]1CN(c2ccccc2F)CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311783 ZYHJKDCGKTTWHQ-GOSISDBHSA-N 440.519 2.016 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3cc(C)oc3C)CC2)cc1 788952467 VPPLIDCBJWOGMU-UHFFFAOYSA-N 440.544 2.343 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 789369664 ACCNWOBPXYFVQM-APWZRJJASA-N 428.489 2.124 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)C3CCCC3)cc2F)C[C@H](C)O1 789828760 YIYOJJXMYWFXEV-IRXDYDNUSA-N 434.556 2.046 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc4c3OCCCO4)CC2)cc1 793737816 PTLDGKYGZKEVFK-UHFFFAOYSA-N 439.512 2.212 10 20 IECD CC1(C)[C@H](O)CCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794598728 SFDXGSXUQCWUCB-QGZVFWFLSA-N 435.458 2.087 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccc(C)cc3)[C@@H](C)S(C)(=O)=O)nc12 797997751 QJROIKWCJZLHCY-KUHUBIRLSA-N 446.529 2.184 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](N3CCCC3)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 805768422 IWJOREDMLGKIOG-XMSQKQJNSA-N 444.601 2.483 10 20 IECD CC(C)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 808085457 MAWCDSZYHYRXMU-FYYLOGMGSA-N 442.604 2.155 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCO[C@]3(CCOC3)C2)cc1 808112713 ZUMJPJIMRGIRFB-YADARESESA-N 441.528 2.329 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1 809795257 OJONXAPZRWAVPA-YPAWHYETSA-N 425.529 2.452 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H](CO)C1CCCC1 811866921 OQVUMYUXXPVTMU-FQEVSTJZSA-N 442.539 2.293 10 20 IECD CCCN(C(=O)[C@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 914903517 MWXZVKICPQHBFQ-ROUUACIJSA-N 447.557 2.460 10 20 IECD COCCCn1c(-c2ccc(N3CCOCC3)cc2)nc2c1c(O)nc(=O)n2CC(C)C 916854275 GMIUFORTHWNCDO-UHFFFAOYSA-N 441.532 2.495 10 20 IECD CCOC(=O)[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 916980412 NGXVHPRWQXECEA-SCTDSRPQSA-N 435.540 2.331 10 20 IECD C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1 917126506 GTFZBNWYIVJTDF-CYBMUJFWSA-N 431.543 2.246 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c1 919811149 MAYSFXWIGBIAFZ-UHFFFAOYSA-N 448.526 2.462 10 20 IECD O=C(CN1CCC(n2cc(Cl)cn2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 1319938275 NJVLNKIUSKDAOL-UHFFFAOYSA-N 435.931 2.466 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1CCCO1 1781975560 LIKAPIJDAMLPSZ-CBGDNZLLSA-N 438.908 2.058 10 20 IECD C[C@H](Cc1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801429575 GSDDZEOTASWUPC-NFWAQSGPSA-N 448.903 2.426 10 20 IECD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1810999173 LEWICKQBCHFGGK-VLIAUNLRSA-N 437.456 2.072 10 20 IECD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)ccc1F 1816720912 CPERCAXRHFUOCH-LLVKDONJSA-N 443.460 2.331 10 20 IECD O=C1CC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)N1 1821293465 LWWSHJXJWHIJHW-JSGCOSHPSA-N 447.879 2.059 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(O)O)CC3)cc1 1823437573 ISOIHLAHGNYJAK-HNNXBMFYSA-N 440.525 2.087 10 20 IECD CO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1826163741 PUYVUTRJSIMJBG-WPRPVWTQSA-N 425.894 2.468 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@@]3(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826266449 RKKUBPKNFSYXKE-NMIRZEMHSA-N 426.857 2.100 10 20 IECD CCC(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843331358 PLDGVKIJYNAFHF-GOSISDBHSA-N 430.549 2.318 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2n[nH]c3cc(Cl)ccc23)C1 1844106767 KVVFFLMYXSCCFJ-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CN(C)c1ccc(CNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1F 303495576 XCGFOPHODHUCGS-UHFFFAOYSA-N 440.463 2.253 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCn3cnc4sccc4c3=O)cc2F)CC1 730192888 OTNOWDKMNCVOHW-UHFFFAOYSA-N 443.548 2.446 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCNC(=O)c1c(F)cccc1F 732997117 UPGUJUJTGMXIKP-UHFFFAOYSA-N 432.471 2.373 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 741234986 ZSRPGJHWBTUARD-UHFFFAOYSA-N 447.586 2.472 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 742799832 CVBNXYFUJCPDQQ-GFCCVEGCSA-N 431.486 2.396 10 20 IECD O=C(c1ccc(S(=O)(=O)N2CCOCC2)o1)N(Cc1ccco1)Cc1ccccc1O 743429683 WWYHCRZTPQCHMA-UHFFFAOYSA-N 446.481 2.442 10 20 IECD CCO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 745692482 WBUXHARLVRPVLG-RDJZCZTQSA-N 444.536 2.210 10 20 IECD CC1=C(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C(=O)OC1(C)C 748565125 QVGSVHCSXZRQQC-UHFFFAOYSA-N 439.491 2.210 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@]1(O)CCN(Cc2ccccc2)C1 749407084 SHWCJUUFRDGLDY-DEOSSOPVSA-N 427.520 2.040 10 20 IECD CC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 749819560 RVXDWXZGRMOLDG-UHFFFAOYSA-N 431.420 2.468 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(CCCCO)CC2)c([N+](=O)[O-])c1Br 750181592 RUKHIKJXTKOJAS-UHFFFAOYSA-N 433.259 2.169 10 20 IECD CN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751241231 YLCKECSOXXWYFL-UHFFFAOYSA-N 431.558 2.076 10 20 IECD CN(CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OCc1ccccc1 756668417 ZBCOULQSMJNINU-FQEVSTJZSA-N 438.528 2.273 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 760600594 HLUGUXFJLXUXBU-UHFFFAOYSA-N 437.474 2.132 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c(OC)c1 766046995 AAYRRKBHLPSJPF-UHFFFAOYSA-N 428.488 2.166 10 20 IECD C[C@H](NC(=O)c1nccc2c(S(N)(=O)=O)cccc12)c1ccc(N2CCOCC2)cc1 768481402 NIUKUVNSQVHLAF-HNNXBMFYSA-N 440.525 2.210 10 20 IECD CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 769559673 MGIMBVZEBYSSDH-UHFFFAOYSA-N 447.482 2.398 10 20 IECD CC(C)[C@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1CCCS1(=O)=O 772676763 GACOTOLSIDPIML-JXXFODFXSA-N 441.569 2.116 10 20 IECD COc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774730636 WQVIMVSHUNXZAY-UHFFFAOYSA-N 436.556 2.160 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCO1 774865805 UQCNNAAHPPRQLR-NRFANRHFSA-N 425.529 2.148 10 20 IECD COC(=O)[C@@H]1CN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 778270962 CIHBJIOTTNJUEJ-AXUYNXDZSA-N 449.507 2.203 10 20 IECD CCOC(=O)CN(C)C(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 781999300 NMLLOEOBRWVTIO-UHFFFAOYSA-N 443.839 2.294 10 20 IECD CSCC[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 782187646 RMLXYEMHNKIJAU-QLFBSQMISA-N 435.498 2.121 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765555 AMPQWIKUFCRDBR-HNNXBMFYSA-N 448.907 2.188 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 784765907 CNWDZOLUSKKDIC-GOSISDBHSA-N 444.919 2.125 10 20 IECD O=C(Nc1cnc(C2CC2)nc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766364 HICAIFRXUFHPPR-MRXNPFEDSA-N 429.908 2.432 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccsc4n3)cc2F)C[C@@H](C)O1 785583249 KADWBIKDSVPPMN-OKILXGFUSA-N 445.520 2.081 10 20 IECD COC(=O)c1cnc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[nH]1 788506818 XYLWWBKVSSNWOC-BETUJISGSA-N 436.509 2.358 10 20 IECD Cc1cc(F)cc(-n2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)nn2)c1 788744199 ZOWGGOQYGUMYSM-KRWDZBQOSA-N 436.491 2.347 10 20 IECD CCc1csc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 789729291 SDXPGAJGMFJDEP-UHFFFAOYSA-N 434.518 2.019 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC(c2ccncc2)CC1 789799494 HTBCZQCGDRULIP-UHFFFAOYSA-N 426.492 2.080 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3CN3CCCC3)cc2F)C[C@@H](C)O1 789822941 BRPKFELTDGDQRJ-WSTZPKSXSA-N 446.567 2.142 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC2(CCOCC2)O1 790360260 MHSAQZMZKZSJHE-QRVBRYPASA-N 449.567 2.325 10 20 IECD Cc1ccc(C)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793732042 HBQWHIPNBRZTKS-FQEVSTJZSA-N 436.556 2.280 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(CC)nc3C(F)(F)F)nc12 797933250 YSRRJAZCOLISLQ-UHFFFAOYSA-N 427.339 2.204 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N(C)C)cc2)cc1OCC 798114455 LVQFTGRXTPXUDR-UHFFFAOYSA-N 435.546 2.145 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1F 803665244 VJDLUSALWCJOKK-MRXNPFEDSA-N 436.528 2.414 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@@H](C(C)(C)C)C3)cc2F)CC1 805008280 IOICRNYMZMXZRP-WIYYLYMNSA-N 448.583 2.294 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC3CCC(C)(C)CC3)CC2)cc(OC)c1OC 806630595 FZOGQBCRUPKUDY-UHFFFAOYSA-N 433.549 2.446 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C1 807101690 AOBLILCXKDJGJY-VQIMIIECSA-N 432.565 2.439 10 20 IECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2=O)cc1 807291218 UWKOTALFXJKGMU-JOCHJYFZSA-N 432.524 2.299 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 807292395 PXGSBTQAWOAFHD-VQTJNVASSA-N 441.553 2.092 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCN(c3ncccc3F)C2)C2CC2)cc1 807912378 IVNHUHDLUIXHLH-KRWDZBQOSA-N 425.508 2.173 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1)N1CCOCC1 863988058 WUQCZQQUEYPWKH-UHFFFAOYSA-N 435.521 2.295 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)CCC4CCCC4)CC3)nc12 917098301 GOWFERIBNBROEI-UHFFFAOYSA-N 429.521 2.226 10 20 IECD C[C@H](OC(=O)Cn1ccccc1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 917954936 HIJRMBIJIUVVKX-AWEZNQCLSA-N 430.416 2.194 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918287097 OBBGVHNZOMMNNM-GASCZTMLSA-N 443.475 2.481 10 20 IECD Cc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795028147 BKZSPCRIXRRFAL-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(Cl)c(O)cc1O 1796604462 JKDQUSLIDJSJEM-ZSBIGDGJSA-N 433.848 2.123 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccc(F)n1 1804286480 ZJBROMOUBOGELG-SYLDHANKSA-N 427.432 2.303 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ncccc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994273 FITHCQIQRQTKCJ-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc2nccn12 1821482164 WTVQBRFOEMAMLG-HNNXBMFYSA-N 447.455 2.483 10 20 IECD C[C@@](O)(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1827424463 XVTLNSPXBZWOAU-IFXJQAMLSA-N 445.438 2.039 10 20 IECD Cc1nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccc1F 1842210689 XTDNOTOIHDJIHF-XBXARRHUSA-N 427.432 2.176 10 20 IECD COc1cscc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038729 GUEIXEOORZWJAY-GQCTYLIASA-N 430.482 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(-n4nc(C)cc4C)nc3)CC2)cc1 106116809 PQETYEWXAVSRIA-UHFFFAOYSA-N 449.511 2.398 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@H](NC(N)=O)c3cccs3)CC2)cc1 115540907 SRAGZIBSYRBUDG-IBGZPJMESA-N 445.589 2.185 10 20 IECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NCc2c(C)c3ccccc3n2C)C1 472221906 GQHWNVKHNKNKMC-QGZVFWFLSA-N 436.578 2.069 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O 727946314 DHJNRJFEMVDSSL-UHFFFAOYSA-N 434.496 2.356 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc2)CC1 729064960 XAFQBDACQGNAJS-KRWDZBQOSA-N 440.544 2.354 10 20 IECD Cc1cc(C(=O)N2CC[C@H](S(N)(=O)=O)C2)c(C)n1-c1ccccc1Br 732664156 JCYWPMZDMWOEDE-ZDUSSCGKSA-N 426.336 2.360 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1 737134660 PCRAQRZWHVDPIA-UHFFFAOYSA-N 444.289 2.392 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCn3c(nnc3C(F)(F)F)C2)c1 739887690 YHZAQLYPKYCQDH-UHFFFAOYSA-N 439.438 2.053 10 20 IECD CCc1nsc(N2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)n1 745648047 NHMYVVKXADPJBA-UHFFFAOYSA-N 448.568 2.233 10 20 IECD NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 746751897 YKHNSLASGVCSJN-AWEZNQCLSA-N 428.455 2.339 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N2C(=O)CCC2=O)cc1 749405104 BNFFOGZANKJFKP-UHFFFAOYSA-N 425.460 2.370 10 20 IECD CCN(CC)c1ccc(CNC(=O)NC[C@@H](O)CS(=O)(=O)c2cccs2)cc1 752148400 GRZJOYXUJUMSSQ-QGZVFWFLSA-N 425.576 2.228 10 20 IECD CC1(C)Cc2cc(S(=O)(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc2O1 753362577 FNRPZVHJMQGPFP-UHFFFAOYSA-N 436.555 2.436 10 20 IECD CCCc1cc(=O)n2nc(N3CCN(c4cc(OC)c(OC)c(OC)c4)CC3)sc2n1 758940662 LGSYPCPNTCQUAU-UHFFFAOYSA-N 445.545 2.456 10 20 IECD CCOC(=O)C(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 762882762 NZZPOICSRLJZSX-GASCZTMLSA-N 438.496 2.188 10 20 IECD NS(=O)(=O)c1ccc(Oc2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)cc1 765073974 ADNUGDQAPZNNHD-UHFFFAOYSA-N 446.466 2.463 10 20 IECD COc1cc(N2CCN(S(=O)(=O)CCc3cccs3)CC2)cc(OC)c1OC 767514916 NNEJVQJEPUFMLM-UHFFFAOYSA-N 426.560 2.468 10 20 IECD CC(C)C[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768512571 QXXLINFAVIYWQZ-DAYGRLMNSA-N 434.512 2.022 10 20 IECD CN1CCN(c2ccc(CN3CCN(Cc4nc(O)c5ccccc5n4)CC3)cc2)CC1 775645289 IYBNJGGDUCQFAQ-UHFFFAOYSA-N 432.572 2.405 10 20 IECD COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2)cc1 779502232 WLQMFTLTFGCXPW-UHFFFAOYSA-N 426.448 2.492 10 20 IECD C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 782097958 OYCCSNXEZAURNG-VIFPVBQESA-N 448.225 2.271 10 20 IECD COCc1ncsc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 785930997 DLPMDCYESIDGBC-UHFFFAOYSA-N 442.520 2.475 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(F)c3F)cc2)CC1 786122006 LPKUNXOABGPHMY-UHFFFAOYSA-N 427.448 2.251 10 20 IECD O=C(NC[C@@H](CO)Cc1cccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788181649 WOSJRENEHXFDJX-HNNXBMFYSA-N 447.538 2.231 10 20 IECD CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318606 FSSFBMAKQGRRJW-UHFFFAOYSA-N 433.512 2.188 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 788938386 RIIZPERCQGYWNW-JOCHJYFZSA-N 434.540 2.210 10 20 IECD Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(=O)c2cnn(C)c21 791204085 AXLWIKMHTFLWRM-UHFFFAOYSA-N 449.433 2.057 10 20 IECD CO[C@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1(C)C 803448943 IUZPSGJUCDLEEP-IRXDYDNUSA-N 425.476 2.303 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1 803705918 UACGKIIDNDRITA-UHFFFAOYSA-N 445.585 2.352 10 20 IECD COCc1cc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1F 804918083 WDXMLEHUKWNCBL-UHFFFAOYSA-N 429.492 2.336 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC[S@](=O)C(C)(C)C 806198186 KSERYMAHKRSJKQ-VWLOTQADSA-N 433.368 2.167 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cc(C)ccc4OC)CC3)nc12 917059389 WZMCZFNXCPDRKJ-UHFFFAOYSA-N 439.516 2.246 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnc(N)n3C3CC3)cc2F)C[C@H](C)O1 917212604 MNJIFVQFOFNBDT-STQMWFEESA-N 434.541 2.356 10 20 IECD Cc1c([N+](=O)[O-])cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 917832821 HGEAKUMFYVTJKM-HNNXBMFYSA-N 441.444 2.443 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnccn4)CC3)cc2F)C[C@@H](C)O1 918220209 IEHSZDNWXROFFV-IAGOWNOFSA-N 428.512 2.261 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1OC 918438333 MURGDSCVHMVFKS-UHFFFAOYSA-N 445.491 2.449 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1 919664683 HZAOQOJCMBRDQA-UHFFFAOYSA-N 431.876 2.115 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(OCCN(C)C)c1)c1ccc(N2CCOCC2)cc1 920925580 KCQGGTRDIVPPAB-SFHVURJKSA-N 440.544 2.280 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnn(-c4ccccc4)c3)cc2)C1 921064236 JNDLBUPVDMSKQB-GOSISDBHSA-N 439.541 2.053 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12 921304807 XDWCFMHBRKIGMA-IRFCIJBXSA-N 432.590 2.207 10 20 IECD CN1CCN(c2ccc(CN[C@@H](Cc3ccccc3)C(=O)N3CCOCC3)cc2F)CC1 1320250880 BGAQEIWZRWWDNL-QHCPKHFHSA-N 440.563 2.137 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2)CC1 1320667863 YTOVKZZMBOBCNN-FQEVSTJZSA-N 449.555 2.309 10 20 IECD COc1ccsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1779917158 RVMGATHUCAIKIU-QVKFZJNVSA-N 447.513 2.004 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccco1)C2)c1cc(O)c(O)c(Cl)c1 1799767197 AAJWPCWQCUPTRS-GFYLOJAKSA-N 432.860 2.261 10 20 IECD COc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769257 WRCKKJYLMOCQSE-HBCWATKFSA-N 446.887 2.277 10 20 IECD CC(C)(C)c1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)[nH]n1 1843441541 FIWIHXPMHNKAIG-UHFFFAOYSA-N 448.527 2.317 10 20 IECD O=C(CCc1cccc(O)c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442808 YQNSFJYNFHUDDF-UHFFFAOYSA-N 446.507 2.321 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc3c(s2)CCCC3)C1 1844039336 UAGOLYRIUYIUKP-UHFFFAOYSA-N 449.623 2.304 10 20 IECD CC(C)Cn1c(N)c(C(=O)CSc2ncc(-c3ccccc3)n2C)c(=O)n(C)c1=O 22267850 KVNRESKAASCAIW-UHFFFAOYSA-N 427.530 2.161 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@H](O)COc3ccc4c(c3)OCO4)CC2)cc1 726714182 UPGNNMADFVUXSI-SFHVURJKSA-N 443.500 2.132 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OCCN(C)C)cc3)CC2)cc1 726726520 TZNBPSRSGZWWFK-UHFFFAOYSA-N 440.544 2.359 10 20 IECD Cc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1C[C@H]1CCCO1 727176642 NIVGYDSYSXITCS-VGVSSDJJSA-N 443.616 2.034 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)c1 734073866 YPRHYQODFTZUPU-UHFFFAOYSA-N 445.431 2.456 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 737134203 KJDDVCKOZRDSQM-UHFFFAOYSA-N 437.452 2.208 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(-n2cccn2)c1 738899887 LKLFKXSQCOORTE-UHFFFAOYSA-N 425.514 2.429 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(N)c(Br)c3)nc12 745465157 XMGYESHZJPSHPJ-UHFFFAOYSA-N 435.234 2.313 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)c1 748847696 FPYZDNRIPZTBJO-UHFFFAOYSA-N 445.541 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)NC(C)C)c3)CC2)cc1F 753740545 RAHSNOCYPNJNIW-UHFFFAOYSA-N 435.521 2.483 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)N3C[C@@H]4CCCN4c4ccccc43)CC2)cc1F 754215900 QJPSBKVKPGDJSI-SFHVURJKSA-N 438.503 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)cc1F 754220044 OIXAVOKFIMXEHF-UHFFFAOYSA-N 427.885 2.098 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Br)c1 757654782 GNKFROFZIMUALP-UHFFFAOYSA-N 430.232 2.440 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCOC[C@@H]1C1CC1 760821458 QQNGWGFBVGTRJO-OAQYLSRUSA-N 440.523 2.263 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 768910875 AVRHXLGGITXWIU-GOSISDBHSA-N 443.997 2.188 10 20 IECD CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 769859921 UDBKBTFEXVKFOW-ZDUSSCGKSA-N 438.531 2.374 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCN(C)c3ccccc3)CC2)cc1 778260572 IGZFCRJNVOHRMH-YPKPFQOOSA-N 436.556 2.495 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2 778543085 ORWMPAIJAUQPRE-UHFFFAOYSA-N 440.475 2.144 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)CC2)cc1 778554281 VNFUBXANEODARS-UHFFFAOYSA-N 442.472 2.274 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1nccn1C 785626481 PLFAFQVJZAGGPM-MRXNPFEDSA-N 445.570 2.389 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(c2nnc3n2CCCC3)CC1 788932896 RDSSPFGPWRBYIT-UHFFFAOYSA-N 436.560 2.237 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](N4CCCCC4)C3)cc2F)C[C@@H](C)O1 789824195 GWGXQFFTFJLQLD-NSHGMRRFSA-N 446.567 2.142 10 20 IECD CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789948553 CJFYTAIVIRITNW-OAHLLOKOSA-N 443.466 2.232 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2ccccc2C)c1C 798311221 JXPNDSHEXRIFFH-GOSISDBHSA-N 431.558 2.168 10 20 IECD CC[C@@H](C)N(CC(=O)OC)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 799169550 MUTYOZDROHBKPT-CQSZACIVSA-N 435.546 2.198 10 20 IECD C[C@H](CN1CCCC1=O)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 803116596 HFDUDKIWRITEKX-QGZVFWFLSA-N 426.517 2.002 10 20 IECD CCN1C[C@H](C)N(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H]1C 803449065 NBMUWZUBVBQDDL-CVEARBPZSA-N 438.519 2.314 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nc3cc(OC)ccc3n2C)cc1F 804851367 AFMFXQIBUNVVIX-UHFFFAOYSA-N 441.507 2.500 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 806126588 UNOLSXXKEJUETO-MRXNPFEDSA-N 435.475 2.467 10 20 IECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 806180112 KAHKKRGNUVNIEA-WOJBJXKFSA-N 428.577 2.399 10 20 IECD CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806327539 CCIKWZGRJXAHIG-DLBZAZTESA-N 438.519 2.364 10 20 IECD CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 806501961 NEILDFCFEICHPX-SOLBZPMBSA-N 438.519 2.362 10 20 IECD CN(C)C(=O)COc1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807512635 BDJSDNUGZRNUPU-UHFFFAOYSA-N 440.283 2.421 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(S(C)(=O)=O)s2)cc1 807694549 IABWNTUCJTXJJR-UHFFFAOYSA-N 437.587 2.273 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccnn3C)C(C)C)CC2)cc1 809793860 QADDDJFOOARQIT-FQEVSTJZSA-N 427.549 2.023 10 20 IECD COc1ccc(N2CCN(C(=O)COc3cc([N+](=O)[O-])c(C=O)cc3OC)CC2)cc1 915663778 RGNDYCAKEIBRDJ-UHFFFAOYSA-N 429.429 2.152 10 20 IECD CNC(=O)c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 917228094 XOYQUJFKMDWVHZ-IYBDPMFKSA-N 429.492 2.494 10 20 IECD COc1c(C)ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 918465468 NTTBEMBSFGWDRI-SFHVURJKSA-N 438.528 2.269 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccsc4)n3)cc2F)C[C@@H](C)O1 918632649 AJEQLSBCMFQXMZ-ZIAGYGMSSA-N 430.509 2.471 10 20 IECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 919022832 TVOXHYBATICZTD-GASCZTMLSA-N 431.464 2.316 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc([N+](=O)[O-])cn3C)cc2F)C[C@H](C)O1 919027915 UIWNAHDBMFXYQO-KBPBESRZSA-N 448.451 2.159 10 20 IECD COc1ccc(N2C[C@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)c(OC)c1 919766525 AONGGLCYSMOXNR-GOSISDBHSA-N 439.512 2.210 10 20 IECD C[C@H](NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1ccc(N2CCOCC2)cc1 920880206 CMPSZVZVZPYNGY-INIZCTEOSA-N 433.530 2.392 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(F)(F)C3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242426 MCEHKJOLQXPMNA-NKFCBESUSA-N 444.862 2.390 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@H]1C[C@H]1F 1807848738 ORXUOJBLVQGREL-ZDRZLCEMSA-N 441.459 2.276 10 20 IECD CC[C@@H](C)[C@@H](N)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809714203 XYSHDRRPBZUSSW-XUYSBGGMSA-N 445.560 2.421 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H](O)c1ccccc1 1817076055 TXCXTMYTPYMTBS-UZLBHIALSA-N 437.456 2.255 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@@H]2C1 1828809124 DGOUQHYBBIDDDB-HUYLIWGRSA-N 442.560 2.066 10 20 IECD O=C(c1ccc(O)cc1F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442567 SCNZLVWMHURNSH-UHFFFAOYSA-N 436.443 2.141 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)nc1 1847174199 BBNGBEOVRGTUBW-CFBOXQHNSA-N 429.860 2.381 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCc3ccoc3C2)=NN1c1ccccc1 1847663982 WBSKNGMUUMLPJN-QMMLZNLJSA-N 446.507 2.379 10 20 IECD CCCC(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 25454459 FYPODIJUWTZVCE-OQLLNIDSSA-N 436.511 2.076 10 20 IECD O=C1OCc2ccc(S(=O)(=O)Nc3nc(-c4cccc(-n5cnnn5)c4)cs3)cc21 727250224 GTPYCIJNENQBSX-UHFFFAOYSA-N 440.466 2.257 10 20 IECD COC(=O)N(C)CCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729333199 REQZEIFGMWYCFI-UHFFFAOYSA-N 444.511 2.037 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2n1C 743887004 FBVWLJALBGCBHX-UHFFFAOYSA-N 425.464 2.112 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958318 RDYVOWRCUGMTBP-HKBQPEDESA-N 444.553 2.421 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@@H]2CCOC2)n1C[C@@H]1CCOC1 752848020 GDXWQGMMDYSCAX-VQTJNVASSA-N 427.549 2.292 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 754535717 IHGKYYGAURUKCH-UHFFFAOYSA-N 426.494 2.462 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(F)cc1F 765904322 QZLNAFIHMPSBOZ-UHFFFAOYSA-N 443.200 2.474 10 20 IECD O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 774189626 YVUQJNRVLYTJHN-RTBURBONSA-N 433.534 2.300 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 774407219 CLGWOYNSUHPDKH-GASCZTMLSA-N 443.475 2.101 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCO1 774867461 XVTVROCPHAZQNR-QHCPKHFHSA-N 438.572 2.118 10 20 IECD COc1cc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)nn1C 775074007 AYWZWAXORPXLKV-UHFFFAOYSA-N 447.429 2.096 10 20 IECD CC[C@H]1C(=O)N(CC)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 779340041 RIHSZBFYAOYKSF-HNNXBMFYSA-N 437.543 2.337 10 20 IECD COC(=O)[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 781343221 CKBBWUBPYQNYLU-FIKGOQFSSA-N 435.540 2.473 10 20 IECD C[C@H](c1ccccc1)N(C(=O)C(=O)Nc1ccn(CC(=O)N(C)C)n1)c1ccc(N)cc1 783483012 MAIUGIGWQPFOQJ-MRXNPFEDSA-N 434.500 2.286 10 20 IECD O=C(NCCc1cnn(-c2ccccc2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786119334 DKEDXPOPQSQLNN-QFIPXVFZSA-N 448.523 2.444 10 20 IECD CC(C)CN1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789819433 MVZDXJHCBDUCGT-CMKODMSKSA-N 448.583 2.150 10 20 IECD Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1Cl 793722358 LCCORHWFUAYPRW-SFHVURJKSA-N 442.947 2.283 10 20 IECD O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)N(Cc1ccco1)Cc1ccccc1O 797190917 QUPWWVUWWFOKEA-UHFFFAOYSA-N 440.481 2.369 10 20 IECD Cc1cn(-c2ccc(F)cc2)nc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 801136576 NFBJVOPGRVYTEL-UHFFFAOYSA-N 442.516 2.485 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 803662967 PEUZYMKHBIYXJA-UHFFFAOYSA-N 440.519 2.237 10 20 IECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCN1C(=O)OC(C)(C)C 803664347 LDEHUZHXELKTLG-GDBMZVCRSA-N 436.528 2.412 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCOc3ccccc3F)CC2)cc1 804317589 IXPZNWGRDDSOTJ-UHFFFAOYSA-N 429.492 2.457 10 20 IECD CCN1C[C@H](CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)Oc2ccccc21 807288008 RCEUPCOMBIFOIM-NRFANRHFSA-N 434.540 2.425 10 20 IECD CC(C)N[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768719 AKLYBORLSOLOFP-IRXDYDNUSA-N 438.519 2.362 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@@H]([C@H]2CCOC2)C1 807769650 ICMKWBHDPPJCSN-IXDOHACOSA-N 437.487 2.258 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O 808229388 AAJATRVRVKHFBW-HNNXBMFYSA-N 429.439 2.190 10 20 IECD CSC1(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCC1 808853928 KZMQRVGXZDTNRG-UHFFFAOYSA-N 430.618 2.237 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3nc(O)c4cc(OC)c(OC)cc4n3)CC2)cc1 917262396 WJCRZSQSRVFRSP-UHFFFAOYSA-N 438.484 2.253 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442739 SZQFIAORFDOZKD-UHFFFAOYSA-N 439.512 2.245 10 20 IECD CCOc1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918465622 PYTQLJNCDPAXJZ-GOSISDBHSA-N 438.528 2.350 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc(C4CC4)nc4c3c(O)nc(=O)n4C)CC2)cc1 918663925 KRBMDYRGFFJLJW-UHFFFAOYSA-N 449.511 2.273 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2c(cccc2NS(C)(=O)=O)C1 918740540 OUNUOFDTIWQVTM-UHFFFAOYSA-N 430.574 2.141 10 20 IECD C[C@H]1CN(Cc2csc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)C[C@@H](C)O1 919810437 VEZOETIMSIPTKD-TXEJJXNPSA-N 440.547 2.082 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)CC2)cc1 1116639803 XYSPACKDCDFUTA-UHFFFAOYSA-N 433.530 2.004 10 20 IECD CCS(=O)(=O)c1cccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 1318639741 IROXUWGHNNUYCD-UHFFFAOYSA-N 446.573 2.433 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)no1 1781121406 UCKQKHORYCICQO-DYESRHJHSA-N 449.891 2.489 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnc2cc(Cl)ccn12 1796600636 XFJFZRICYBYKLO-QDMKHBRRSA-N 441.875 2.360 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1803128879 ZKYIVAOHZJJRQI-GMVHGZKUSA-N 440.500 2.221 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)cn1)CC2)c1cc(O)nc(O)c1 1816722596 PVVIZOPQFLBXPX-LLVKDONJSA-N 429.433 2.023 10 20 IECD Cc1cc(/C=C/C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)no1 1816726787 ZSQJHWHARBUBMD-OGOUPESXSA-N 441.469 2.185 10 20 IECD O=C(Cn1nccn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740087 HQBDJPUZTOSVDU-QGZVFWFLSA-N 447.923 2.276 10 20 IECD O=C(c1ccc2[nH]ccc2n1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441777 PMVYNNRXYHXCQL-UHFFFAOYSA-N 442.479 2.173 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2CCC(=O)NC2)C3)cc1 1845397756 PMKVJNATBQRCPG-HXUWFJFHSA-N 434.540 2.437 10 20 IECD COc1ccc(Cl)c(CC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1F 1846432172 CWRRHRZWVWKPCS-UHFFFAOYSA-N 449.866 2.354 10 20 IECD Cc1c(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)oc2ccccc12 1847054679 VVJXRQQGSCVRRU-UHFFFAOYSA-N 443.550 2.419 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)CC2)cc1 108429925 CABKKMDCRIKJKJ-RUZDIDTESA-N 448.523 2.127 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3[nH]cc4c(=O)ncnc3-4)c2C)cc1 730657968 SHUUQMIQOPIULK-UHFFFAOYSA-N 449.467 2.304 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cccc4cnccc34)CC2)cc1 732923166 QOZDQQCWYIIIIX-UHFFFAOYSA-N 426.542 2.344 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(-n3cnnn3)ccc2F)cc1 737116374 DAFCBEVRKQOHKR-UHFFFAOYSA-N 425.468 2.245 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3cncc(Br)c3)c2)CC1 747860099 KFKVBQMXEXAJHE-UHFFFAOYSA-N 439.335 2.347 10 20 IECD COC[C@@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 749792839 RVBDLBBVYDKIQS-LJQANCHMSA-N 428.512 2.167 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc(C(=O)OC)oc3C)cc2F)CC1 754804292 WRMHJPGVSIYNND-UHFFFAOYSA-N 439.509 2.134 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ncn(C2CCCCC2)n1 755202063 LZJFYUQBDKSHOU-UHFFFAOYSA-N 444.511 2.138 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 756334739 ANUGFJCMZWPTFA-SFHVURJKSA-N 447.557 2.276 10 20 IECD COCCN(CC(=O)O)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 769464601 PUDSEZCNHFSRDR-RAXLEYEMSA-N 428.557 2.289 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c4nccc(Cl)c34)cc2)C1 769637616 IBQBCCMHSINTTJ-AWEZNQCLSA-N 447.948 2.397 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H](c1cccs1)N1CCOCC1 774807397 IYEQVMWVAIMUFK-HXUWFJFHSA-N 442.585 2.154 10 20 IECD Cc1cc(CNC(=O)NCc2cccc(Br)c2O)ccc1S(N)(=O)=O 775221187 FWMIZRRFPYDIKC-UHFFFAOYSA-N 428.308 2.110 10 20 IECD CN(C)C1CN(C(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)C1 775553623 WOBGXRPBFFOCSZ-AUWJEWJLSA-N 440.388 2.423 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@H](c4ccc(F)cc4)C3)CC2)cc1 779219104 HVYOBJWYBMHCHK-UPVQGACJSA-N 429.536 2.391 10 20 IECD O=C(N[C@H]1CCC[C@H]1CCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 779354507 BKTLOWQLIHUNNV-UGSOOPFHSA-N 449.485 2.382 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781442405 DYVVEWUCBCMNFD-UHFFFAOYSA-N 429.448 2.046 10 20 IECD CC(C)CN1CCO[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 785398930 PKFQWMANOOXENC-QFIPXVFZSA-N 430.593 2.012 10 20 IECD NS(=O)(=O)[C@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 785978911 KKMXZPMGNZSXIM-JTQLQIEISA-N 428.146 2.170 10 20 IECD CC(C)(CO)CCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787040417 NZEDMTUVUIFEGZ-HNNXBMFYSA-N 427.492 2.288 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](c3ccnn3C)C(C)C)CC2)cc1 788097992 RVDOQKMRLOTJCM-NRFANRHFSA-N 428.581 2.290 10 20 IECD O=C(NCCOCC(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 788539293 UTTYWFNORMPAMS-UHFFFAOYSA-N 445.400 2.113 10 20 IECD CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 788910353 AFXKQEKQESKTJB-IBGZPJMESA-N 430.549 2.323 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(c2nnc3ccccn23)CC1 788911179 JWQCQYCMKSLXBL-UHFFFAOYSA-N 432.528 2.352 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc(Cl)c1F 792211706 GYGZJCYCKOOCMW-UHFFFAOYSA-N 449.866 2.357 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc4c[nH]nc4cc3C)cc2F)CC1 792220453 AFJMODRROODSHA-UHFFFAOYSA-N 438.507 2.407 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)[C@H](Cc4ccccc4)C3)CC2)cc1 792940952 LOLZXJURFLVAGC-JWQCQUIFSA-N 438.616 2.037 10 20 IECD CN(C[C@@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1)S(C)(=O)=O 795654337 NYXVJMOIINWFLK-INIZCTEOSA-N 432.542 2.432 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(N2CCOCC2)cc1 803298336 BLQFEVXLZMJYFU-OAHLLOKOSA-N 434.587 2.456 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21)c1ccc(N2CCOCC2)cc1 803298408 SSGSSFIYQQZOQN-KLIQENQMSA-N 435.615 2.196 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(NC(C)=O)cc3)CC2)cc1 803557964 XFIXYRXNMCSECS-UHFFFAOYSA-N 438.528 2.051 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4c(F)cccc4F)C3)ccc21 803686128 WZKKXGBDTPDERO-QGZVFWFLSA-N 428.483 2.359 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)CC2)cc1 804316013 XYUZMHHYWGXVIT-UHFFFAOYSA-N 448.564 2.200 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@@H]3C[C@H](C)O)CC2)cc1 804449362 YYRVCTVVWJPPOB-OFFRDUJJSA-N 429.561 2.442 10 20 IECD CC(C)(C)OC(=O)N1CC(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 804756458 AKGYGZVUSAXFCB-UHFFFAOYSA-N 443.500 2.497 10 20 IECD CCN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCN(c2ccccc2)C1=O 806281657 FPQCNZDBYKAJPM-MRXNPFEDSA-N 432.571 2.396 10 20 IECD CCO[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C12CCCC2 807199896 RAJYXFLWTXXZBI-SFTDATJTSA-N 429.561 2.336 10 20 IECD O=C(COC(=O)[C@H](O)c1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)c(F)c1 811278989 BNGMHMVBRSVCEC-HXUWFJFHSA-N 436.867 2.209 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)[C@H]4CC=CC[C@H]4C3=O)cc2F)C[C@H](C)O1 815062960 RYIUYTCCSCQUBW-UOVPBQLFSA-N 429.492 2.007 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccccc4C3=O)cc2F)C[C@@H](C)O1 917714993 XWLDQNCROQBVEI-HUUCEWRRSA-N 425.460 2.352 10 20 IECD NC(=O)CCN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918200726 AVBSCLBEQDMVGP-UHFFFAOYSA-N 428.508 2.374 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(-n4cncn4)nc3)cc2F)C[C@H](C)O1 918204990 XIPSPBGERQHOBR-HOTGVXAUSA-N 439.495 2.414 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(N2CCNC2=O)ccc1Cl 1254760978 IJHPUOXPUGIDQS-INIZCTEOSA-N 447.875 2.185 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320089320 VGIVWZJGNXGGNJ-ILBGXUMGSA-N 435.572 2.291 10 20 IECD COc1cscc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777847872 CMTWONQREOSNTB-IIBYNOLFSA-N 447.513 2.004 10 20 IECD CC(C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783219870 GAXQJVJSEBPOBN-WZMUZEJKSA-N 432.517 2.377 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792219116 KDMCEJVMFKBVDQ-DFRHBOMNSA-N 444.528 2.233 10 20 IECD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)ccc1F 1799767501 ULCLOEDJQDSHHS-IVWMJMPLSA-N 449.866 2.111 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2cccnc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995036 WXTVHBFRGFBUHN-FDDCHVKYSA-N 447.495 2.235 10 20 IECD CC1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1815063638 IRXXYQOPEIODGO-QGZVFWFLSA-N 442.520 2.254 10 20 IECD O=C(c1cc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714517 DFVNNIPMNLQXJX-NRFANRHFSA-N 448.527 2.436 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2ccccc2F)C1 1842700810 YDWIQAAYVMXYQF-VQHVLOKHSA-N 426.444 2.402 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3c[nH]c(=O)cn3)C2)cc1 1844763531 STMSLAJNJIRKHY-UHFFFAOYSA-N 431.496 2.308 10 20 IECD O=C(CCNC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 732274911 VOTFIXTYMJOUOF-UHFFFAOYSA-N 440.519 2.437 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 734687945 YXGLQQYNUGLNQN-UHFFFAOYSA-N 430.574 2.418 10 20 IECD CC(C)CC(=O)NCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 745215052 XMVKBLWPBCFOBT-UHFFFAOYSA-N 436.464 2.496 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)Nc4ccc(C)cc4)CC3)nc12 746478565 FUKHRHHAYMGCRG-UHFFFAOYSA-N 438.488 2.270 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1 747571750 PFSMFBXLFSXNPG-KKUMJFAQSA-N 431.493 2.116 10 20 IECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753737690 IPMZIXDDPVLYPD-GOSISDBHSA-N 427.542 2.077 10 20 IECD CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 755329698 ZOIBKIFPGVWWTA-FZKQIMNGSA-N 449.485 2.334 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cncc(Br)c1)c1ccc(N2CCOCC2)cc1 757161795 ZJNQXWDMPDPFML-CYBMUJFWSA-N 433.306 2.497 10 20 IECD COc1cc(N2CCN(S(=O)(=O)N3CCc4ccccc4C3)CC2)cc(OC)c1OC 759099609 KXEDRZQEVZBXNP-UHFFFAOYSA-N 447.557 2.138 10 20 IECD CS(=O)(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 764733161 AZZFACJEGLWHBN-YOEHRIQHSA-N 431.505 2.475 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)n(C)c1 765754206 SJRMSCCXTVKTNE-UHFFFAOYSA-N 444.351 2.454 10 20 IECD COc1ccc(CC(=N)NOCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772883925 NDGWATLXRWFORH-UHFFFAOYSA-N 430.480 2.028 10 20 IECD CCn1c(=O)n(CC(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)c2ccccc21 777826658 PVNQCRCPZIVJEQ-UHFFFAOYSA-N 431.876 2.384 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(F)ccc3NS(C)(=O)=O)c2)CC1 781269955 XFNDOYDFMLDUKS-UHFFFAOYSA-N 434.493 2.118 10 20 IECD O=C(NCc1ccc(N2CCCC2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787183037 VFHIFKPDJZTRKC-FQEVSTJZSA-N 438.528 2.211 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN3CCc4ccccc43)CC2)cc1 787690264 VZZZCTUSBPTYJE-UHFFFAOYSA-N 436.556 2.303 10 20 IECD C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789802359 XDTYXWOCWHIJMK-ZLLBNUPZSA-N 447.551 2.067 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(F)cc1 789833187 FFQUCMYUMMHDMO-HNNXBMFYSA-N 431.483 2.462 10 20 IECD CCCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789840097 CRKPFHGWINNPDA-LJQANCHMSA-N 435.540 2.211 10 20 IECD COc1cncc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 791698006 ZUEKZLVIXSKPFT-LBPRGKRZSA-N 431.404 2.445 10 20 IECD C[C@H](OC(=O)[C@H]1CCCN(C(N)=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792273171 QBUUXPSQDKETPW-KBPBESRZSA-N 449.463 2.123 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc4c(cc3C)OCO4)CC2)cc1 795067794 LYQOQOHTBSCUME-UHFFFAOYSA-N 447.557 2.223 10 20 IECD COC(=O)c1nc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)sc1C 803664913 RBQHJIFELNCJGD-INIZCTEOSA-N 448.520 2.423 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 807100163 KZPZUMYIVCZMOE-CVDCTZTESA-N 438.572 2.083 10 20 IECD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 913305483 SXUJONLDGASQFC-LBPRGKRZSA-N 448.391 2.137 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1 918434806 SQXRGGOTZQBOCJ-UHFFFAOYSA-N 444.557 2.228 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3cccc(F)c3)CC2)cc1 921118614 HPMYUPYFGASUJU-JOCHJYFZSA-N 430.524 2.379 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)C3=COCC3)CCC2)cc1 1792315938 IQDSQCWQMHXACM-UHFFFAOYSA-N 431.539 2.285 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)c2ccccc2o1)c1cc(O)nc(O)c1 1792852627 XTWNARZJNXQSNW-QDMKHBRRSA-N 435.436 2.165 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1OCCc2ccccc21)c1cc(O)nc(O)c1 1793485632 HCDQLWRFTCXUMF-DMUMMCEESA-N 437.496 2.449 10 20 IECD O=C(CC1CCOCC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806934376 VLZGPZUQWHQLKW-VGOFRKELSA-N 440.500 2.024 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993170 FGAVWODDBGSDAE-FOIQADDNSA-N 437.431 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362577 ZYHZAQNNVICLLS-FPMFFAJLSA-N 441.488 2.206 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nccn3c2)[nH]n1)c1cc(O)nc(O)c1 1817845321 JXAWJXDCRVXLPW-MRXNPFEDSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)ncn2)CC1 1829465536 CZENYTXGWXILCH-INIZCTEOSA-N 445.907 2.483 10 20 IECD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)cc1 1834988938 WOQJNGGWOAGYKT-UHFFFAOYSA-N 438.528 2.300 10 20 IECD COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)cc1F 1847372502 MWISLIYIFZRNHH-SFXFJHKKSA-N 442.443 2.480 10 20 IECD O=C1CCCN1C[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 732449080 LTTGBMAKHHOBHY-SFHVURJKSA-N 432.540 2.473 10 20 IECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 734075398 ZKPSZJORCNDVDN-MRXNPFEDSA-N 445.541 2.051 10 20 IECD NC(=O)C1CCN(c2ncccc2CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 743592145 HEWNHBSWOQDWSK-UHFFFAOYSA-N 437.544 2.367 10 20 IECD CCO[C@H](C)c1noc(CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 743859413 ZWPANZUBLAQECU-GOSISDBHSA-N 444.580 2.009 10 20 IECD NC(=O)Cc1ccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743976027 XNIFJUMHYKDQLF-INIZCTEOSA-N 446.454 2.040 10 20 IECD C[C@H](OC(=O)[C@@H](C)CS(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747077699 DSNJPKBFYCBDTF-STQMWFEESA-N 443.477 2.013 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](C)CS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 747080055 LVTKCZIHCKJKGW-CYBMUJFWSA-N 435.498 2.272 10 20 IECD CCOc1ccc(NC(=O)NCc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 748444672 XVHXTGRXWZDZDP-UHFFFAOYSA-N 435.502 2.134 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](OCC(F)(F)F)C3)CC2)cc1 754043141 PVXGDTAVVYGRNV-ICSRJNTNSA-N 431.499 2.221 10 20 IECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3csc(C4CC4)n3)CC2)cc1 759114535 RZEICGNEIQPYDY-UHFFFAOYSA-N 435.571 2.293 10 20 IECD CCOC1CC(CNC(=O)NCc2cccc(Br)c2O)(N2CCOCC2)C1 767895908 LNDWHXSCMKOCIA-UHFFFAOYSA-N 442.354 2.224 10 20 IECD CC(C)[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCCS1(=O)=O 768127274 WREDRBRIRXXZKO-LJQANCHMSA-N 426.494 2.461 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCOC4(CCOCC4)C3)cc2F)CC1 769102814 OJXVJTCJIVIPGP-LJQANCHMSA-N 434.556 2.495 10 20 IECD Oc1ccc(Br)cc1CN1CCN(Cc2nnnn2-c2ccccc2)CC1 769316636 LYWJKHFWMCUFBT-UHFFFAOYSA-N 429.322 2.448 10 20 IECD CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 770006774 BKVUEZQBMUSZNL-KRWDZBQOSA-N 434.514 2.447 10 20 IECD COCCO[C@@H]1COCC[C@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 776855338 HHTKECMYCQLQSB-NNNWTRQLSA-N 439.528 2.059 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](c3cccs3)N(C)C)CC2)cc1 778226459 SCWHBBXFUIVESS-CFGKVWFZSA-N 442.585 2.381 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781443802 QXQLTEMWWKNPQY-UHFFFAOYSA-N 425.485 2.215 10 20 IECD CS(=O)(=O)c1cccc(Cl)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 784066883 BTHTWEFULAWGDI-HNNXBMFYSA-N 449.960 2.375 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN(C)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 785526572 FOQINFAJBKRTAH-FQEVSTJZSA-N 438.572 2.339 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(N2CCCC2)nc1 787182185 PVAKHUORLYUCHH-UHFFFAOYSA-N 439.585 2.168 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 787191722 RNOFDPXTNGANNS-UHFFFAOYSA-N 439.560 2.338 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 788318631 GEZVWFBBKCHOEQ-NZQKXSOJSA-N 437.540 2.424 10 20 IECD COc1cc(N2CCN(C(=O)CN3CCc4ccccc4C3=O)CC2)cc(OC)c1OC 788769578 UDRZOJVRYRGPIK-UHFFFAOYSA-N 439.512 2.060 10 20 IECD CN(Cc1nccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951809 ZYFBKGLWIMPOMO-UHFFFAOYSA-N 442.463 2.273 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 790226086 SWPBKDWAGBYKCW-FZMUQLTDSA-N 428.460 2.084 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 790912167 OABJHQUWORDKDE-ROUUACIJSA-N 442.516 2.166 10 20 IECD COc1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc(Cl)cc1C(=O)N(C)C 793050755 GIELNOLKJYPTGM-NSHDSACASA-N 449.891 2.148 10 20 IECD COc1ccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c(O)c1 794382447 XCYDIRGYRALPRO-SFHVURJKSA-N 438.571 2.426 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[nH]1 796351577 QSAFWCCHVFNXJD-OKILXGFUSA-N 447.463 2.027 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](C)(CNC(=O)OC(C)(C)C)C3)nc12 801574815 XZBNRKURUCOFAU-NRFANRHFSA-N 433.509 2.348 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@@]2(C1)OCc1ccccc12)c1ccc(N2CCOCC2)cc1 803299863 BMCQEIKUSVWEIM-BVZFJXPGSA-N 435.524 2.358 10 20 IECD CN(CCCn1ccnc1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449277 UOYHTKWENJBRLF-UHFFFAOYSA-N 435.475 2.118 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N(CCN(C)C)[C@H]3CCS(=O)(=O)C3)c2C)cc1 841773607 MGUHJYSUXSRTTN-IBGZPJMESA-N 433.574 2.294 10 20 IECD CN(CCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 918117040 FPFNACIQULJPEY-GOSISDBHSA-N 447.580 2.445 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1Cc1ccncc1 1320692013 JNDYSBUQIBQVFG-OALUTQOASA-N 427.501 2.138 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2(C)COC2)cc1 1792624187 QSQQSBRNTMCAPH-VTYHHJSWSA-N 437.540 2.334 10 20 IECD Cc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796934321 HSSMFKVZJVLCCZ-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H](O)c1ccccc1 1804285059 BWBGYSGNUULUMP-RTJJCOEGSA-N 438.480 2.188 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cnco3)C2)CC1 1806323685 ULZAAUOENHSWTM-UHFFFAOYSA-N 435.484 2.312 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469880 RAQKHBKXNJLOGK-FUOQNJDISA-N 449.486 2.238 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847140 MFNOPHFRHQEHEV-PBHICJAKSA-N 444.536 2.500 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1825921719 HWAFOHQXNFMYQI-QGZVFWFLSA-N 427.505 2.082 10 20 IECD CC(C)N1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827303424 CQMRFQVGECJLHP-HIFRSBDPSA-N 445.545 2.048 10 20 IECD CSc1ncccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442705 VHSYYGLASQLGEA-UHFFFAOYSA-N 449.536 2.413 10 20 IECD CCc1ncsc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844839847 JKWFPAJQJSRZAG-FNORWQNLSA-N 429.498 2.353 10 20 IECD CSc1ccc(CC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056123 IHMSETVOVDGDHZ-UHFFFAOYSA-N 449.623 2.015 10 20 IECD CN(C)c1ccc(CNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 18165313 CWOVMBYISYEVOH-UHFFFAOYSA-N 434.587 2.260 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)n(C)c2ccccc12 578375554 YAMIXWKOUXGZCH-UHFFFAOYSA-N 444.438 2.484 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)o1 726567563 LZHZXAYELRSOFS-UHFFFAOYSA-N 429.445 2.188 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1 726601190 ITIQBWLOCNJFIP-UHFFFAOYSA-N 442.534 2.185 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(OCC(=O)NC)cc3)cc2F)CC1 730384352 IVNUXQIRCMXDSU-UHFFFAOYSA-N 443.523 2.414 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1 732575444 BINSYHAIBAZDCB-IBGZPJMESA-N 437.544 2.042 10 20 IECD COC(=O)NCCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733542209 DFYGCVWAQDMURH-CYBMUJFWSA-N 438.436 2.468 10 20 IECD Cc1cc(CC(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 739696714 PYJRIFAGTAMFHV-INIZCTEOSA-N 438.981 2.322 10 20 IECD C[C@@H](CS(C)(=O)=O)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747077697 DSNJPKBFYCBDTF-QWHCGFSZSA-N 443.477 2.013 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 748470014 FQKLTJNDWYYHJB-UHFFFAOYSA-N 427.457 2.346 10 20 IECD C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)C1 748485500 HSJZJOTVUIYPCG-HOTGVXAUSA-N 445.541 2.314 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](NC(=O)OC(C)(C)C)C3)CC2)cc1 754011144 BKWIMMHXZYRZOH-TZIWHRDSSA-N 448.608 2.167 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN(C(C)=O)c4ccccc43)CC2)cc1 754067973 REOVLHCAXSEFHC-QFIPXVFZSA-N 438.572 2.441 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccccc3CC(N)=O)cc2F)C[C@@H](C)O1 758426116 PPPLIVRAGZADSZ-IYBDPMFKSA-N 429.492 2.162 10 20 IECD COCC1(O)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 759274146 AMSMDUWTWXXVPC-UHFFFAOYSA-N 431.455 2.225 10 20 IECD CCCc1[nH]nc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1[N+](=O)[O-] 760086929 XTMHDUPBMOEKMR-UHFFFAOYSA-N 433.465 2.259 10 20 IECD CCCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n(C)n1 772209782 RZFYVBIXFQFXBQ-GASCZTMLSA-N 431.512 2.380 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccnn3Cc3ccccn3)cc2)C1 772430853 GYZIKRYJYPZBMM-GOSISDBHSA-N 433.516 2.350 10 20 IECD Cc1cccc2c(=O)c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c[nH]c12 776121710 HECLQRXAKDPDRP-UHFFFAOYSA-N 425.510 2.001 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@H](N2CCNC2=O)C1 782971767 NKIZYOIROHMFOV-WBVHZDCISA-N 437.491 2.456 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCOC[C@H]1CCCO1 785562713 OWFQKOWYYZORHU-MRXNPFEDSA-N 443.338 2.205 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](c3cccs3)C3CC3)cc2)C1 785787095 IAMWLJCAHPBMQY-YLJYHZDGSA-N 440.569 2.334 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)cc1 788979115 SXGOHHWEPURHNI-FQEVSTJZSA-N 427.549 2.099 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3CN3CCCC3)cc2F)C[C@@H](C)O1 789822939 BRPKFELTDGDQRJ-NSHGMRRFSA-N 446.567 2.142 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNc2nc3ccccn3n2)c1 790344000 IASWICFZYQPCGI-UHFFFAOYSA-N 433.563 2.382 10 20 IECD COc1cccc(CNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)c1O 798493108 MAVLYSMWFXHQPP-UHFFFAOYSA-N 427.910 2.222 10 20 IECD CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)CC1 799763257 DZRXJWBGPHDNQE-UHFFFAOYSA-N 439.578 2.342 10 20 IECD C[C@H](NC(=O)C(=O)N(CCN(C)C)Cc1cccs1)c1ccc(N2CCOCC2)cc1 803303503 OKPAQRIANBVSBK-SFHVURJKSA-N 444.601 2.352 10 20 IECD CC(C)C[C@H](CO)N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451687 SJYFNYLDXURNQV-QGZVFWFLSA-N 427.492 2.238 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 810208396 VBEAJMLMAYFUMJ-UWJYYQICSA-N 427.549 2.197 10 20 IECD CCN(CC)CC[C@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816487537 QSJXMHXIFWAJBM-OAHLLOKOSA-N 441.575 2.077 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(Cc4ccco4)CC3)CC2)cc1 916198056 HCXNLGMMSLUWIN-UHFFFAOYSA-N 441.576 2.328 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2 918121460 HGZPTVTXKVHRDI-QAPCUYQASA-N 435.528 2.443 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)NC4CCCCC4)CC3)nc12 919803125 UBSAFRJYIDMGOP-UHFFFAOYSA-N 444.536 2.208 10 20 IECD C[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1784714529 RLTFWACEIKAJRX-JBTZNLARSA-N 444.528 2.473 10 20 IECD Cc1nc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)o1 1798819533 GOQRIXDQOSBKAG-VBUUOAMHSA-N 435.484 2.336 10 20 IECD CO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1801041747 NFQYYKCFAPQUQT-KMQSCTNJSA-N 425.529 2.332 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1cc(O)nc(O)c1 1817844763 KMQUOWRUNXSQBA-AWEZNQCLSA-N 428.474 2.221 10 20 IECD CC(C)n1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820602704 IYDSMGKFVSTIDE-LBPRGKRZSA-N 442.501 2.266 10 20 IECD Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827788671 KCDFHAZGSAHGGJ-QGZVFWFLSA-N 448.614 2.417 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(F)c(NS(C)(=O)=O)c1 725992032 OYBWEZACYYUNND-UHFFFAOYSA-N 437.493 2.079 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3c(-c4cnccn4)noc3=O)c2C)cc1 726119102 LIOOZVNINIDJPQ-UHFFFAOYSA-N 433.424 2.370 10 20 IECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726600881 KLYUUVAHDKZKDW-KRWDZBQOSA-N 447.504 2.119 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1 729062458 BHJYOLRGFDTNNZ-JTQLQIEISA-N 426.878 2.274 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(N4CCCC4=O)CC3)cc2F)C[C@H](C)O1 729481905 ILUVEQWRWRLVPO-ROUUACIJSA-N 446.567 2.142 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(CC(F)(F)F)C3)cc2F)CC1 730126485 ZCVPMAMYWVPVNN-MRXNPFEDSA-N 431.478 2.403 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)NCc3ccc(C)cc3)cc2F)CC1 730235028 JUAUYZLVTDFFFS-UHFFFAOYSA-N 441.551 2.392 10 20 IECD COc1ccc(C[C@]2(C)NC(=O)N(CN3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1 730252110 MMZMTGZDMXHQFQ-DEOSSOPVSA-N 438.528 2.337 10 20 IECD CCS(=O)(=O)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 732603920 AKAAHWCOOIXOGG-YRNVUSSQSA-N 449.373 2.116 10 20 IECD CN(Cc1cnccn1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 735522332 YDAHHRYWQPUXHV-UHFFFAOYSA-N 443.441 2.163 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)cc2F)CC1 735750188 FUVJHMAYGUAOBV-UHFFFAOYSA-N 449.552 2.245 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ncn(Cc4ccccc4)n3)CC2)cc1 737138095 IAMOQHGYSLZQTH-UHFFFAOYSA-N 434.500 2.012 10 20 IECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742799357 JRLLXORVRDVXSY-CYBMUJFWSA-N 442.488 2.265 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc4c(c3)CCCN4C)cn2)C[C@H](C)O1 747571264 MOJDXSVQVQDUNE-IRXDYDNUSA-N 440.548 2.223 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 750255432 KTVQIJZBAOVWGS-ZDUSSCGKSA-N 429.473 2.317 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(C(F)(F)F)ccc3=O)cc2F)C[C@H](C)O1 754722048 AWGJUPYFMBNECO-STQMWFEESA-N 442.413 2.331 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 758004474 UENAPWJNHKRCIQ-GJZGRUSLSA-N 435.521 2.325 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3C)CC2)cc(OC)c1OC 759946017 QSCNLDNCWZESBM-UHFFFAOYSA-N 428.489 2.474 10 20 IECD COC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 760087348 PEXHKDDLMQWQBY-UHFFFAOYSA-N 431.489 2.406 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2nccn2C)CC1 760875016 KIHOWJJYERTDFD-MRXNPFEDSA-N 443.507 2.345 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3CCCO[C@H](C)C3)CC2)cc1 764116705 PMTHAWMQZQXUIE-OAQYLSRUSA-N 447.624 2.007 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccn(Cc2ccncc2)n1 768034823 NYCMRISUNUANHS-UHFFFAOYSA-N 436.541 2.135 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@H]1CCO[C@@]3(CCOC3)C1)c2[N+](=O)[O-] 770907138 AGXDBVQCOAUIIQ-NPMABZOXSA-N 436.420 2.438 10 20 IECD COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773854951 DFUHSAAVKCTMGH-MRXNPFEDSA-N 447.557 2.379 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N3CCOCC3)CCCCC2)cc1 774843375 TZORMWBPURWOHK-UHFFFAOYSA-N 430.593 2.300 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(OC(F)F)cc1 775227592 HFQPRGPYWILWAM-UHFFFAOYSA-N 433.455 2.399 10 20 IECD COCCN(C(=O)/C=C\c1cnn(C)c1)c1ccc(NC(=O)/C=C/c2cnn(C)c2)cc1 776966714 MLJWHPWFVLRYTR-CYQDLDFOSA-N 434.500 2.498 10 20 IECD COCCN(C(=O)/C=C/c1cnn(C)c1)c1ccc(NC(=O)/C=C\c2cnn(C)c2)cc1 776966716 MLJWHPWFVLRYTR-WIZYTBDYSA-N 434.500 2.498 10 20 IECD COC(=O)C1(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 784252924 XTYMJDDUPGXRMO-UHFFFAOYSA-N 432.565 2.240 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)N3CCOCC3)CC2)cc1 784356754 SIIHSBRYLQEINK-FGZHOGPDSA-N 427.545 2.175 10 20 IECD O=C(OCc1ncccn1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400195 WINMFGYGWXYBQA-UHFFFAOYSA-N 430.398 2.248 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)Cc3ccc(C)cc3)CC2)cc1 786225788 CYKJWXPXRWBSFF-JOCHJYFZSA-N 440.588 2.419 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1O 787306119 SKRSTVLQADKERF-GASCZTMLSA-N 445.491 2.086 10 20 IECD Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)ccn1 789029290 GRBRWBVERAIDCO-UHFFFAOYSA-N 427.482 2.485 10 20 IECD CN(CC1CC1)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789847771 UVGKTRXPQNCTHE-FQEVSTJZSA-N 430.618 2.046 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OC3CCCC3)cc2)ccc1O 790408096 TVLXFLUGLGYZLJ-UHFFFAOYSA-N 426.516 2.423 10 20 IECD CN(C)C[C@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793728385 YHKATTCEUKDUOG-VXKWHMMOSA-N 439.556 2.189 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1OC 798429708 JCHZJEKZONUACU-UHFFFAOYSA-N 434.514 2.391 10 20 IECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1OC 805592051 JJAXLXUMWHWXSS-UHFFFAOYSA-N 446.475 2.461 10 20 IECD CCNC(=O)OC[C@H]1CCCCN1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 806620146 PQHNRTOKHMRJJF-HXUWFJFHSA-N 447.580 2.127 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1 807452066 ZYNLPKCCLFDZKS-FQEVSTJZSA-N 438.572 2.458 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)c1 815471228 ZUBVNOGGZBUAHK-GFCCVEGCSA-N 427.436 2.304 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C4CCC4)C[C@H](C)C3)CC2)cc1 817020987 PCGAXNIFCPSTTQ-CFGKVWFZSA-N 440.588 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cnn(CC(=O)NC4CC4)c3)cc2F)C[C@@H](C)O1 918219658 MRNDBIGRMCPMJN-GASCZTMLSA-N 444.511 2.236 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2ccccc2O)CC1 918224584 RHLWYHRQBZLFPM-UHFFFAOYSA-N 442.491 2.036 10 20 IECD O=C(Cc1csc(-c2cccnc2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918333944 CYKQTFMXBSXVCT-UHFFFAOYSA-N 442.566 2.299 10 20 IECD C[C@H](NC(=O)NCc1cccnc1N1CCOCC1)c1ccc(N2CCOCC2)cc1 920869183 PKTIYLMKHIRWHA-SFHVURJKSA-N 425.533 2.315 10 20 IECD CCOC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1320473320 VOWFZZJUIOJVPS-LNLFQRSKSA-N 435.540 2.473 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ncccn3)CCC2)cc1 1792313858 CRRNPPMRUYVCIB-UHFFFAOYSA-N 441.538 2.085 10 20 IECD CCn1nc(C(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601532 UVFGZTALEKEAFU-MUJYYYPQSA-N 427.505 2.398 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CC(F)(F)C1 1802634655 NOXDZEAQBUQTSJ-UGSOOPFHSA-N 432.427 2.253 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ncc(F)cc1F 1804282793 CUPGLOFWKMQWLL-BPQKRJORSA-N 445.422 2.442 10 20 IECD COc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825901857 MZDNJWWRMOQVLY-SFHVURJKSA-N 440.500 2.444 10 20 IECD COc1ccsc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442658 ROEHZUJEQHOJHX-UHFFFAOYSA-N 438.509 2.367 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(C)n1C 1844615081 JCRUTYGJVTWERR-UHFFFAOYSA-N 433.512 2.252 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 490359138 AURLNFGCWJVFPB-UHFFFAOYSA-N 438.425 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](C)CS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 734990435 JXOGIFGVKQTEFZ-KRWDZBQOSA-N 432.542 2.462 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1(S(=O)(=O)c2ccccc2)CC1 748135723 YPVUACFQFYSEGE-UHFFFAOYSA-N 430.526 2.261 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC3(c4ccc5c(c4)OCO5)CC3)CC2)cc1 754162519 FEOVGKVVFUIURW-FQEVSTJZSA-N 425.529 2.186 10 20 IECD COC(=O)[C@@H](C)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 756896677 PTATXXLHTPUXRY-GAJHUEQPSA-N 443.519 2.419 10 20 IECD COc1cc(N2CCN(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 759100389 AFXWJUKQVWUVIJ-HZPDHXFCSA-N 427.567 2.057 10 20 IECD CCS(=O)(=O)N1CCc2cc(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)ccc21 759593879 JYLCMDNKXLXHTA-XBXARRHUSA-N 431.466 2.249 10 20 IECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761982911 NYCIUMUTMYRTEI-HNNXBMFYSA-N 441.937 2.297 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC)c(NS(=O)(=O)c2cccc3nonc23)c1 765037931 QSXOHEDJAZYSIF-UHFFFAOYSA-N 439.519 2.096 10 20 IECD CCOC1CC(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)(N2CCOCC2)C1 767781554 ONNZDKKLAWCWPK-BJRAERQBSA-N 446.592 2.153 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1NC(=O)CCN(C)C 768113140 LMQDDMUHCVMDQM-UHFFFAOYSA-N 443.523 2.345 10 20 IECD C[C@H](NC(=O)C(=O)Nc1nc(-c2nccn2C)cs1)c1ccc(N2CCOCC2)cc1 768722552 VUXFOETYPPAXHE-AWEZNQCLSA-N 440.529 2.196 10 20 IECD COC(=O)c1ccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)s1 771080443 BSOHJUUCVWZKBH-UHFFFAOYSA-N 442.497 2.485 10 20 IECD CN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774179393 PDWWOQMITLLTQP-UHFFFAOYSA-N 436.434 2.212 10 20 IECD C[C@H](NC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 775710335 WNUIQNOYXLSLQA-YWZLYKJASA-N 437.500 2.156 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCO[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776422327 YTNVBBHCYSYOPM-GDBMZVCRSA-N 434.514 2.283 10 20 IECD CCNC(=O)c1ccccc1NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778232912 JLKAQSGIPPRSQO-OUKQBFOZSA-N 436.512 2.288 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N(C)C)cc2)cc1F 786301808 NSLYLCHUDYKIQV-UHFFFAOYSA-N 428.508 2.306 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(C(F)(F)F)cs1 788318804 HQBYGOYWTPRCNP-LBPRGKRZSA-N 442.463 2.492 10 20 IECD CC(C)(CO)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 788324879 ZDEXNLYQLCEBAE-QFIPXVFZSA-N 439.556 2.058 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@@H](Cc2ccccc2)C1 789843735 CAHONBWNNUQTQK-QFIPXVFZSA-N 439.581 2.326 10 20 IECD CO[C@@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cccc21 790918021 LSIGUKTWUWJVLR-HXUWFJFHSA-N 425.485 2.248 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]2CCCC[C@H]12 793735887 ZGXOGQBNHSNBFN-XRULBBBTSA-N 426.561 2.042 10 20 IECD Cn1cc(C(=O)CCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 796148036 OWHOZZVTVBHFIF-UHFFFAOYSA-N 445.431 2.340 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(C)C[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803308711 IRIRRZZJPAJKSY-XXBNENTESA-N 436.556 2.216 10 20 IECD COCCCN1CCC(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 804354410 WLNNVZSUQTVNMA-UHFFFAOYSA-N 429.517 2.131 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C(=O)C(C)(C)C)CC3)cc2)CC1 805022990 KVFWHZIQCADHFN-UHFFFAOYSA-N 428.577 2.256 10 20 IECD CC[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 805636026 IPYZOPLIJAVRCZ-IBGZPJMESA-N 430.593 2.156 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)C3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 806847494 QIDSWWKQAJNQRF-SFHVURJKSA-N 446.592 2.436 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 806866559 KSUTXVPKAHGHGD-KRWDZBQOSA-N 438.528 2.431 10 20 IECD C[C@H]1SCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@@H]1C 808854959 ORKYOFRXRRDBLA-QZTJIDSGSA-N 430.618 2.187 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)cc(F)c3F)cc2)C1 815401580 DTBBLJDTYRYZJQ-CYBMUJFWSA-N 434.418 2.061 10 20 IECD CNC(=O)c1cccc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 916196385 DLEWPHWWAAEZBT-UHFFFAOYSA-N 439.560 2.066 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 917998277 HTDPLUVPKMNTIW-OKILXGFUSA-N 436.509 2.408 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 918058514 QGIGLJVCRCNBHO-INIZCTEOSA-N 432.546 2.326 10 20 IECD C[C@@H]1Oc2ccccc2N(CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)C1=O 928484949 CLOHQFWUDGAFKH-INIZCTEOSA-N 425.485 2.068 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(C3CCCC3)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 1319454742 SHANGZCVNWVKLI-OAQYLSRUSA-N 449.617 2.166 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn2ccc(Br)cc2n1 1322461124 WDOGGSQLOOQIMA-ZDUSSCGKSA-N 448.273 2.412 10 20 IECD Cc1cc(CCNC(=O)N2CCN(C(=O)N3CCOCC3)CC2)c(C)n1-c1ccccc1 1349577605 ZKBLKRTWHOSCQT-UHFFFAOYSA-N 439.560 2.416 10 20 IECD C[C@]1(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1(F)F 1785399036 WXNNAJLQKLWGAM-MSOLQXFVSA-N 430.835 2.240 10 20 IECD O=C(CN1CCSCC1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425257 KQBHTJXPBOGQBH-UHFFFAOYSA-N 442.541 2.289 10 20 IECD O=C(/C=C\C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)NC1CC1 1788426956 JFRLMMHMBNZZAY-HJWRWDBZSA-N 436.468 2.075 10 20 IECD C[C@]1(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)CCCN1 1792315068 ZXYNHAWXJHOADP-HXUWFJFHSA-N 446.598 2.123 10 20 IECD CNc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cc1 1799770808 JHKRMDAKONPOMG-CCWDJLKJSA-N 445.903 2.310 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc2sccn2c1 1804333701 PBIWMVNUUWQNFY-BTTYYORXSA-N 448.595 2.113 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998210 JMDYXFPGVLJHMX-VGOFRKELSA-N 436.468 2.433 10 20 IECD O=C(CC[C@@H]1CCOC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813627575 RYBHJGQXHXCCBE-ZDPZECHZSA-N 440.500 2.024 10 20 IECD Cc1nc(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816726763 YZRVKLAMVHBQPR-NSHDSACASA-N 429.458 2.094 10 20 IECD CC(=O)O[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C(C)C 1819248500 KQVRYTOGBOBBCJ-HNAYVOBHSA-N 445.476 2.110 10 20 IECD Cc1ncc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1826731028 FPFYRUYCWYPPFT-LLVKDONJSA-N 445.526 2.183 10 20 IECD COc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427498 ZRWCHUDGWCJFKM-SFHVURJKSA-N 440.500 2.444 10 20 IECD CN(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877310 FAOZBRNTNPXAHX-QRBZPYHOSA-N 445.560 2.388 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 435016729 QHMFQDHJAAODLL-INIZCTEOSA-N 439.497 2.065 10 20 IECD CCCC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 726235099 UOYZDEHFFQEBIH-PMACEKPBSA-N 443.592 2.226 10 20 IECD CN(CCS(C)(=O)=O)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 728026239 FCFDWRYWILHNQR-ACCUITESSA-N 432.614 2.233 10 20 IECD COc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1 734016404 OZONJJIDMNAPOD-GJZGRUSLSA-N 434.514 2.129 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743958394 VBOQNRMNVMGFFS-UHFFFAOYSA-N 430.526 2.379 10 20 IECD Cc1cc(C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c(C)n1-c1ccccn1 748243048 WOFLQJFICCJFHV-UHFFFAOYSA-N 432.528 2.353 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 749628117 NGRYNJSHDPGWJJ-UHFFFAOYSA-N 430.530 2.303 10 20 IECD CC1(C)COCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060548 HPBFSHSVBVBDLY-UHFFFAOYSA-N 439.559 2.095 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 751384187 AFPGPLLIBVBJCY-UXHICEINSA-N 430.593 2.218 10 20 IECD C[C@@H](NC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F)c1ccc(N2CCOCC2)cc1 752288612 TULWRXCFBMTZDB-GFCCVEGCSA-N 441.912 2.454 10 20 IECD COc1cc(Cl)cc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1O 761194724 GSFZQNIIXCBWHR-UHFFFAOYSA-N 436.921 2.437 10 20 IECD COc1cccc(C(N)=O)c1OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 768512232 PGFFBOPPDYXVHS-GJZGRUSLSA-N 445.491 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CN4CCCCCCC4=O)n3)CC2)cc1 771069474 VQLVZDZDMCAJPK-UHFFFAOYSA-N 441.532 2.262 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773740786 SYCTVNUAIPMNET-OAHLLOKOSA-N 448.541 2.449 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 774804634 AMXKTELZGZPJHG-QGZVFWFLSA-N 449.502 2.393 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1O 774821463 QVCOCXDTKHUZJW-UHFFFAOYSA-N 439.465 2.345 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1CCOCC1 786462438 IZBQSEOJBRMDDE-JOCHJYFZSA-N 430.593 2.108 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(C(=O)C2CC2)CC1 786650455 UTIKBCOKBSLCEH-UHFFFAOYSA-N 426.561 2.153 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)cc1 788974445 FFNRLWNTNHVHSJ-UHFFFAOYSA-N 443.636 2.025 10 20 IECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820965 RIIOKGGIDATESW-BWPNAZKDSA-N 446.567 2.141 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCO[C@H](c4ccco4)C3)cc2F)C[C@@H](C)O1 789822950 BURXFHLVHVTORI-MRUHUIDDSA-N 445.491 2.249 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 789867918 JNWYXSULVLMNDK-VAMGGRTRSA-N 429.586 2.320 10 20 IECD C[C@@H]1OCC[C@]12CN(C(=O)c1ccc3c(c1[N+](=O)[O-])C(=O)c1ccccc1C3=O)CCO2 791887885 HWYOWRBQGLZUHQ-NPMABZOXSA-N 436.420 2.390 10 20 IECD COC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCC1 792344210 IKUGRKXKCIMVMQ-ZACQAIPSSA-N 435.540 2.472 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H]3CN3CCOCC3)cc2)CC1 805026042 ZXXLGHVAPVNZDE-QHCPKHFHSA-N 442.604 2.252 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)s1 807695949 WZUYXCIGWBMRGZ-UHFFFAOYSA-N 448.522 2.295 10 20 IECD C[C@@H](OC(=O)C[C@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808689705 GOQGFXIOFHCGPX-ZIAGYGMSSA-N 434.448 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCCN4c4ncccn4)n3)CC2)cc1 809464233 DIERLIFWKXWFBZ-IBGZPJMESA-N 449.515 2.101 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC[C@]1(C)NC(=O)NC1=O 819518905 KGCFRSSNBMPLFO-QFIPXVFZSA-N 432.521 2.143 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C 819756574 ZAAWLBISCOVNDX-UHFFFAOYSA-N 426.535 2.321 10 20 IECD O=C(NCC(=O)N1CCCCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916473882 ZBGOZECRFNFIRN-UHFFFAOYSA-N 428.455 2.354 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3cccnc3N3CCOCC3)CC2)cc1 918006487 TYDCRDHDOMQGBO-UHFFFAOYSA-N 425.533 2.349 10 20 IECD CS(=O)(=O)c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc1 918198831 ICVBRYIUISWWOV-DTQAZKPQSA-N 426.585 2.014 10 20 IECD O=C1N[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)CS[C@H]1Cc1ccccc1F 919860364 WAYYDXNADKUKCX-SFTDATJTSA-N 443.544 2.121 10 20 IECD COC(=O)N(C)c1ccccc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 920261650 FPKOQBYKNCJGDV-UHFFFAOYSA-N 441.484 2.403 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 1319624331 GXKNQAILJQMQOD-QZTJIDSGSA-N 442.560 2.481 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCC(=O)N3CCC[C@@H](C)C3)CC2)cc1 1341870180 XKJXCTWXUJHUBX-HXUWFJFHSA-N 445.608 2.155 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cccs1)C2)c1cc(O)nc(O)c1 1777847860 BWAXCCMGBNDLAZ-VRJXGNDESA-N 443.525 2.395 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1ncccc1F)CCO2 1782007177 LHZYGZRXBPFMDO-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C4CC4)cc3)C[C@@H]21)c1cc(O)nc(O)c1 1787294148 DWFIXBDQQGJEJQ-IHPCNDPISA-N 437.496 2.277 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cn2c(Cl)cccc2n1 1796601320 ULNVVEXGTWSWBB-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1F)C1=NN(c2ccccc2)C(=O)C1 1797219715 OGPUPUYOZAEXDQ-ACHSLPGTSA-N 435.459 2.265 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c(C)n1 1799769390 ZSWYSCDDSUGLIK-CCWDJLKJSA-N 445.903 2.280 10 20 IECD Cc1nnc(CCC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)s1 1810547829 XAJIXWGRNBDLCD-UHFFFAOYSA-N 445.545 2.130 10 20 IECD CCn1nc(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817839035 SFRGBKWMCFYAEG-OAHLLOKOSA-N 439.476 2.360 10 20 IECD C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499664 SLPDQEZJFDCZHC-AGMRTUQYSA-N 435.575 2.308 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3ccccc3O)CC2)CC1 1837348128 CLZAKCBIPNFZMF-UHFFFAOYSA-N 441.484 2.124 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037413 OMQSPSJWLUTIIW-PMGBHYCQSA-N 426.469 2.492 10 20 IECD CN1CCc2cc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)ccc21 1847037662 PHXQSFQSPBBIMA-VMPITWQZSA-N 449.507 2.326 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccccc3OC(F)F)cc2)C1 725826081 YRSUQPFKNSLHPQ-HNNXBMFYSA-N 439.484 2.468 10 20 IECD COCCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)CC(F)(F)F 732808411 OSYPVQBGZXNCDJ-UHFFFAOYSA-N 447.479 2.435 10 20 IECD NC(=O)CCNC(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 733631086 DDPZYLBOYUXCGL-IBGZPJMESA-N 440.500 2.211 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc1 734214231 USTBEYBSFKQUPN-VQTJNVASSA-N 445.608 2.154 10 20 IECD Cc1cc(C(=O)Nc2cnn(CC(=O)NCCN(C)C)c2)c(C)n1-c1ccc(F)cc1 741713882 ZJSABXCDXSZMOA-UHFFFAOYSA-N 426.496 2.360 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1 741908064 YWCPJQIHJJDQBQ-UHFFFAOYSA-N 431.558 2.325 10 20 IECD COc1cccc(CNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1O 745807779 FGFXXEQVJOBERT-LJQANCHMSA-N 426.517 2.098 10 20 IECD COc1ncc(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 746783759 QJIFWXYBWRJCMA-GJZGRUSLSA-N 430.480 2.406 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1 748081451 ZNBDSZVYKOOYNR-UHFFFAOYSA-N 426.336 2.401 10 20 IECD Cc1cnc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)o1 748378615 KWTZHESCZFORFT-UHFFFAOYSA-N 432.414 2.328 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 751415564 SJWPOLHOLFZPKE-UHFFFAOYSA-N 440.543 2.054 10 20 IECD CN(C[C@@H]1CCC[C@H]1O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755060197 XJCNDQAEWUGTCA-GHTZIAJQSA-N 442.539 2.245 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c1 760660088 PSPRPWCBWKOKAC-FPOVZHCZSA-N 436.505 2.407 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 773242323 HDLSTKBINRXQCO-MRXNPFEDSA-N 442.491 2.099 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 775046063 WRPYDFBKKKFBLY-DENIHFKCSA-N 436.556 2.091 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)cc2F)C[C@@H](C)O1 775178776 CYROVAANSQPUQY-MBNYWOFBSA-N 432.323 2.366 10 20 IECD O=[N+]([O-])c1cc(NS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)ccc1O 775286525 VOMYFFSIIWIGLT-UHFFFAOYSA-N 429.208 2.446 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1csc(N2CCCC2=O)n1 777827588 DBHUGFLFGHEEQB-UHFFFAOYSA-N 437.905 2.373 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC)cc3OC)CC2)cc1 778239594 UBRLKUFPSDGRHC-ZHACJKMWSA-N 439.512 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)N3CCC(C)CC3)CC2)cc1 778249884 FVRXRXCVNMPOEC-ZTBDEIDFSA-N 428.577 2.137 10 20 IECD COC(=O)c1csc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778324057 BEYDABICGRHRLF-FPLPWBNLSA-N 429.498 2.387 10 20 IECD CCOc1cnc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 778536667 VROQBQPWHVOSDM-GASCZTMLSA-N 446.479 2.101 10 20 IECD COc1ccc(C(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c(OC)c1OC 779532726 WABDBQBISNZYCN-UITAMQMPSA-N 442.468 2.121 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4c(cccc4OC)C3)CC2)cc1 782845347 IKLSWYICFXOOJE-KHPPLWFESA-N 435.524 2.494 10 20 IECD CN1CCC(N(C)[C@H]2CCCC[C@@H]2N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785445887 ZYGCMONUYVQSFO-GOTSBHOMSA-N 443.636 2.164 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](Oc4ncccc4F)C3)CC2)cc1 785837682 GIZBCDWWVPFLTA-UNMCSNQZSA-N 444.551 2.256 10 20 IECD O=C(NCc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 786626424 WJQWTQYIVUTOCU-UHFFFAOYSA-N 432.318 2.218 10 20 IECD CCS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786655001 BHUQZQFOCSOTKZ-UHFFFAOYSA-N 447.532 2.218 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(F)cc1 787638522 NKRKTXKGAXWWFN-RTWAWAEBSA-N 443.519 2.458 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)nc1 788909212 DOBKPROPHZRRKG-HXUWFJFHSA-N 449.555 2.484 10 20 IECD CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798195 DAELJRZGJJPQGV-JOCHJYFZSA-N 443.519 2.169 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 789825750 OLFCMXSTNNJHKC-GGPKGHCWSA-N 446.567 2.142 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1c(C)nn(CCS(C)(=O)=O)c1C 797973029 KTBWRMRURJEHOE-UHFFFAOYSA-N 443.953 2.079 10 20 IECD Cc1nn(C)c(Br)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 800854319 ZIATYJMOYUURGS-CQSZACIVSA-N 434.338 2.123 10 20 IECD CCCCN(CC(=O)N1CCN(c2ncnc3c2cnn3C)CC1)Cc1ccccc1O 801596554 FHNGIJNWBPHVJE-UHFFFAOYSA-N 437.548 2.020 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 803297413 UUEDMPXMRJEBNO-QGZVFWFLSA-N 441.528 2.376 10 20 IECD C[C@@H]1CC(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 803448360 PDGAFVYWONHKTL-ZIAGYGMSSA-N 425.476 2.445 10 20 IECD COC(=O)c1nc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)sc1C 803664915 RBQHJIFELNCJGD-MRXNPFEDSA-N 448.520 2.423 10 20 IECD CC(C)[C@H]1CN(C)CCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768642 NNFPHFFBBFKURW-VQIMIIECSA-N 438.519 2.172 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CNS(=O)(=O)c2cccnc2)cc1 810075652 RHBYCUDBORJQAK-UHFFFAOYSA-N 428.514 2.248 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)cc1 916502835 NIFBQRHGJHMRAD-UHFFFAOYSA-N 427.549 2.422 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](c4nnc5n4CCCCC5)C3)nc12 917090765 NTWGBDNDIIZQLL-HNNXBMFYSA-N 439.520 2.309 10 20 IECD COCCOc1ncccc1CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918209913 WTJMBAZSRCXBBE-UHFFFAOYSA-N 432.496 2.206 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCCc4ccc(F)cc43)cc2)C1 918464901 DFEUNBQWYQKPBC-GOSISDBHSA-N 438.503 2.123 10 20 IECD C[C@@H]1Cc2cc(C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2N1S(C)(=O)=O 919767300 TZWXLMSLVWEYGT-MRXNPFEDSA-N 429.542 2.164 10 20 IECD CN1CCN(c2ccc(CN3CCN(C)C[C@@H]3CNC(=O)OC(C)(C)C)cc2F)CC1 1321777558 CWHPXADFNLEHDS-IBGZPJMESA-N 435.588 2.218 10 20 IECD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)n[nH]1 1790111879 NIRGDDDVEYCRKB-UHFFFAOYSA-N 443.554 2.326 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccsc3)C[C@@H]21 1792218490 HZSOYTBYXCPVED-NVKRQELUSA-N 444.509 2.172 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@H](c2ccccc2)C1)c1cc(O)nc(O)c1 1797752157 SOARPHJRMSHJES-ZMMAXQRCSA-N 436.468 2.262 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CCC(CC1)CC2 1803248799 BHVBWTIPHBRWFV-OBYNBTBUSA-N 435.615 2.455 10 20 IECD CCc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807992917 FADUMFZRCQNBRF-HTAPYJJXSA-N 447.495 2.479 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c(C)n1C 1807994963 MBYPREZRVVQEBZ-JTSKRJEESA-N 449.511 2.477 10 20 IECD CC(C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874690 DNIHICFFKWNORP-XDJBQHOISA-N 446.544 2.453 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cnc1C 1843441263 IVQNCUOJDHNGTG-UHFFFAOYSA-N 431.496 2.308 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)nn1C(F)F 1844785976 RQXWJAGKIJBQLS-GQCTYLIASA-N 448.426 2.234 10 20 IECD N[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1cccnc1 1845501032 RJDCXTRTARUAPR-INIZCTEOSA-N 430.892 2.053 10 20 IECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N1CCOc2cc(N(C)C)ccc21 542964473 KSDYIEMOWFEINF-MRXNPFEDSA-N 433.534 2.356 10 20 IECD Cc1nc(S(=O)(=O)NCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cn1C 725892248 XIDAJCBWONPXGL-UHFFFAOYSA-N 433.578 2.092 10 20 IECD Cc1ccc(C(=O)OCC(=O)N2CCC(NC(=O)CCc3ccccc3)CC2)c(O)c1O 727004244 JRLJNECCKVVFAC-UHFFFAOYSA-N 440.496 2.303 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)OC(=O)c2ccc(C)c(O)c2O)c1 727005919 XOPYUKWDGWSVGT-LLVKDONJSA-N 431.397 2.163 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 728302229 UCNLKVNPOWUWGC-UHFFFAOYSA-N 431.558 2.077 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)c1 729529715 DHAQODNZSALIIM-UHFFFAOYSA-N 449.554 2.134 10 20 IECD CCCCN(C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732885492 QNYDWKYEXZITHQ-UHFFFAOYSA-N 443.571 2.473 10 20 IECD COc1cccc(CNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c1O 743916188 UHVZMFWVIVCYKL-CQSZACIVSA-N 445.903 2.279 10 20 IECD CN1CCCc2cc(CNC(=O)c3cc(S(=O)(=O)N4CCCC4)ccc3O)ccc21 745991638 YRSHNXNMOURFJR-UHFFFAOYSA-N 429.542 2.489 10 20 IECD O=C(Nc1ccn(CC(F)(F)F)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 746363237 OUSIXAQOYFSNBR-AWEZNQCLSA-N 426.395 2.297 10 20 IECD CCN(CC)c1ccc(CNC(=O)NC[C@H](O)CS(=O)(=O)c2cccs2)cc1F 752170511 IUDDLEOKRNGNEI-HNNXBMFYSA-N 443.566 2.367 10 20 IECD CN(CC1(O)CCCC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752654388 OAIXAYDEJIPUCG-UHFFFAOYSA-N 442.539 2.389 10 20 IECD C[C@@H]1COCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 754512758 SBZYATCOPNHBMC-ZDUSSCGKSA-N 435.458 2.210 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755346764 SLJKJZZUWYBEDY-MSOLQXFVSA-N 434.581 2.483 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 761290120 MLTIZPOJMPLBON-GFCCVEGCSA-N 444.531 2.211 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@H](C(N)=O)c3cccc(Br)c3)cc2)C1 763376411 LGGALIPWOZAKTQ-LPHOPBHVSA-N 445.361 2.467 10 20 IECD C[C@@H](NCc1ccc(N(C)C)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 764635213 NSURDHZZBXLTBA-OAHLLOKOSA-N 425.576 2.329 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1 774804818 CFALLMVVPHQTOY-HXUWFJFHSA-N 444.601 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccccc3Cn3cncn3)CC2)cc1 778247989 ZJALWQNQCQDMGS-KHPPLWFESA-N 446.511 2.179 10 20 IECD COC[C@H](C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 778528692 GSQLGFLJXINGDX-JYJNAYRXSA-N 447.511 2.098 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cccnc2-n2cncn2)cc1 782423560 AJKYLCXTXWETOI-UHFFFAOYSA-N 445.483 2.489 10 20 IECD CCOC(=O)c1ncn(C2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c1N 788000291 TYJFEJUEKNOGRX-UHFFFAOYSA-N 442.564 2.004 10 20 IECD COc1cc(O)c(CNC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)cc1OC 789774065 KXCDYYDNEJLJDO-SFHVURJKSA-N 432.492 2.356 10 20 IECD COC1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789819482 NLEDUWVLQRJOBD-GIOYIUAESA-N 435.540 2.377 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1 789819918 OTYCPMDSVWHXLK-YRNRMSPPSA-N 435.540 2.377 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789825475 MCAYCQBKUAIOBN-IAGOWNOFSA-N 434.556 2.045 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842218 BVEKAQHYRVTWPO-FQEVSTJZSA-N 443.523 2.107 10 20 IECD CC(C)C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789847843 WVFGPHCQQSWGMY-PKOBYXMFSA-N 435.540 2.113 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)O1 789948478 BCNUWDYDOOZPRW-WMLDXEAASA-N 443.466 2.184 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)CN(C)[C@H]3CCS(=O)(=O)C3)cc2Cl)C1 800572627 ZXZIPJZZRQLRAB-RDJZCZTQSA-N 427.998 2.311 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3C)CCCC2)CC1 805155360 ZSNMLNRMIDWKLM-UHFFFAOYSA-N 430.593 2.217 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCCCSc1nccs1 806277129 RBDUBMGAUNAJLR-ZDUSSCGKSA-N 428.580 2.209 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccncc1OC[C@@H]1CCOC1 806456979 BDSFJSICGPSKNU-GOSISDBHSA-N 444.507 2.472 10 20 IECD CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287420 JQQQOEHVGXKGHJ-LJQANCHMSA-N 426.561 2.080 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387803 XZVGHSRNKPDEIE-UHFFFAOYSA-N 436.306 2.350 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 808582776 KFYYFNBKHMCFLS-HXUWFJFHSA-N 440.931 2.478 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918311791 VMHSJCVYBIXDPC-UHFFFAOYSA-N 440.544 2.061 10 20 IECD O=C(COc1ccc(F)cc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334438 GNEOSNINJDLYDY-UHFFFAOYSA-N 426.897 2.409 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 1116592240 QXDKJSNNKCYSIT-INIZCTEOSA-N 436.505 2.335 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 1255148005 FLHGECKKIDRGRP-HNNXBMFYSA-N 430.482 2.436 10 20 IECD CN1CCN(c2ccc(CN[C@H](Cc3ccccc3)C(=O)N3CCOCC3)cc2F)CC1 1320250877 BGAQEIWZRWWDNL-HSZRJFAPSA-N 440.563 2.137 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505433 IFZYXRZKSALHRV-QIBGMHRESA-N 430.501 2.083 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(Cl)c3)C[C@@H]21)c1cc(O)nc(O)c1 1787295436 RKZHVXCKYAUUQM-JQFCIGGWSA-N 431.876 2.053 10 20 IECD CC(C)(C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314455 CSIGDKKZTHCYNR-KRWDZBQOSA-N 449.598 2.388 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)C(F)F 1806430581 BIZIEJNNIAGRGQ-HNAYVOBHSA-N 441.438 2.145 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCSC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001767 QMDSDGNZHXQDOS-YRNRMSPPSA-N 442.541 2.351 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccno1)CC2 1828194894 ARWQBFUFIIMIPZ-GSQGTZRGSA-N 442.453 2.187 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1Cl 1841151663 BNNMYUDLBHUWIE-UHFFFAOYSA-N 437.974 2.326 10 20 IECD C[C@H](Cc1ccncc1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039467 UHFOIVSPTPWFLK-MQDFFIGUSA-N 437.496 2.294 10 20 IECD COc1ccc(N2CCCN(CN3C(=O)C(=O)N(Cc4cccs4)C3=O)CC2)cc1 108225477 ZQERFDVUEQQLIK-UHFFFAOYSA-N 428.514 2.217 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1 109701870 KUTJEGJKXWEQIY-GMAHTHKFSA-N 449.555 2.380 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](O)COc3cccc(F)c3)cc2F)CC1 730133385 QCIMSOWIYQLBRN-IBGZPJMESA-N 448.514 2.346 10 20 IECD CC(=O)NC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCCC1 731255923 JTUUXEDSHLPUMQ-IYBDPMFKSA-N 449.523 2.048 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)CC1 731844376 FSDZNPIKAKYOQX-OAQYLSRUSA-N 431.577 2.479 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21 733314355 RHVPFQXCYVZVKD-UHFFFAOYSA-N 449.598 2.332 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(S(N)(=O)=O)c(Br)s1 734471013 KQPLJKSAKUQUNT-UHFFFAOYSA-N 432.365 2.462 10 20 IECD Cc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 737107721 PYPMGWAMDUHJNS-UHFFFAOYSA-N 426.395 2.402 10 20 IECD COc1ccc(-c2n[nH]cc2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 742560444 HFHNGBGNNOXMDP-UHFFFAOYSA-N 440.525 2.250 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)ncn4C)cc2F)CC1 743907404 QHSBLQREUXETQY-UHFFFAOYSA-N 438.507 2.109 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cccc4c3CCCC4)cc2)CC1 748058355 HPPZUNIRUJKJCC-UHFFFAOYSA-N 434.583 2.279 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)c1 748842761 XSCIJSPZFONLSG-UHFFFAOYSA-N 440.481 2.341 10 20 IECD CN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1ccc(F)cc1 748963357 ZXHKYHKTJWCULB-HXUWFJFHSA-N 441.551 2.459 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 754234551 OTXHNTIUDXZUIM-ZCYQVOJMSA-N 425.573 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755703604 KLNSCKQIUNQCNT-SJORKVTESA-N 449.548 2.436 10 20 IECD O=C(COC(=O)CCc1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCOCC2)c(F)c1 756532934 CKEAJPSAZDMBBH-UHFFFAOYSA-N 445.447 2.363 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](C)N3CCc4ccccc4C3)CC2)cc1 758209121 IAVXXPSPMXEEBA-BWKNWUBXSA-N 438.616 2.215 10 20 IECD COc1cc(N2CCN(C(=O)NCC(=O)N(C)C3CCCCC3)CC2)cc(OC)c1OC 759273456 MNKYSIAQFRTTQS-UHFFFAOYSA-N 448.564 2.335 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)CC2)cc1 762558740 LKACPYUXRYBSCR-VAMGGRTRSA-N 436.647 2.496 10 20 IECD O=C(NCc1cccc(Br)c1O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1 765326368 HSTQCACGRRTAQG-CQSZACIVSA-N 433.262 2.227 10 20 IECD COc1cccc(CNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c1O 769498692 MAMBITFWSXXSSO-JTQLQIEISA-N 433.258 2.464 10 20 IECD CCOC(=O)[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 774022726 HRAMKDWSSKZGFW-GFBZKKKVSA-N 442.584 2.160 10 20 IECD CCCCn1c(N)c(N(CC)C(=O)CN[C@H](C)c2ccc(N(C)C)cc2)c(O)nc1=O 775832697 ABOLVFWQPXLFQB-OAHLLOKOSA-N 430.553 2.101 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc(CN(C)C)c3)CC2)cc1 778226032 NHGWWAIKBFMKJQ-VAWYXSNFSA-N 436.556 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3C3CCOCC3)CC2)cc1 778423274 QALPELWMSYZZPJ-HYGBKTPJSA-N 427.545 2.318 10 20 IECD COc1ccc(N2CCC(Nc3ccc(C(=O)N4CCS(=O)(=O)CC4)cn3)CC2)cc1 786774548 MHEZUCNJROPNJK-UHFFFAOYSA-N 444.557 2.042 10 20 IECD COCCOc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 787993963 HVXFQEJFRNBKAX-UHFFFAOYSA-N 441.528 2.122 10 20 IECD C[C@H](c1ccccc1F)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734592 UWMCNLAMFMTEFQ-AEFFLSMTSA-N 440.519 2.363 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1F 796734972 XNTJSMWYKXJUCU-ZDUSSCGKSA-N 447.438 2.404 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCOc1ccc(F)cc1 803712438 IOTBDTSVWMNNMC-UHFFFAOYSA-N 429.492 2.206 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@@H]3c3cccs3)CC2)cc1 803747474 QNIGMIGCSXSNPC-HXUWFJFHSA-N 442.585 2.359 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 807631628 BUXHYHQQKUKKFR-UTKZUKDTSA-N 442.512 2.492 10 20 IECD COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 912980736 OJYRKKNGXOBSTF-UHFFFAOYSA-N 434.879 2.219 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 916228922 PMPSCBYXBQDQRK-UHFFFAOYSA-N 448.614 2.288 10 20 IECD O=C(Cn1cnc2c(oc3ccccc32)c1=O)NCc1ccc(N2CCOCC2)c(F)c1 917193439 WFSQQAPMBUWVQO-UHFFFAOYSA-N 436.443 2.435 10 20 IECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 918444099 LJEIYGYEEOZMFW-UHFFFAOYSA-N 433.530 2.410 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 920921134 XYVWPNSQTQPNOL-CQSZACIVSA-N 438.575 2.053 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sc(-c2cnn(C)c2)nc1C 1325761225 CMXAPFLGUCDWSP-AWEZNQCLSA-N 430.486 2.167 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)cc3)C2)C1 1780744075 AQWAVEOYWGINMY-OAQYLSRUSA-N 432.860 2.214 10 20 IECD CN1CCC(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)CC1 1805004544 ZGLHHKUNQFPROL-UHFFFAOYSA-N 430.549 2.070 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccnc2Cl)C1 1840968322 GQLSMPUDVHFPSZ-UHFFFAOYSA-N 437.887 2.345 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3c(c2)OCO3)C1 1843627316 YMWFNRVVEFLCHG-QPJJXVBHSA-N 438.436 2.063 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2c(C3=S=CC=C3)nc3ccccn23)cc1 509813346 WPRUFYFSKWJCEA-UHFFFAOYSA-N 426.523 2.463 10 20 IECD CCS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 732536736 HTASLJHTSIFRDZ-UHFFFAOYSA-N 440.518 2.106 10 20 IECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1OC 739941654 SLVDSNIKNRCHIU-UHFFFAOYSA-N 434.514 2.139 10 20 IECD C[C@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 743638601 RXTCWYODOKZLNO-KBPBESRZSA-N 448.501 2.314 10 20 IECD CCCN(CC)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746756975 RJHHCMBHBBAFJT-UHFFFAOYSA-N 443.571 2.473 10 20 IECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1cc(OC)ccc1O 752395196 XNVUPWLGNSJQPH-UHFFFAOYSA-N 426.878 2.103 10 20 IECD CN1CCCc2cc(CNC(=O)NC3CCN(S(=O)(=O)C(F)(F)F)CC3)ccc21 755302866 PYZUZIBWXYGRHV-UHFFFAOYSA-N 434.484 2.182 10 20 IECD COc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1O 760455072 QWTIMXFUTRYKCG-UHFFFAOYSA-N 432.473 2.398 10 20 IECD CNS(=O)(=O)c1ccc([C@H](C)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 761148494 CQQHPWNRSFKQGA-LBPRGKRZSA-N 437.905 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN([C@@H](C)c4nccs4)CC3)CC2)cc1 767010713 RIQNXYGCLJDCKH-SFHVURJKSA-N 429.590 2.179 10 20 IECD C[C@@H]1CN(C(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)C[C@@H]1O 769129297 RLOBYMXOXYRQBC-XKJFWKHASA-N 441.372 2.490 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 769164027 TZHWNPRZXXRQJR-DNQXCXABSA-N 444.620 2.462 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nc21 771066264 QHHRIOGVCOTLTH-OAHLLOKOSA-N 444.923 2.141 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cnn(CC(=O)NC4CCCC4)c3)CC2)cc1 772061661 RUJMBNJZHFAILH-UHFFFAOYSA-N 425.533 2.303 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H](c1ccco1)N1CCCC1 774871445 QMHFUQZCBIWCRB-NRFANRHFSA-N 440.544 2.028 10 20 IECD CNS(=O)(=O)[C@H]1CCN(Cc2cc(Br)cc(Br)c2O)C1 775738445 DXIJRRNLLSMBRN-JTQLQIEISA-N 428.146 2.041 10 20 IECD COC(=O)[C@H]1C[C@@H](OC)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778239575 TZINUTUSMYHCGD-MGPUTAFESA-N 436.464 2.053 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(OC2COC2)cc1 782093280 NOUHIBQDNOGTSE-UHFFFAOYSA-N 431.514 2.021 10 20 IECD NS(=O)(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)c1 782896091 KCMFUSTYBHHZLS-UHFFFAOYSA-N 431.514 2.340 10 20 IECD O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 786755580 YXQJVDDHSSPYCC-UHFFFAOYSA-N 442.466 2.258 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1(Cc2ccccc2)CC1 789813912 XIFMFWRGMOYZRP-UHFFFAOYSA-N 425.504 2.418 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(c2ccccc2F)CC1 789860561 LYXLMALDDXFFLJ-UHFFFAOYSA-N 442.560 2.344 10 20 IECD C[C@@]1(O)CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 792050979 JOBMZPBHOQAKOJ-HSZRJFAPSA-N 442.539 2.389 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cncc(Br)c3)c2)CC1 795352330 YZDYCRURKFYSPR-UHFFFAOYSA-N 439.335 2.313 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 804317320 ZRTANDPJXJCSFQ-GOSISDBHSA-N 425.529 2.190 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1 804520437 HGLWNUFGOZEEBR-UHFFFAOYSA-N 439.556 2.404 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CCCC2)CC1 805158191 LQSGCNYFQAYHQD-UHFFFAOYSA-N 440.588 2.219 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCC[S@@](=O)Cc2ccccc2)C2CC2)cc1 805408408 UGSXGVGKVGJCHX-SSEXGKCCSA-N 427.570 2.309 10 20 IECD CC[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 805636266 MHSOQTAMKAHXAY-GOSISDBHSA-N 448.583 2.295 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 806457235 HBOUULIUBDWXSC-GOEBONIOSA-N 433.446 2.489 10 20 IECD O=C(NCCCCn1cc(Br)cn1)C(=O)NCc1ccc(N2CC=CC2)cc1 807289506 XHOIDYARSVFJHO-UHFFFAOYSA-N 446.349 2.235 10 20 IECD CC[C@@H](C)Oc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccn1 808742767 GTWFJBHSAIHFSG-GOSISDBHSA-N 440.544 2.370 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CCOCC(F)(F)F)cc2F)C[C@@H](C)O1 809808933 BNIGGAWRKXBTJR-BETUJISGSA-N 428.448 2.438 10 20 IECD CCCC(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 825177447 FYPODIJUWTZVCE-DHDCSXOGSA-N 436.511 2.076 10 20 IECD C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 917417052 GTBBMVPFBXBTDH-MRXNPFEDSA-N 442.585 2.342 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2C)cc1OC 917759322 NLJZWVVSTLWLFJ-UHFFFAOYSA-N 428.488 2.264 10 20 IECD CN(C)C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918436816 FIUBRDBHYGNDDD-UHFFFAOYSA-N 426.542 2.197 10 20 IECD CC[C@@H]1[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCN1C(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 985026847 LNNXQFFGRVOYPU-LUMDGCDRSA-N 425.489 2.382 10 20 IECD Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1F 1777846581 OXFSRMQIFAOKOG-UZUQRXQVSA-N 443.475 2.382 10 20 IECD CCc1noc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779638802 YBVMMYVFTVJADN-NRFANRHFSA-N 449.891 2.367 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@H]1C[C@H]1F 1807821257 WDRMEAPCMZKYDH-TXXUCJGISA-N 449.486 2.238 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](N)CN)C3)CC2)cc1 1810861270 RBEIACZODOUDAR-QFIPXVFZSA-N 437.588 2.225 10 20 IECD CC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708304 QYEGUCYDWXBHMA-CABZTGNLSA-N 425.894 2.204 10 20 IECD O=C(Cn1ccnc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708642 LGOSFZRJZOBMOM-LLVKDONJSA-N 447.904 2.330 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)C1CCCC1)CC2 1828242185 BWZQDYWEJJEWJZ-LLVKDONJSA-N 438.600 2.106 10 20 IECD CC(C)NS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 16134716 IWKMQUUUADAWCA-UHFFFAOYSA-N 431.558 2.482 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3C3OCCO3)cc2F)C[C@@H](C)O1 728172986 QENMDEBXXWZEEG-CBGDNZLLSA-N 435.540 2.283 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)c1 734018895 MIMHIEGTWAUYQQ-INIZCTEOSA-N 442.534 2.256 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)c1O 740493893 KUSQRDPQXINXJA-UHFFFAOYSA-N 449.529 2.041 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742805120 GSJPYKIWPFDWGX-CQSZACIVSA-N 438.475 2.484 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 752721468 COHTZMGIYIZQSO-UHFFFAOYSA-N 444.532 2.336 10 20 IECD COc1ccc(N2CCN(CC(=O)NCC(=O)N[C@H](C)c3ccc(F)cc3)CC2)cc1F 753856953 KECKPKPKGBKDCR-MRXNPFEDSA-N 446.498 2.089 10 20 IECD COc1ccc2c(c1)C=C(C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)CO2 755199398 UCIAPTIRVOXZCJ-UHFFFAOYSA-N 428.510 2.022 10 20 IECD COc1cc(N2CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)CC2)cc(OC)c1OC 759220284 HIZOULGKXCXXSC-UHFFFAOYSA-N 435.521 2.418 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2C)cc1OC 763279334 BEHCWFKVDMRVAZ-UHFFFAOYSA-N 428.488 2.264 10 20 IECD C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 771768803 KZNJRRDFIXSCPE-WMZHIEFXSA-N 429.609 2.394 10 20 IECD CCOC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1C 774115570 AEYSXVSAGPZGMW-KRWDZBQOSA-N 429.473 2.054 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1O 774878546 SPVGVJJECMKDAU-OAHLLOKOSA-N 439.465 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCn3c(C)nc4ccccc43)CC2)cc1 778219460 FMROPLMBPBRBML-QXMHVHEDSA-N 447.539 2.375 10 20 IECD COC[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCOCC1 783221081 GBAZXCKUWCTCAL-OAQYLSRUSA-N 429.540 2.474 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1 785427689 GLLZCTWGUBANQX-INIZCTEOSA-N 432.471 2.365 10 20 IECD C[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCc2ccccc21 788137240 BUPUHJCTTPOFKD-KRWDZBQOSA-N 441.503 2.273 10 20 IECD CCCCN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789823146 ZBZFZFWIEIQVFW-QZTJIDSGSA-N 448.583 2.436 10 20 IECD CCOC(=O)C1(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCC1 791833833 MQUVMYIHGOIZLY-ZHACJKMWSA-N 443.544 2.140 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](c4ccccc4)C3)cc2)C1 793734205 RIVANFZODIPDDO-SFTDATJTSA-N 434.540 2.021 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 793863821 OYJYWELBPHZZSR-SFHVURJKSA-N 441.528 2.294 10 20 IECD COc1ccccc1CCNC(=O)CNC(=O)NCc1ccc(N2CCSCC2)cc1 798057834 WKBMMJJNFZROTR-UHFFFAOYSA-N 442.585 2.407 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)N1CCCC1 798368630 SOIUTSXKJYHNOI-AWEZNQCLSA-N 428.455 2.352 10 20 IECD Cc1cc(-c2nnc(N3CCC[C@@H](NS(C)(=O)=O)C3)n2C)c(C)n1-c1ccccc1 800742291 FPMLQXQIDCXCCA-QGZVFWFLSA-N 428.562 2.408 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCC1CCN(C)CC1 803378744 WIIKAJDEWWWRBL-UHFFFAOYSA-N 426.355 2.351 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(-n2cc(Cl)cn2)n1 803662939 OMPXYWPJZLRVCH-UHFFFAOYSA-N 444.898 2.367 10 20 IECD CC[C@@H](C)[C@@H](C)N(C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CC1 803750376 LWLPIXGBSJMGGR-RTBURBONSA-N 430.593 2.359 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C[C@@]2(CCOC2)O1 805026732 YRCZVASAPJGZIC-XUZZJYLKSA-N 429.561 2.336 10 20 IECD CNC(=O)CCOc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807513413 NFLBAFWZAHLOOR-UHFFFAOYSA-N 440.283 2.469 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 807672103 WMGDYHDPWRRFIS-MRXNPFEDSA-N 426.492 2.054 10 20 IECD CC(C)NC(=O)CN(C)Cc1c(O)ccc2ccc(O)c(CN(C)CC(=O)NC(C)C)c12 914781969 RHXZUOYAMQTPFP-UHFFFAOYSA-N 444.576 2.164 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)nc(O)c4ccccc43)cc2F)C[C@@H](C)O1 918141626 WTEGDBGLGQHRAY-GASCZTMLSA-N 440.475 2.171 10 20 IECD COc1cccc(CC(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)c1 1319948291 QKDCVXULMQKRIS-UHFFFAOYSA-N 440.563 2.473 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3cccnc3)cc2)CC1 1324997981 HFNROAHBACCQCN-XMMPIXPASA-N 435.572 2.421 10 20 IECD CC(C)n1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817845175 DONZQHZLXOGBFK-CQSZACIVSA-N 440.464 2.008 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)C3CC3)CC2)CC1 1838111737 LEMHCHFGWFJMKX-UHFFFAOYSA-N 438.528 2.188 10 20 IECD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 71956712 RBABZZUAVXDPFS-SFHVURJKSA-N 441.551 2.153 10 20 IECD CNc1cc(-n2nc(C)cc2NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)ncn1 439308418 VGXRFWFSIMYEFY-UHFFFAOYSA-N 433.497 2.481 10 20 IECD C[C@H]1CN(C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 729597908 UEWLXJZFNVILRU-NSHGMRRFSA-N 434.556 2.446 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nc(CCC(C)C)no3)CC2)cc1 729873949 XWTOOYIIMGLGDK-PMERELPUSA-N 434.562 2.264 10 20 IECD COC(=O)NCCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733542484 HDQPDROEHCIXJL-ZDUSSCGKSA-N 438.436 2.468 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccc(CNS(C)(=O)=O)cc3)CC2)cc1 735576572 DLRYNFUXOCRURI-UHFFFAOYSA-N 432.546 2.489 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1 737184729 VWWXBNZKRAJOAQ-LBPRGKRZSA-N 443.481 2.412 10 20 IECD CN(CC(=O)N1CCN(Cc2cccs2)CC1)Cc1ccc(N2CCOCC2)cc1 741736125 NRYBJCSAXQIPRK-UHFFFAOYSA-N 428.602 2.361 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1F 742802382 XOJWTEKLBOFUFV-ZDUSSCGKSA-N 443.447 2.473 10 20 IECD CCCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 747980046 PQCMDLVZNSPXCT-UXHICEINSA-N 443.592 2.226 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)CN4CCOCC4)CC3)c2C)c1 749338900 URZWGZWYGQDIRY-UHFFFAOYSA-N 438.572 2.328 10 20 IECD CC(C)(C)C(=O)NCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060031 FZOPNPSTPCVKGK-UHFFFAOYSA-N 425.532 2.147 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc([S@@](C)=O)cc3)CC2)cc1 754050942 NMNHLIYJIJSRRP-IIMAJNMQSA-N 431.602 2.048 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3nc(-c4ccccc4F)ccc3=O)CC2)cc1 758221275 WYZFQWWZQQLVMK-LJQANCHMSA-N 438.503 2.241 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(F)c3C(N)=O)cc2F)C[C@H](C)O1 758911438 INKUTXKMOVTSJF-KBPBESRZSA-N 433.455 2.373 10 20 IECD COc1cc(N2CCN(CN3C[C@@H](c4cccnc4)CC3=O)CC2)cc(OC)c1OC 758962684 AAKZBCPYCLVOEB-SFHVURJKSA-N 426.517 2.203 10 20 IECD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(Cc2ccc(N(C)C)cc2)CC1 768870658 BZPZYZZVNJQKAL-UHFFFAOYSA-N 435.546 2.256 10 20 IECD Cc1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C(=O)N(C)C 772908603 GFLUYKMHUXIGBL-UHFFFAOYSA-N 428.508 2.401 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2 773739866 GCVLYSVIOLGDBD-AWEZNQCLSA-N 435.498 2.170 10 20 IECD COC(=O)[C@@H]1C[C@H](OC)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778236378 ZPRQBIBLXJCMJR-KUHUBIRLSA-N 436.464 2.053 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCCN1CCN(C)CC1 778952368 BBJHGGBBGSKJTF-GOSISDBHSA-N 448.567 2.358 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781046947 JKORZDHFOAVSLC-UHFFFAOYSA-N 444.557 2.047 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 785563131 ZATAYFVQUYBNQR-HSZRJFAPSA-N 438.572 2.175 10 20 IECD Cc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 788415166 ZEDZBXYZCRYMID-KRWDZBQOSA-N 443.519 2.295 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCN(CC2CCCCC2)CC1 789812862 PGDXHNQTNFZNFS-UHFFFAOYSA-N 446.567 2.003 10 20 IECD CCCCN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789823148 ZBZFZFWIEIQVFW-ROUUACIJSA-N 448.583 2.436 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCc2nnc3n2CCCC3)cc1 793584865 UKPLLTBRTNEFFZ-UHFFFAOYSA-N 436.516 2.119 10 20 IECD CC(C)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793734210 RJOOYOVQRJZSIP-NRFANRHFSA-N 436.556 2.444 10 20 IECD Cc1nc(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1C 795248582 GTGFWQZNJIIYCJ-KRWDZBQOSA-N 437.566 2.339 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803298628 VUPFLZSRAVHXBP-OXJNMPFZSA-N 429.517 2.360 10 20 IECD C[C@H](NC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 803299399 KLFFOHQSQOYWHC-IBGZPJMESA-N 447.539 2.245 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1F 803662147 SDIIWJBFNHRLGK-QHCPKHFHSA-N 448.539 2.367 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(C(=O)NCc2ccccc2)CC1 807099104 JZFLEIAZWVYWPW-UHFFFAOYSA-N 436.556 2.232 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC(C)(C)O1 807768995 CTNQNRASYUDJME-CABCVRRESA-N 425.476 2.399 10 20 IECD COCc1cc(Cl)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 811670884 HKGTUTGTOLPXSG-UHFFFAOYSA-N 448.906 2.357 10 20 IECD Cc1cc(C(=O)CN2CC[C@@]3(CCCN(C)C3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815145522 XKSRDXLYEBNGJL-HSZRJFAPSA-N 444.601 2.342 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(Cc4ccco4)CC3)cc2F)C[C@H](C)O1 917020178 DNAXPEFSUZRGQQ-OALUTQOASA-N 444.551 2.466 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1OC 917759135 ICADBSGGRZAXPM-UHFFFAOYSA-N 430.504 2.275 10 20 IECD CN(CCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CC(F)(F)F 918117005 FCEAAVFKPNZPLD-MRXNPFEDSA-N 429.487 2.072 10 20 IECD CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918444060 JOFQRZJJCUNEGU-UHFFFAOYSA-N 426.517 2.061 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc4c(c(C(=O)O)c3)OCCO4)CC2)cc1 919728665 UGPJRCRJCZZQDP-UHFFFAOYSA-N 448.497 2.066 10 20 IECD COc1ccc([C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)cc1 919805380 SCZXQPLIQSRVLR-LJQANCHMSA-N 433.530 2.339 10 20 IECD CN1CCN(c2ccc(CN3CCC(Oc4ccnc(C(N)=O)c4)CC3)cc2F)CC1 1325732550 AMPFKYZYPXNHHX-UHFFFAOYSA-N 427.524 2.115 10 20 IECD COCn1ncc(C)c1CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1347441045 DZZMWMNRCKUWKN-UHFFFAOYSA-N 425.512 2.341 10 20 IECD Cc1noc(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004364 VUPDYDOMGGDDDB-NRFANRHFSA-N 449.891 2.042 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(Br)cn1 1796601035 WNWPDWLYLLYECE-BTTYYORXSA-N 447.289 2.216 10 20 IECD C[C@@H](Nc1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798463818 WZJMTBRWVOMKST-REBRKWNGSA-N 445.907 2.294 10 20 IECD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1ccccn1 1816728488 QMEISJLWTMKGPP-WCQYABFASA-N 439.497 2.374 10 20 IECD Cc1cc(Br)cnc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249702 NFNPLQSVSZWXMP-UHFFFAOYSA-N 447.289 2.090 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 726726959 YCBZVOKJMBUSNL-UHFFFAOYSA-N 434.500 2.308 10 20 IECD CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 730671555 CAXSVLWYUYLKQA-FQEVSTJZSA-N 438.576 2.057 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCC[C@@H](O)C3)c2C)c1 737817277 ZZSXCEKVNMUOSO-LJQANCHMSA-N 428.485 2.307 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccccc1CN1CCOCC1 746162469 ITUQLEYWHRMDEA-UHFFFAOYSA-N 429.542 2.006 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 749639444 KWHWHLDFITVHNX-UHFFFAOYSA-N 444.557 2.012 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc21 751238795 DARONADAXNCFAS-UHFFFAOYSA-N 443.569 2.283 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@]4(CCc5ccccc54)C3)CC2)cc1 754071350 PXXVEVWZNOGTKT-JYFHCDHNSA-N 437.584 2.352 10 20 IECD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)COC(=O)c1cccc(O)c1O 758581271 LZUXXGZPJPINQO-UHFFFAOYSA-N 448.497 2.376 10 20 IECD COc1cc(N2CCN(C(=O)NCCC(=O)NC3CCCCC3)CC2)cc(OC)c1OC 759241894 JSXRGVVIFWTXCQ-UHFFFAOYSA-N 448.564 2.383 10 20 IECD COc1cc(N2CCN(C(=O)NCCCOC3CCOCC3)CC2)cc(OC)c1OC 760124214 YIBWTWXBVVACRB-UHFFFAOYSA-N 437.537 2.130 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nn(C)c4ccccc34)CC2)cc1 760144588 WZNFUYSBPDRLIO-QXMHVHEDSA-N 433.512 2.103 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3noc4ccccc34)CC2)cc1 760534729 XWUHKBJGKJVUQM-UHFFFAOYSA-N 444.557 2.468 10 20 IECD CN1CCN(c2cc(CN3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)ccn2)CC1 761001223 ASDCGWAAGJEUKH-UHFFFAOYSA-N 429.908 2.157 10 20 IECD COCCOc1cccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 772069591 GHNDJTQUVJKTFO-HXUWFJFHSA-N 425.529 2.272 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 774857521 KEJPQAPKCOFTQM-QGZVFWFLSA-N 438.519 2.362 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCc2ccccc2C1 775122977 SCHMLLABQJNTFX-IBGZPJMESA-N 425.504 2.077 10 20 IECD C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)CC(=O)N2C 775352517 QBSLOFNAFNRDAX-MRXNPFEDSA-N 440.519 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(CN(C)C(C)C)CC3)CC2)cc1 778244471 DZCQUQMLJYPCFS-MDZDMXLPSA-N 442.604 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc([N+](=O)[O-])ccc3O)CC2)cc1 778403675 KWFSFWQPMAPELM-HJWRWDBZSA-N 426.429 2.153 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C)c(C)c(C(=O)O)c3)c2)CC1 780409640 YHFRDEVDACVSCR-UHFFFAOYSA-N 431.514 2.471 10 20 IECD CCOc1cc(/C=C/C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1O 780896120 CURDQXQWVHGSDJ-UXBLZVDNSA-N 430.526 2.355 10 20 IECD COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781440153 BJOOIWRDCNBNBF-UHFFFAOYSA-N 449.866 2.357 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 786290409 HZOAPUUZXHRCQD-MRXNPFEDSA-N 434.500 2.135 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@@H]2CCC[C@H]2[C@H]1C(N)=O 787333445 ZTCQOWWUDJMSKK-RPNZERQGSA-N 431.492 2.375 10 20 IECD CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1nncn1C 796187738 RGQICAGWNIYZJG-VWKPWSFCSA-N 432.544 2.171 10 20 IECD CCN1CCN(C(=O)Cc2ccc(NC(=O)NCc3ccc(OC)cc3O)cc2)CC1 797633195 GPMFZKQQNDDXLV-UHFFFAOYSA-N 426.517 2.429 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCN3CCN(C)C(C)(C)C3)cc2F)C[C@@H](C)O1 799364898 PZFCEWJIFJAGKR-QZTJIDSGSA-N 435.588 2.265 10 20 IECD Cc1ccc(CN(CCO)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 803301123 ZEWHRANMHLRQPX-LJQANCHMSA-N 425.529 2.030 10 20 IECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803309529 ZFWOORXHUDLVLS-VQTJNVASSA-N 430.593 2.185 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCc3ccccc3F)cc2F)CC1 805007318 QNCITTIXONJWFZ-UHFFFAOYSA-N 444.526 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCC(=O)OC(C)(C)C)n3)CC2)cc1 809464498 GMOXYBRJSINWNI-UHFFFAOYSA-N 430.505 2.244 10 20 IECD COc1ccc(N2CCCN(C(=O)CNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 810181691 REWVBWBZPOKTNX-UHFFFAOYSA-N 437.949 2.366 10 20 IECD CN1CCN(c2ccc(CNC(=O)NCc3ccc(N4CCSCC4)cc3)cn2)CC1 916245136 ACRKNZYRCVUVEQ-UHFFFAOYSA-N 440.617 2.386 10 20 IECD CNC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918097602 KOPOFNOGQWSEPY-UHFFFAOYSA-N 440.544 2.020 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1 918304409 PZJIWQNCDASHOX-UHFFFAOYSA-N 438.528 2.212 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cccc1[N+](=O)[O-] 918442950 YUTADQKRQZZXLT-UHFFFAOYSA-N 426.473 2.367 10 20 IECD Cc1c(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nnn1-c1ccccc1 920004615 WJMYIKCUSWUEPT-IBGZPJMESA-N 432.528 2.136 10 20 IECD COc1cc(N2CCN(C(=O)CCc3nc4cccnc4[nH]3)CC2)cc(OC)c1OC 1116579717 WRIDHDOAKWDVRT-UHFFFAOYSA-N 425.489 2.265 10 20 IECD O=C(COCc1ccncc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1117387213 CVLBOMGPEXZSFP-UHFFFAOYSA-N 436.491 2.170 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 1324121774 VJVRWATWRBRKBS-QAPCUYQASA-N 444.459 2.189 10 20 IECD CC(C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243092 QVFVGFBSCQYCNX-JDFRZJQESA-N 440.924 2.160 10 20 IECD CCC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)n1cccc1 1804333721 PRRJYLQUNQPBII-YYIAUSFCSA-N 448.614 2.328 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)C23CC(C2)C3)[nH]n1 1823501919 XNFGAPQQBFLGGS-FPGGMFCHSA-N 433.559 2.062 10 20 IECD O=C(c1ccnc2ncccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039431 ODDZUHOKNQWCRV-FNORWQNLSA-N 446.463 2.277 10 20 IECD FC(F)Oc1ccc(N2CCC(NC(=S)NCCCN3CCOCC3)CC2)cc1 726493502 JDSJYSBUOBXAHP-UHFFFAOYSA-N 428.549 2.443 10 20 IECD O=C(COC(=O)c1cc2c(s1)CCOC2)NCc1ccc(N2CCOCC2)c(F)c1 728644598 OQIMBPWOZRDTTF-UHFFFAOYSA-N 434.489 2.270 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 742499215 XVBGWMMFFHSSAR-UGESXGAOSA-N 425.529 2.188 10 20 IECD CS(=O)(=O)Cc1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 749195035 TYGVNVIPNLGGQJ-UHFFFAOYSA-N 449.548 2.331 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c(C)n1-c1cccc(Br)c1 749252192 FSJIWDMKVQJELN-INIZCTEOSA-N 431.290 2.233 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 749738923 QMJHDCNLRPBXDP-UHFFFAOYSA-N 428.558 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC(C)C)cc3)CC2)cc1F 753740921 YWGVQPRFQCMXTP-UHFFFAOYSA-N 435.521 2.483 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 758968549 HZFCVRCZSMTDEA-UHFFFAOYSA-N 430.468 2.420 10 20 IECD COc1ccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1O 760094232 GXMLRMSHVZYOTC-UHFFFAOYSA-N 431.489 2.458 10 20 IECD COC(=O)COc1ccc([C@@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 767874235 FQQGRXKOJMFYIT-GOSISDBHSA-N 441.528 2.246 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(CC(N)=O)c3)cc2F)C[C@@H](C)O1 768516969 IXRDLLCRZFJBBV-IYBDPMFKSA-N 429.492 2.162 10 20 IECD COc1ccc(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)N(C)C 775836368 MQCLSPDGMUUXAW-HNNXBMFYSA-N 434.562 2.301 10 20 IECD O=S(=O)(Nc1cccnc1)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 776308731 UMJVDUPDDCCJPN-UHFFFAOYSA-N 431.455 2.219 10 20 IECD O=C(NC[C@H]1COC2(CCOCC2)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 776941680 XWUWBBKPPQCVCA-SFHVURJKSA-N 441.475 2.478 10 20 IECD Cc1cc(C(=O)NCC2CN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1Br 779334510 MFXMOUNSGWDLIA-UHFFFAOYSA-N 440.363 2.478 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 781502843 GKULKHNRALPRBN-NSHDSACASA-N 432.429 2.021 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1)C1=S=CC=C1 781838527 CSMLVHDUZUWBOT-UHFFFAOYSA-N 449.441 2.069 10 20 IECD Cc1nc2ccccc2n1CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 785498661 ZOTGEIGHFAQQRQ-KRWDZBQOSA-N 435.528 2.175 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 786275698 BUSFFIROXZPYDZ-UHFFFAOYSA-N 426.429 2.063 10 20 IECD CC(C)CN1C[C@@H]2CN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CCN2C1=O 787066220 UDOHAZOWJPTDNH-NQIIRXRSSA-N 429.565 2.372 10 20 IECD C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313084 PPNCMJGUAZBFAS-OALUTQOASA-N 430.593 2.012 10 20 IECD COC(=O)c1cnc(SCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[nH]1 788506821 XYLWWBKVSSNWOC-CHWSQXEVSA-N 436.509 2.358 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cnc[nH]4)CC3)cc2F)C[C@@H](C)O1 789817147 GBECYPMBDFGJFN-IYBDPMFKSA-N 443.523 2.185 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCN(C)C)CC3)cc2F)C[C@@H](C)O1 789817210 GXKLVXRIMLPDAH-HDICACEKSA-N 448.583 2.246 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@]2(CCOC2)O1 794307745 DNFWVJTWJHPWKK-ORAYPTAESA-N 438.527 2.275 10 20 IECD NS(=O)(=O)Cc1cccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 800718161 BPZSZBDMRVMCCR-IBGZPJMESA-N 433.530 2.072 10 20 IECD CCCCN(CC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801598017 SKRLGVWDPGBMCL-SFHVURJKSA-N 434.562 2.498 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CC)c(S(N)(=O)=O)c1 802610097 UIXPCPHGYDUOAT-UHFFFAOYSA-N 433.530 2.369 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 803300488 SWNUPOZVCSLRNI-QGZVFWFLSA-N 439.512 2.130 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1Oc1ccccc1 807289204 LTUAPRGWTAOQAR-DNVJHFABSA-N 435.524 2.420 10 20 IECD COc1ccc(N2CCCN(C(=O)CNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 810181522 OOFOQNDRQNSRHJ-UHFFFAOYSA-N 431.558 2.329 10 20 IECD CCCNC(=O)[C@H]1CN(S(=O)(=O)c2ccc(Cl)c3nonc23)c2ccccc2O1 814377653 ALRORFLVPDDJSN-CQSZACIVSA-N 436.877 2.359 10 20 IECD CSc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918463634 LYHJAHRYRIFNOX-MRXNPFEDSA-N 426.542 2.365 10 20 IECD O=C(COC(=O)c1ccc2c(c1)OCCCO2)NCc1ccc(N2CCOCC2)c(F)c1 918897228 WAELGXGBGBLHPP-UHFFFAOYSA-N 444.459 2.297 10 20 IECD COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 931283147 RLDODQAWKGAHMB-OAHLLOKOSA-N 442.472 2.221 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C(=O)OC)CC2)cc1 1343416263 ZZPSVZDUOAXDRA-UHFFFAOYSA-N 449.485 2.291 10 20 IECD O=C(C[C@@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004004 RGHBCJSIQHGDHC-YCRPNKLZSA-N 438.908 2.154 10 20 IECD Cc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1785510327 VYAORFKHBKXDBA-YFTVHVBSSA-N 438.480 2.269 10 20 IECD Cn1ccc(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)n1 1787416637 NEHFPRKZWUCJDN-UHFFFAOYSA-N 443.554 2.028 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ccccc3c1)C2)c1cc(O)nc(O)c1 1796137398 LIPMMCBAPZHJFI-IRJINJETSA-N 447.491 2.092 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cccc2ccccc12 1796781574 RVPCSBCCADNIQZ-FAQVEIGNSA-N 433.464 2.163 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1807993982 BLEULKJOBSXRBM-BEFAXECRSA-N 437.456 2.126 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550538 NOQIGXIWRKFHQU-HNNXBMFYSA-N 427.505 2.104 10 20 IECD CC(C)CCC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812603838 GTHNYRNAYSSOBN-OXJNMPFZSA-N 448.614 2.384 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCSC1)CC2)c1cc(O)nc(O)c1 1816729243 YGDXBMQFWAAPCD-PWSUYJOCSA-N 434.543 2.318 10 20 IECD CCN(CC)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821673925 OQZVNCKMSNYPIQ-RHSMWYFYSA-N 444.536 2.500 10 20 IECD CC[C@H](C)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1831054245 SDXLPGQZPAJQGR-LHSJRXKWSA-N 440.924 2.257 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CSc2ccncc2)C1 1841965864 FEACNFUAURYIPZ-HWKANZROSA-N 441.509 2.207 10 20 IECD O=C(c1cc(Br)ccc1O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250337 MICILUKYCPMZQM-UHFFFAOYSA-N 448.273 2.092 10 20 IECD COc1cccc(CC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843441725 BEGOSMBFPCEMFZ-UHFFFAOYSA-N 446.507 2.234 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3c(c2)COC3)C1 1843755619 DXOYRKHQYPSXRS-FNORWQNLSA-N 436.464 2.364 10 20 IECD CC[C@@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847055767 MXHBFVFQSRHPGV-MRXNPFEDSA-N 431.583 2.244 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@H](CCS(C)(=O)=O)C3=O)c2C)cc1F 16573930 SQHOTCGZISLPLB-SFHVURJKSA-N 449.504 2.079 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2ccc3c(c2)OCCO3)CC1 727238846 CGDMRCBCAROEOB-UHFFFAOYSA-N 438.572 2.300 10 20 IECD O=C(NCCS(=O)(=O)N1CCSCC1)N(Cc1ccco1)Cc1ccccc1O 730673372 RRHCISYFUCQBLK-UHFFFAOYSA-N 439.559 2.076 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 734686457 ODLQPBLQDXXVOF-UHFFFAOYSA-N 441.557 2.037 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3ccn(CC(=O)NC)c3c2)cc1 743891175 MGFYECWRRRQTAQ-UHFFFAOYSA-N 435.528 2.488 10 20 IECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C 746738718 JWMJYRWRVMTZPD-UHFFFAOYSA-N 431.514 2.338 10 20 IECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751120471 IFMFFSPNLSOLFM-IBGZPJMESA-N 448.541 2.407 10 20 IECD COC(=O)c1coc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)c1 753918606 MGYFEOURUVIECI-UHFFFAOYSA-N 425.444 2.220 10 20 IECD COCCOc1ccc(F)cc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754212988 HSIMXECGDOCFAL-UHFFFAOYSA-N 449.454 2.286 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)c3O)cc2F)C[C@@H](C)O1 758559381 HUKJEVNWDKFXNI-OKILXGFUSA-N 432.448 2.324 10 20 IECD COc1cc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccc1O 760096902 QLLGLQQKTVNXCD-UHFFFAOYSA-N 431.489 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3(CN(C)C)CCCC3)CC2)cc1 760138540 YSZUZKPCMPPXGB-ZHACJKMWSA-N 428.577 2.138 10 20 IECD COC(=O)[C@@H]1CCC[C@@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771059009 XCYDCPFVRCTPBK-IAGOWNOFSA-N 442.516 2.416 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC=C(c3ccc4c(c3)OCCO4)CC2)c1 771332926 WGMCPGCMRTVZCZ-UHFFFAOYSA-N 430.482 2.464 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3ccc(Cl)cc3)CC2)cc(OC)c1OC 774436479 PYANGJVQWMCMOZ-UHFFFAOYSA-N 447.919 2.331 10 20 IECD C[C@H](NC(=O)N1CCOC[C@@H]1c1noc(-c2cnn(C)c2)n1)c1ccc(N(C)C)cc1 776237222 FSKNHFIOZSZNOQ-KBXCAEBGSA-N 425.493 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3CCN(C4CCCC4)CC3)CC2)cc1 778305143 LWHFVQKLCJXZIM-ZHACJKMWSA-N 440.588 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4c(cccc4OC)C3)CC2)cc1 782845550 IKLSWYICFXOOJE-ZHACJKMWSA-N 435.524 2.494 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccccc2CN2CCOCC2)cc1 785444248 QMMBHSYTDDOPDB-UHFFFAOYSA-N 438.572 2.298 10 20 IECD CCc1cc(N2CCC(NC(=O)C(=O)NCc3ccc(N(CC)CC)cc3)CC2)ncn1 788955346 QAJODSADMGXMLS-UHFFFAOYSA-N 438.576 2.287 10 20 IECD CC[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837225 WWEASJAQJMMAEV-FQEVSTJZSA-N 428.508 2.408 10 20 IECD C[C@H](c1ccccc1F)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734595 UWMCNLAMFMTEFQ-SJLPKXTDSA-N 440.519 2.363 10 20 IECD CC[C@@H](c1nnc(Sc2ncc([N+](=O)[O-])s2)n1CCN1CCOCC1)N(C)C 799927431 ABDLPQICAZAEEG-LBPRGKRZSA-N 427.556 2.139 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3cc(C)ccc3F)CC2)cc1 803747097 LNFKXUCWOBOPSL-UHFFFAOYSA-N 442.535 2.040 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3CCCN(CC(C)C)C3)CC2)cc1 804318700 RETDZSLJEKHPGL-IBGZPJMESA-N 430.593 2.264 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1F 804853429 XSEGJMHRAJOKNS-CTNGQTDRSA-N 434.556 2.048 10 20 IECD CN(C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 804956495 PPCCHVNEAKQQTA-UHFFFAOYSA-N 444.479 2.482 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H]3c3ncc[nH]3)cc2F)CC1 805010193 XAEFNSBQLJKJGV-HXUWFJFHSA-N 442.539 2.061 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCOc4cc(OC)ccc43)CC2)cc1 806791003 VPTXTCHCOLGJGQ-NRFANRHFSA-N 439.512 2.383 10 20 IECD COCc1cnc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 806844151 UOSODENYLKCUGV-CHWSQXEVSA-N 436.509 2.297 10 20 IECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807953891 ARERSJIECUXUBE-KYJSFNMBSA-N 434.968 2.223 10 20 IECD COCc1nc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cs1 811950564 HSKGAUJJEBHRRY-UHFFFAOYSA-N 433.578 2.310 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)N4CCC[C@H](C)C4)CC3)nc12 917105229 DFGLEKPWYSNDTK-HNNXBMFYSA-N 429.521 2.082 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cc(Br)cn3)cc2)C1 917837219 VMHHTYZEPSQZPZ-OAHLLOKOSA-N 434.338 2.054 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3cccc(NS(C)(=O)=O)c3)CC2)cc1 918004974 MHLWWUIUCJLSMO-UHFFFAOYSA-N 432.546 2.489 10 20 IECD CC1(C)Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2O1 918283084 BGMIGEOKQYGRGR-UHFFFAOYSA-N 429.448 2.425 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc([N+](=O)[O-])n3C)cc2F)C[C@@H](C)O1 919025756 PQERSKBLXPBBGR-ZIAGYGMSSA-N 448.451 2.159 10 20 IECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cccc1C(=O)N1CCOCC1 919796426 RNRBUSLZJINDOR-UHFFFAOYSA-N 438.528 2.131 10 20 IECD Cc1nc(COc2ccccc2C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)no1 919878095 HLBJOIDOBWYTGN-UHFFFAOYSA-N 442.497 2.444 10 20 IECD C[C@@H](NC(=O)c1ccc(CCNS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 920882195 VVPCPNCKEGGSCA-QGZVFWFLSA-N 431.558 2.106 10 20 IECD O=C(Nc1c(Cl)ccc2nonc12)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 1117548675 UIBLUYFSMNIVLQ-UHFFFAOYSA-N 440.840 2.289 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3c(I)cnn3C)CC2)cc1 1324309836 RNEOSYKLQIHFDY-UHFFFAOYSA-N 440.285 2.386 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cncnc3)cc2)CCC1 1787442631 KCFQDMKMDQFLRR-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cocn3)CCC2)cc1 1792314075 QBCJCZIYQAJBHW-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccn2nccc2c1 1804286365 RTLXPKOPVVNLQG-XBMZCVMLSA-N 448.479 2.416 10 20 IECD CNCCCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809772000 OMTOXNBKQKDXOA-SOFGYWHQSA-N 431.533 2.047 10 20 IECD Cc1cccc(CCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1841942222 WKJYQSCUZWWIDE-UHFFFAOYSA-N 445.523 2.319 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(F)nc1 1848171603 QEQPRXZOQVRGFA-ALOLOFKDSA-N 441.459 2.185 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc1 195566244 PEPGXVHBCJOOOK-UHFFFAOYSA-N 446.498 2.032 10 20 IECD CS(=O)(=O)Nc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 725887073 DOVGTXBZNYNODM-UHFFFAOYSA-N 439.484 2.227 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2C 728306764 CGWOFUWMYJRLRW-LPHOPBHVSA-N 449.555 2.468 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4C)CC2)cc1 729784696 OFPOOKREFTWWNU-UHFFFAOYSA-N 436.512 2.282 10 20 IECD C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733311256 QOSXANHFKDMNCS-UONOGXRCSA-N 428.510 2.154 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1C 737079962 VTNVVEWWGQZHTC-UHFFFAOYSA-N 432.546 2.468 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1 737134596 OHJHCADDDUZVDO-GOSISDBHSA-N 426.473 2.290 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOc2ccc(F)cc2)cc1OC 742027581 HSZREAALJBVELB-UHFFFAOYSA-N 432.495 2.417 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)c1 743906860 RSLMLQRWNSJDEX-LBPRGKRZSA-N 429.429 2.182 10 20 IECD Cc1cc(C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1-c1cccc(C(C)C)c1 747992597 TZUJTOFIBHBEFZ-UHFFFAOYSA-N 432.590 2.264 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCCCSc2nccs2)c1 749730969 HRSNTJHGVHRMDX-UHFFFAOYSA-N 435.560 2.078 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(NC(C)=O)c3)CC2)cc1F 754040776 XGHUUMQZFWUSLV-UHFFFAOYSA-N 437.493 2.312 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@H](C)Cn3ccnc3C)CC2)cc(OC)c1OC 760105286 CULSMGHOABDREH-INIZCTEOSA-N 431.537 2.385 10 20 IECD COC(=O)c1cn([C@H]2CCCN(C(=O)NCc3ccc(N4CCSCC4)cc3)C2)nn1 762567485 FSRGDLCOVRBMBQ-SFHVURJKSA-N 444.561 2.165 10 20 IECD C[C@H](NCc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1 765283187 RRZUJCOCZWVQSU-IBGZPJMESA-N 445.585 2.395 10 20 IECD COc1ccc(O)c(CNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c1 768997659 FLPYLAYOSZPLFC-UHFFFAOYSA-N 434.880 2.194 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCC3)cc2F)C[C@@H](C)O1 774865335 KNEOADPOZWPSGR-IAGOWNOFSA-N 434.556 2.046 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1 781505939 JBOCSWSJDJDJFF-CYBMUJFWSA-N 440.456 2.195 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn(C)c1=O 781969942 MQRRYLAJOFVYPX-CQSZACIVSA-N 434.443 2.019 10 20 IECD COCCOc1ccc(-n2nc(C)c(C(=O)OCC(=O)c3ccc(O)c(O)c3)n2)cc1 783708663 RFBOOUPJTSOCDT-UHFFFAOYSA-N 427.413 2.052 10 20 IECD COc1ccccc1[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1nccn1C 785626480 PLFAFQVJZAGGPM-INIZCTEOSA-N 445.570 2.389 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C(C)(C)N3C(=O)c4ccccc4C3=O)cc2)CC1 786657529 ZFOHGDNACLZHRR-UHFFFAOYSA-N 448.523 2.046 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ncnn3-c3ccccc3)CC2)cc1 786873900 XXRFNWRGISLNQU-UHFFFAOYSA-N 449.559 2.287 10 20 IECD CCC(=O)Nc1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 787084187 RCTOWWKSFBNVAQ-UHFFFAOYSA-N 438.528 2.147 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799018 LNVFCUURIPHUHS-UHFFFAOYSA-N 429.492 2.423 10 20 IECD C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793717137 HHSIQLGPVVOOSP-COPCDDAFSA-N 448.567 2.409 10 20 IECD C[C@@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCCCC1 793721309 ISSQOFCMOAEKFO-INIZCTEOSA-N 438.519 2.364 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 802610446 ADCIEYWXECSOMT-SFHVURJKSA-N 437.496 2.365 10 20 IECD C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803305781 OXXJBGJGRHNPGT-JGOTUQMDSA-N 443.588 2.489 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(C)C[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803308709 IRIRRZZJPAJKSY-CVDCTZTESA-N 436.556 2.216 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1F 803661600 HHCDMUZPPDRZME-HZPDHXFCSA-N 436.528 2.460 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](c3nncn3C)C(C)C)CC2)cc1 805767583 XZPZMGRFRAUVDD-HXUWFJFHSA-N 429.569 2.032 10 20 IECD CN(C)S(=O)(=O)C[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 805768908 HIFYLSBPQWNBGQ-JTQLQIEISA-N 438.255 2.321 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cn1 807385292 HOSRZFGHNZGPAM-UHFFFAOYSA-N 430.262 2.299 10 20 IECD CN1CCN(c2ccc(CN3CCC(C(=O)NCCCN4CCCC4)CC3)cc2)CC1 809732155 DYDVUVDQNLGXGH-UHFFFAOYSA-N 427.637 2.253 10 20 IECD CCOC(=O)N1CCC[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 912901747 PRKNZOQIGRUHMN-LJQANCHMSA-N 432.565 2.192 10 20 IECD COc1ccc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)cc1OC 916175441 UWHFSOHIOWQSDL-UHFFFAOYSA-N 446.506 2.039 10 20 IECD CNC(=O)COc1cccc(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918019423 SOLKHHUOTWROFG-UHFFFAOYSA-N 426.517 2.242 10 20 IECD O=C(CCCn1cccc1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784567803 ZJPLRLWLNBAQKT-JOCHJYFZSA-N 447.919 2.477 10 20 IECD COC(=O)CSCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425175 FDZYNWPRVLSSRI-UHFFFAOYSA-N 445.497 2.147 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@@H]3CCOC3)cc2)CCC1 1791977640 JCBVLPRZJFKDLS-CYBMUJFWSA-N 433.555 2.017 10 20 IECD O=C(C[C@@H]1CCCCO1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804099516 OJKYXRCDQRYLID-NRJQMVOHSA-N 440.500 2.167 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H]2CCN(C(=O)C(O)O)[C@H]2c2cccnc2)cc1 1811262495 PSUPKLPTUGLEHY-IRLDBZIGSA-N 448.523 2.119 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc([N+](=O)[O-])o1 1814308902 RROBJXUFHUWKBW-GFCCVEGCSA-N 442.388 2.337 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3nccc23)[nH]n1)c1cc(O)nc(O)c1 1817847351 WTTAAUATJOHNLA-KRWDZBQOSA-N 447.455 2.483 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427110 PNWDJJNPQWSYJO-LPHOPBHVSA-N 441.532 2.259 10 20 IECD O=C1C[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1830740031 GKPSFERPYHFRRQ-DOTOQJQBSA-N 449.935 2.121 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 435016730 QHMFQDHJAAODLL-MRXNPFEDSA-N 439.497 2.065 10 20 IECD CN(C)S(=O)(=O)c1ccsc1C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 599542502 ONOZNNQPYLQKEF-UHFFFAOYSA-N 435.552 2.467 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726726081 NHNJUKXKOYKUIY-UHFFFAOYSA-N 438.528 2.477 10 20 IECD NS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 729360514 SJVOGDXIAPVIAE-UHFFFAOYSA-N 431.486 2.396 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)OCCN(C)S(=O)(=O)N3CCOCC3)c2C)c1 731294422 JHGNFZZTYPBWCZ-UHFFFAOYSA-N 435.546 2.068 10 20 IECD C[C@H](CNC(=O)OC(C)(C)C)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 732208037 RHZDTDLXZDOCSP-MRXNPFEDSA-N 438.544 2.124 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1 734073844 XNDXMWZTMDFDAV-HOTGVXAUSA-N 427.501 2.265 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1-n1cnnn1 743904995 GZORXTMGMYAGSP-UHFFFAOYSA-N 449.515 2.162 10 20 IECD C[C@@H](CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCN(C)CC1 745799934 MXNRWRCOBMIYMP-KRWDZBQOSA-N 439.551 2.440 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(C(C)(C)CO)CC3)c2C)cc1 747840904 RZJZNRQABFFZGS-UHFFFAOYSA-N 427.545 2.452 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)cc(C)c3C)cc2F)CC1 751916857 HFCMGKLNJNSGDS-UHFFFAOYSA-N 448.564 2.162 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C 753638181 PXLVBCNBWPMCAD-QFIPXVFZSA-N 425.577 2.149 10 20 IECD CN1CCN(CC2(C)CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 758380065 FJIXEQOODQHPHY-UHFFFAOYSA-N 447.599 2.221 10 20 IECD COc1ccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1F 759410118 PJXRKDGJUKDBMZ-UHFFFAOYSA-N 447.463 2.147 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc4[nH]ccc34)CC2)cc(OC)c1OC 759410121 PLBSOEBJEBUVNV-UHFFFAOYSA-N 438.484 2.481 10 20 IECD Cc1ccn(-c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 759498528 PNJGYGRHZOSRHH-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c1 760918061 JTBOUSQBWMZSAR-RHSMWYFYSA-N 435.521 2.484 10 20 IECD CC(C)(C)S(=O)(=O)N1CCC(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 762411378 ZDVRZWNOHMVKLW-UHFFFAOYSA-N 443.953 2.403 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cccc(OC)c3O)CC2)cc1 768161759 ZOLZYXLOCJAXKU-UHFFFAOYSA-N 434.514 2.084 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(C(F)(F)F)c1 774357241 PWPGYYDBBRXNKM-UHFFFAOYSA-N 425.363 2.372 10 20 IECD Cc1noc(C2(C)CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 781351226 VLZXNEPYIZWLOI-UHFFFAOYSA-N 431.512 2.024 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 782107683 SSDIXRDDYIPYDV-AWEZNQCLSA-N 431.514 2.496 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)CCN3C[C@H](C)O[C@H](C)C3)cc2F)CC1 788982698 UNTXYXVIBDYHSV-KDURUIRLSA-N 435.588 2.218 10 20 IECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799653 OCDIZHAYYKXDDF-IBGZPJMESA-N 434.556 2.049 10 20 IECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789825280 LHAWEPCWMXYNMU-XWSJACJDSA-N 448.583 2.292 10 20 IECD O=C(CN1CCN(C(=O)c2cccc(O)c2O)CC1)Nc1ccc(Br)cc1 790891528 NYYBGPNLBYESKS-UHFFFAOYSA-N 434.290 2.257 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H](C)S1=O 791178664 VVAHXYBFFVXLMM-RYUDHWBXSA-N 428.557 2.236 10 20 IECD COc1c(C)cnc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 803296566 DXOYZJYPAZRSPF-KRWDZBQOSA-N 426.517 2.037 10 20 IECD CC(C)C(=O)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803676942 XBCVDCCUMPBGTB-UHFFFAOYSA-N 428.577 2.399 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290003 AZAWGPKDIXMACF-NRFANRHFSA-N 447.583 2.006 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCC(=O)c5cccn54)n3)CC2)cc1 809464968 NVLVWZOFVTXUJM-LJQANCHMSA-N 435.484 2.337 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](CO)CC1 819239817 KPJQGFDBTVYNGA-AWEZNQCLSA-N 449.485 2.336 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)S(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 917714710 NYQCFCZRHLZBGT-CALCHBBNSA-N 449.548 2.376 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@H](C)O1 917998276 HTDPLUVPKMNTIW-KBPBESRZSA-N 436.509 2.408 10 20 IECD COc1ccc(C(=O)N2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)c(OC)c1 918000327 MEQHWPWQHAQHOU-UHFFFAOYSA-N 426.517 2.437 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccccc3CN3C(=O)CNC3=O)CC2)cc1 918039901 UCCPKNBITOTRRG-UHFFFAOYSA-N 437.500 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc4nc(O)nc(O)c4c3)cc2F)C[C@H](C)O1 918140366 LXEULZJSUKBOGN-RYUDHWBXSA-N 427.436 2.119 10 20 IECD Cc1cc(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 918567889 IAPOXLMRZWFPMH-MRXNPFEDSA-N 437.949 2.171 10 20 IECD Cc1nn2cccnc2c1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919697764 JRYXORXIZXBTRB-UHFFFAOYSA-N 446.490 2.223 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N2CCN(c3ccc(OCC)cc3)CC2)CC1 1341342563 OLUFEFWRGRJJQQ-UHFFFAOYSA-N 425.551 2.158 10 20 IECD CN(C)C(=O)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1520620244 LMNQVMIAARBZGI-CYBMUJFWSA-N 437.543 2.195 10 20 IECD CSCC[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429284 CKAPJLCIUDDQFE-MRXNPFEDSA-N 431.514 2.355 10 20 IECD Cc1ccc(O)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1798842548 LTEMQNCIIIZSHU-HBCWATKFSA-N 446.887 2.282 10 20 IECD O=C(COc1ccccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806467189 AABGEGSMHPFTHZ-SBUREZEXSA-N 448.479 2.286 10 20 IECD CCc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992104 UXSPZHQKVWTCHI-ZHRRBRCNSA-N 447.495 2.479 10 20 IECD CC(C)[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708415 YPQPSGHELYEGEI-BMIGLBTASA-N 439.921 2.450 10 20 IECD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)n1cccc1 1826590575 DZIXACPLFBKIHD-AAEUAGOBSA-N 427.486 2.238 10 20 IECD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846343521 LRSVQNNFEGEAKS-HUUCEWRRSA-N 448.903 2.324 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(c3cnccn3)CC2)c([N+](=O)[O-])c1Br 14320191 JLGNACVHLGDQQC-UHFFFAOYSA-N 439.226 2.391 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 19608145 QSZJETSCPWJSHW-INIZCTEOSA-N 447.509 2.416 10 20 IECD COc1ccc(-c2ccc(-c3nc4c(c(=O)[nH]3)=C3CCS(=O)(=O)CC3=S=4)cc2)cc1 463234030 QTBJTKWQFISFDR-UHFFFAOYSA-N 438.530 2.252 10 20 IECD CCOC(=O)N(C)C1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 726965495 CJAKOENWDDKTAE-UHFFFAOYSA-N 433.549 2.480 10 20 IECD COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 727230038 MCGJMCMQVDHXNY-GOSISDBHSA-N 449.454 2.242 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1 729062339 QLRTZEVRLSXPHS-MRXNPFEDSA-N 427.501 2.091 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1 729066611 NNDJLTNGQSLKHR-CYBMUJFWSA-N 427.457 2.352 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)N4CCC(C)CC4)CC3)nc12 734151424 HSKKCBWKGRFDFD-UHFFFAOYSA-N 429.521 2.082 10 20 IECD CC(C)(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 737245682 LYFNJGDAOMFDIU-UHFFFAOYSA-N 443.569 2.474 10 20 IECD CCC(CC)[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCOCC1 742049900 HMACMLJIYPPRFL-RBBKRZOGSA-N 430.593 2.142 10 20 IECD CCc1nncn1CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 743554302 ALPUPDQFHPVTFB-UHFFFAOYSA-N 426.443 2.195 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCC[C@H](CCO)C1 745735926 CMHZKRLTVUBLIV-GOSISDBHSA-N 442.539 2.246 10 20 IECD O=C(CN1CCN(C2CCOCC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747843608 BRPQJJHLJHGZGU-UHFFFAOYSA-N 433.508 2.197 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](C)Cn3ccnc3C)CC2)cc1 749195479 BTIVAVBPPCTPFZ-IBGZPJMESA-N 428.581 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](Cc3ccc(F)cc3)n3nnnc3C)CC2)cc1F 753730331 HTHXVZOPMWLIIO-FQEVSTJZSA-N 442.470 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1F 753895008 OSFJBWHILCCHJJ-INIZCTEOSA-N 440.475 2.394 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)CC2)cc1 758220943 DERPWHPDRATNTL-IBGZPJMESA-N 438.488 2.045 10 20 IECD CC1(Cn2cc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)nn2)COC1 758956201 VRQHPEZCOJHOQS-UHFFFAOYSA-N 439.438 2.100 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NCCCSc2nccs2)CC1 759566845 DZFYYQIIGVWALJ-UHFFFAOYSA-N 443.595 2.004 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 761086497 SNAYVCCWAJSAMX-UHFFFAOYSA-N 436.512 2.047 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccnc1OCC(F)F 765854382 XICRYWBUDRDNSR-UHFFFAOYSA-N 448.470 2.189 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 767718555 KPNMHWUVQPQQPH-UHFFFAOYSA-N 435.477 2.069 10 20 IECD CC(C)(C)OC(=O)NCC1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCC1 769811371 NPADSYVVKLCBLI-UHFFFAOYSA-N 427.523 2.331 10 20 IECD C[C@H](NC(=O)N1CCC[C@H]([C@H](O)c2nccn2C)C1)c1ccc(N2CCOCC2)cc1 769976839 ABVZKHLEMOCHJM-CUWPLCDZSA-N 427.549 2.473 10 20 IECD C/C=C\C[C@@H](CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770349120 HWKHYGQTMFNIAT-KVLZDYKBSA-N 428.512 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CC(=O)N(C(C)(C)C)C4)n3)CC2)cc1 771058033 SAGIDTNDPHAOQH-MRXNPFEDSA-N 441.532 2.084 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4Cc5ccccc5C(=O)O4)n3)CC2)cc1 771067999 QDQKHXBIUQNDRQ-HXUWFJFHSA-N 448.479 2.424 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 774990870 ZWXZUPXGUYRGOD-UHFFFAOYSA-N 426.586 2.499 10 20 IECD Cn1cc(S(=O)(=O)NCCCSc2nccs2)cc1C(=O)NCC(F)(F)F 775702614 BPWMAHIXVFKILC-UHFFFAOYSA-N 442.510 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CCC(=O)N4)CC2)cc1 778239120 QAHIOMSFODAEDH-KHPPLWFESA-N 434.496 2.423 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(CC(=O)N(C)C)CC3)CC2)cc1 781356825 SAMBMFQEVXUGHQ-UHFFFAOYSA-N 445.608 2.107 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4c(Cl)cccc4c3=O)CC2)cc1 781858335 VVDNQKQVDWPCQD-QGZVFWFLSA-N 428.920 2.242 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 782463990 SLXAUSIYGWXMCC-UHFFFAOYSA-N 430.935 2.384 10 20 IECD COc1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786122585 UQYKLAVLLBKFFZ-UHFFFAOYSA-N 437.949 2.496 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCCSc3nccs3)cn2)C[C@@H](C)O1 787198011 MBSRSOXIQOREOB-HUUCEWRRSA-N 449.602 2.067 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)cc1 788976347 XGGMRNYOXLDSQB-UXHICEINSA-N 429.517 2.093 10 20 IECD C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 792474223 PJEKHBZMBVEVIX-QWHCGFSZSA-N 430.468 2.461 10 20 IECD CC(C)[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793717122 GYELERBBPTYXAX-AABGKKOBSA-N 428.577 2.336 10 20 IECD CCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccn1 793726137 RWKQJCLCDVXLEH-WIYYLYMNSA-N 437.544 2.057 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OC)c1OC 793912143 CNWYJLURMFVJGO-HNNXBMFYSA-N 429.517 2.315 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 804858608 YGETZJJCKJULSL-LJQANCHMSA-N 427.501 2.400 10 20 IECD Cc1cc(C(=O)COC(=O)C(C)(C)N2CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 805614167 BWXZFHKLTUXSSQ-UHFFFAOYSA-N 447.557 2.342 10 20 IECD CO[C@H](C)c1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 809331696 JLYWAWUSDVTILK-PBHICJAKSA-N 433.530 2.380 10 20 IECD CCOC(=O)C[C@@H](C(F)(F)F)S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809388881 GSNZQKLECJGQEH-INIZCTEOSA-N 438.468 2.169 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1 862047084 USGFPNXTZPSHPC-UHFFFAOYSA-N 437.587 2.404 10 20 IECD NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 917386376 NOXMOFIZFTXURO-UHFFFAOYSA-N 425.963 2.471 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1)C1=S=CC=C1 917447430 YLCHHIQPRGSAMG-UHFFFAOYSA-N 449.441 2.069 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1C[C@H]2CCCN2c2ccccc21 918284849 RMUFUBFVUBVQGQ-GOSISDBHSA-N 438.503 2.294 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)nc1)CC2)c1cc(O)nc(O)c1 1816724968 FJBHOVUNYZNGCU-NSHDSACASA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccc3nc[nH]c23)[nH]n1)c1cc(O)nc(O)c1 1817845088 YDARAOXXKRBLKE-AWEZNQCLSA-N 448.443 2.107 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c[nH]1 1827896586 OVKOQHJVKIARMJ-QGZVFWFLSA-N 448.614 2.417 10 20 IECD Cc1ccncc1CCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842051793 PSYOBMBCALKJSE-UHFFFAOYSA-N 445.523 2.319 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2n[nH]c(C3CC3)c2F)C1 1842292278 DCBKDBJPZIZSHN-FNORWQNLSA-N 442.447 2.073 10 20 IECD O=C(/C=C/c1cccnc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441238 GWMGHEHKHMPHOG-MDZDMXLPSA-N 429.480 2.091 10 20 IECD O=C(c1ccc2ccoc2c1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055120 FUWQSGDZDADZEL-UHFFFAOYSA-N 429.523 2.110 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCN([C@H]4CCS(=O)(=O)C4)CC3)c2C)cc1 247856762 XTUVHRLJLYTLRR-IBGZPJMESA-N 431.558 2.048 10 20 IECD CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 725900603 YRBSNBNBICWBOL-UHFFFAOYSA-N 427.523 2.141 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727481990 IIJVQUBLBPRJGB-SFHVURJKSA-N 425.533 2.408 10 20 IECD C[C@H](NC(=O)N(C)[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732885120 PMPMEGKBPDEFFU-WMLDXEAASA-N 428.455 2.389 10 20 IECD CS(=O)(=O)Cc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 734842761 WPEGQLNIYNRZHQ-UHFFFAOYSA-N 440.612 2.263 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCCN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 743363602 ULOFOHLBTSBVDL-SFTDATJTSA-N 431.625 2.484 10 20 IECD Cc1cc(C(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)c(C)n1-c1ccccn1 746873072 YFQRCWMOHIATJQ-UHFFFAOYSA-N 434.562 2.002 10 20 IECD COC(=O)[C@@H](O)C1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 747402230 HZHHUBIBCFCDKO-SFHVURJKSA-N 441.475 2.212 10 20 IECD CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 751351893 ZYKSTKSONBHPSJ-AEFFLSMTSA-N 448.589 2.315 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1cc(C(=O)OC)n(C)c1 751467074 PKTNRHJCOLHHGK-UHFFFAOYSA-N 431.308 2.491 10 20 IECD C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 752633585 ZXHVMJKWCBBODG-QWHCGFSZSA-N 427.523 2.139 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccn(-c4ccccc4)n3)CC2)cc1 754007067 FWOMMFPBWRAUDJ-XMMPIXPASA-N 435.572 2.496 10 20 IECD Cc1ccc(-n2cnc3c2CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C3)cc1 754415110 CQDJMBDUCGVFRY-UHFFFAOYSA-N 426.498 2.456 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3CCS(=O)(=O)CC3)cc2F)C[C@@H](C)O1 756059770 XVOWUMCNNPYRJE-HUUCEWRRSA-N 427.542 2.063 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(OC)c4c(c3)OCCO4)CC2)cc(OC)c1OC 759220022 BIZUBCWUZKCVRE-UHFFFAOYSA-N 444.484 2.455 10 20 IECD O=C(CN1CCN(C(=O)NCCCSc2nccs2)CC1)NCc1ccccc1 759601146 IOECHQUBAKMSFV-UHFFFAOYSA-N 433.603 2.269 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 759941928 YVTSEWXPNKFMGQ-FQEVSTJZSA-N 449.548 2.436 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCC(C(=O)NCCCN3CCCCC3)CC2)cc1 764382954 DYXLLBMCSQAAHU-UHFFFAOYSA-N 443.636 2.073 10 20 IECD C[C@H](NCc1ccc(N(C)C)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 764635211 NSURDHZZBXLTBA-HNNXBMFYSA-N 425.576 2.329 10 20 IECD COc1ccc(N2CCCN(Cc3cc(OC)c(OCC(N)=O)c(OC)c3)CC2)cc1 768997833 HMNFYWAKNWPTRE-UHFFFAOYSA-N 429.517 2.289 10 20 IECD O=C(CNC(=O)c1ccc2c(c1)OCO2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771059023 PDJWITQIVKHOPI-KRWDZBQOSA-N 445.903 2.285 10 20 IECD CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 773676164 NYTCXAYIFZLSNB-IBGZPJMESA-N 447.919 2.268 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(OC)c(OC)c3)CC2)cc1 774724156 AYZBKJHBGILGEL-UHFFFAOYSA-N 441.528 2.156 10 20 IECD O=S(=O)(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(CC(F)F)c1 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C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCN(c2ccccc2)CC1 788018172 ZEMIYDUFLZBZHZ-FQEVSTJZSA-N 449.599 2.012 10 20 IECD Cc1cccc([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793734693 VTRJIRFSLWBXTJ-RXVVDRJESA-N 436.556 2.233 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cc([N+](=O)[O-])ccc1O 796401614 FQTJGASAQGVXFN-UHFFFAOYSA-N 437.474 2.332 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21 802610155 SAHWBYBTTABSRB-FQEVSTJZSA-N 426.469 2.488 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC[C@H]1NC(=O)OC(C)(C)C 803662547 CXJDHIAVZRRMFA-WMLDXEAASA-N 436.528 2.270 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccc(N(C)C)cc1 810387677 CXWSOYRPKANKLF-LBPRGKRZSA-N 434.443 2.311 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 813589475 AEOKHZLMCZBJAW-HZPDHXFCSA-N 441.569 2.406 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 914505712 PUSXTRGPIIUTNE-UHFFFAOYSA-N 448.589 2.163 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 918246872 UASNGKJDHJNSAF-CALCHBBNSA-N 438.528 2.257 10 20 IECD COC(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918294834 KKILPNPCIHCCQW-LJQANCHMSA-N 442.468 2.090 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OC 918442957 ZEXUSSGZLUSVGV-UHFFFAOYSA-N 427.501 2.167 10 20 IECD COC(=O)C[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919723811 JVIVCMATTRJNLB-ZIFCJYIRSA-N 435.540 2.473 10 20 IECD COc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc(N2CCN(C)CC2)c(F)c1 1257437163 IBRXHURXEYPOHU-UHFFFAOYSA-N 436.553 2.449 10 20 IECD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)c(C)n1C 1779928302 ITQFJAZQSPDYDM-JOCHJYFZSA-N 447.919 2.464 10 20 IECD COCCCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805349842 COZLCPWHAXNALI-SOFGYWHQSA-N 432.517 2.474 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc4cccn4cn3)CC2)C1 1810552257 SONDLBVVZCIHHV-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813522537 DQGPMQACESZJKD-JTSKRJEESA-N 436.468 2.433 10 20 IECD Cc1onc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1C 1815450647 QCAFSSWELHNSCM-CQSZACIVSA-N 426.433 2.440 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc2ccccn12 1818612513 WHVJMKXIKKOAAZ-HNNXBMFYSA-N 447.455 2.483 10 20 IECD CC(C)n1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820602702 IYDSMGKFVSTIDE-GFCCVEGCSA-N 442.501 2.266 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1 1822680214 VOYMFYNCGVLHIU-XHWCKBBDSA-N 433.461 2.243 10 20 IECD Cc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)s1 1847055900 BCLNFDMLDUQGTA-AATRIKPKSA-N 435.596 2.133 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(CC3CC3)C4=O)ccc21 727947121 KIDAZTLXASFVIJ-UHFFFAOYSA-N 446.507 2.330 10 20 IECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NCc1cccc(OC)c1O 729564712 HDSRRYJWPVVABQ-UHFFFAOYSA-N 428.489 2.119 10 20 IECD CS(=O)(=O)N1CCCC[C@H]1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805192 IDNHRYKYJSCYFD-YOEHRIQHSA-N 431.505 2.187 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 749106073 PYTQCOAPUSTNNM-ZDUSSCGKSA-N 440.543 2.419 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CN(C(=O)OC(C)(C)C)C3)cc2F)CC1 751794478 QSCMACAIZCTZSH-UHFFFAOYSA-N 435.544 2.386 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4ccnn4)CC3)cc2F)C[C@H](C)O1 753208571 ALWBUDMRJPUFSV-ROUUACIJSA-N 444.555 2.059 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754040619 UFQZIJUILIJZIR-UHFFFAOYSA-N 438.477 2.140 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(C[C@@H](C)C[C@@H](C)C4)C3=O)CC2)cc1F 757053906 SCUAHYWBTPVGII-RSQQPWMTSA-N 446.523 2.230 10 20 IECD C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@]1=O 760661389 QZNJMUFOBCNIAT-MZHQLVBMSA-N 428.557 2.238 10 20 IECD Cn1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C(F)(F)F)n1 772930181 UIGIADWTOGXEIQ-CYBMUJFWSA-N 426.395 2.291 10 20 IECD C[C@@H](NC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccc(N(C)C)cc1 776268724 FQDHJJLMCQDACV-OAHLLOKOSA-N 433.530 2.070 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 776906136 PIFNQALWMIRJIM-LPHOPBHVSA-N 445.564 2.054 10 20 IECD O=C1NCC2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)CC2)O1 780306827 QNBRLRXILKQGOS-UHFFFAOYSA-N 442.438 2.326 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)cc1F 787135632 CGYJARRWPQSNSR-UHFFFAOYSA-N 426.536 2.331 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc4ccn(C)c34)CC2)cc1 788326523 GSPOSECYECVCFC-UHFFFAOYSA-N 449.555 2.454 10 20 IECD CC(C)C1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793734350 SHOOMVVPMCXALR-GPJFCIFZSA-N 428.577 2.336 10 20 IECD COCCCN(Cc1ccncc1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803303644 RNXDKHJIIHOHKU-LJQANCHMSA-N 440.544 2.161 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC[C@H]1NC(=O)OC(C)(C)C 803662546 CXJDHIAVZRRMFA-RHSMWYFYSA-N 436.528 2.270 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1F 804853896 XBPLRHMLPOOBGS-CMKODMSKSA-N 448.583 2.388 10 20 IECD O=C(NC[C@@H]1CCCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 806040390 GPUBLPNARHHXJS-AWEZNQCLSA-N 431.505 2.381 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290004 AZAWGPKDIXMACF-OAQYLSRUSA-N 447.583 2.006 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O 808542523 NRFLQKWKUOEYHL-QGZVFWFLSA-N 425.485 2.061 10 20 IECD C[C@H](O)C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 809461003 DAQJDEBYQKCMDH-UGKGYDQZSA-N 439.556 2.153 10 20 IECD O=C(NC[C@H]1COC2(CCCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809673306 PNZDYLFANIKUQG-UXHICEINSA-N 446.544 2.482 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3c(Br)nnn3C)cc2F)C[C@H](C)O1 810167801 OWIQJTKHWKEPBK-QWRGUYRKSA-N 426.290 2.260 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 810318227 SXZSTKQTMCUBIN-NRFANRHFSA-N 427.549 2.277 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 815401104 MDQOAFJFHYIRQN-UHFFFAOYSA-N 426.473 2.091 10 20 IECD CC(C)Oc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442605 LFOCBHYIEYCXCY-UHFFFAOYSA-N 426.517 2.332 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1)c1ccc(N2CCOCC2)cc1 920924673 DBCCPGQNMGOLNH-QGZVFWFLSA-N 436.512 2.466 10 20 IECD NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 920938334 LRZHBWNMLYMLBL-JOCHJYFZSA-N 437.544 2.295 10 20 IECD Cc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004616 IHRHQHJUUJKEEB-OAQYLSRUSA-N 431.876 2.212 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3Cl)C[C@@H]21)c1cc(O)nc(O)c1 1787295313 FFHRVSFZBPQDBW-NUTKFTJISA-N 431.876 2.053 10 20 IECD COCCCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314757 UJIQMVGQEQILGH-UHFFFAOYSA-N 435.571 2.407 10 20 IECD Cn1ccc(=O)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800716652 PUFPSHFMIDTUSE-BTTYYORXSA-N 431.876 2.016 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2coc(Cl)n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992410 YCKPSKKQQCTVCL-PXAZEXFGSA-N 443.847 2.163 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@H]1CCCS1 1813614610 UMERJCBQRMUJQV-GMBSWORKSA-N 428.514 2.103 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnnc(Cl)c1 1816021737 HIIYCPDZHSASBS-CYBMUJFWSA-N 443.851 2.279 10 20 IECD CNC(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1824438344 KTVJEOUEKGCUIJ-INIZCTEOSA-N 437.924 2.121 10 20 IECD Cc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824709746 XMTRVBGITOPFKC-SFHVURJKSA-N 427.505 2.082 10 20 IECD COc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827428629 ZTVGSCIANYSEKW-IBGZPJMESA-N 440.500 2.444 10 20 IECD CC(C)(C)n1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nn1 1845501795 DHNOMHUWDQSFBC-UHFFFAOYSA-N 433.896 2.229 10 20 IECD O=C(c1ccc(Cl)cn1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038210 DMNXZPMGKRQMIY-XVNBXDOJSA-N 429.860 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(C)c3NC(C)=O)CC2)cc1 21731284 KWLHWRWUQIBERT-UHFFFAOYSA-N 425.485 2.468 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OCC(=O)NC(C)C 108808285 YJJCEEPZWGIGCW-UHFFFAOYSA-N 441.528 2.365 10 20 IECD Cc1ccccc1CC(=O)N1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 571575465 SSYDXNJZNWYOFE-UHFFFAOYSA-N 446.551 2.325 10 20 IECD Cc1c(CNC(=O)C(=O)NCCCN2CCN(c3ccccc3)CC2)n(C)c2ccccc12 671019351 CODAKBIPBWZPNE-UHFFFAOYSA-N 447.583 2.431 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 726628341 ZNWVMKHUEXIPJE-UHFFFAOYSA-N 442.472 2.127 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCN(c2ccc(F)cc2)CC1 731870805 XVWKZDBSFRKYLT-LJQANCHMSA-N 426.536 2.489 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1 734530146 DDNHCDDFVGBNKP-UHFFFAOYSA-N 436.500 2.422 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1OC 739670022 CPMSGWGVUDGDHE-UHFFFAOYSA-N 448.906 2.308 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc21 743918586 WVGXWPNQVUKKIS-UHFFFAOYSA-N 431.496 2.018 10 20 IECD Cc1cc(C(=O)COC(=O)c2cn(CC(N)=O)nn2)c(C)n1-c1cccc(C(F)(F)F)c1 745467437 HXNURYCJDSFVDB-UHFFFAOYSA-N 449.389 2.229 10 20 IECD O=C(NCc1ccccc1O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1 748444971 YGXUMFPUHDJPOC-UHFFFAOYSA-N 446.511 2.395 10 20 IECD O=C(CN1C2CCC1CC2)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 748814897 IAHJCQHOSKPEPK-ZDLGFXPLSA-N 445.566 2.360 10 20 IECD CNS(=O)(=O)[C@H]1CCN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)C1 749589474 IGBKBFDDUQJYPJ-RBUKOAKNSA-N 441.513 2.357 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1Cl 751147227 RQABBLPKJCXKQF-UHFFFAOYSA-N 427.891 2.354 10 20 IECD CCS(=O)(=O)CCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759366127 KQHUCMGXJZVPIJ-AWEZNQCLSA-N 428.510 2.156 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cccc(S(C)(=O)=O)c3)CC2)cc(OC)c1OC 759930413 XPDJINASWNURRG-UHFFFAOYSA-N 449.529 2.470 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(OCC(F)F)n3)CC2)cc1 760587894 BHOYADSCYQEFER-UHFFFAOYSA-N 435.427 2.240 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(S(C)(=O)=O)CC1 760933849 QTRNQCBLVKRRNA-AWEZNQCLSA-N 440.521 2.298 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN1CC(F)(F)F 763014163 ZYRYEXBKDZOWAV-RDJZCZTQSA-N 441.498 2.166 10 20 IECD O=C(COC(=O)C1(O)CCSCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 765418351 POPQLBDGPNRAQJ-UHFFFAOYSA-N 425.462 2.202 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CCC(N)=O)CC3)cc2F)C[C@@H](C)O1 767777538 XCEPMFCNEYPLJI-CALCHBBNSA-N 434.556 2.033 10 20 IECD CC1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOCC1 770090476 WVGDRKQKRNGYQZ-UHFFFAOYSA-N 435.458 2.400 10 20 IECD CC(C)OC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCO1 770707257 SHTSIDPMRKUFME-BJLQDIEVSA-N 437.556 2.181 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773847766 OPCXCTWWNSSJOA-XHDOVSQSSA-N 431.558 2.464 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccccc4n3)cc2F)C[C@@H](C)O1 775125158 CMSIMCXQKCIOJU-IYBDPMFKSA-N 439.491 2.020 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]1OC 776226397 FWZGACAJYXTQFD-UNEWFSDZSA-N 426.516 2.177 10 20 IECD C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cn(C)cn1 777823237 RPPZSJDGBPFSOJ-INIZCTEOSA-N 428.514 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](CN4CCCCC4)C3)CC2)cc1 778294584 LQYHAXITFZCLPH-VFCOFNOGSA-N 440.588 2.234 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCN(C2CC2)CC1 782768375 VOAGZWYENFTGIJ-UHFFFAOYSA-N 438.551 2.433 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)cc1 785443024 LBRLSSIPRBGCJV-SFHVURJKSA-N 428.920 2.334 10 20 IECD Cc1nccn1CCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 787655793 RIMJPKSQRAPGCR-UHFFFAOYSA-N 435.475 2.084 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCC3CCCCC3)cc2)C1 788228248 ZHAMYHHRWKUQCV-HXUWFJFHSA-N 428.577 2.481 10 20 IECD CC(C)COc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310826 MYLLQJLVYMYWJV-UHFFFAOYSA-N 425.529 2.491 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC(c2ccncc2)CC1 789840457 IQAQOQRLNHRZTI-UHFFFAOYSA-N 440.519 2.204 10 20 IECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789847521 SNZKIZCWROBQDN-UXHICEINSA-N 435.540 2.113 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 792206219 GGSSXKZYEITSTQ-UHFFFAOYSA-N 432.528 2.478 10 20 IECD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 794241315 DQJVBKXJZNCWMT-LMCOJAPRSA-N 442.560 2.117 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794831733 PYRDFHCXBBMNAE-VLIAUNLRSA-N 429.521 2.050 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 794875318 PLUDDFGABQYHMF-UHFFFAOYSA-N 434.474 2.073 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@@H]1NC(=O)OC(C)(C)C 803686990 SLDUTVPJBDYEJW-LPHOPBHVSA-N 444.576 2.447 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCCCSc3nccs3)CCCC2)CC1 805154754 ROSVRTDPWPAXOY-UHFFFAOYSA-N 440.635 2.281 10 20 IECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)O2 806701877 NVGJFMGHZMGOAO-WPQXDIDISA-N 446.544 2.338 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(CC(=O)NC2CCCC2)CC1 807101450 YNWBYVFTRYOCTG-UHFFFAOYSA-N 428.577 2.365 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C(=O)C(C)(C)C)CC3)CC2)cc1 916196322 AVASNUPTWPUODG-UHFFFAOYSA-N 445.608 2.107 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918286820 KMKVQCMGAKVPEF-GASCZTMLSA-N 442.491 2.054 10 20 IECD CNC(=O)[C@@H]1CN(C(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c2ccccc2O1 918296679 YKDSKSUGDWCZRY-NRFANRHFSA-N 449.463 2.054 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309303 WECHXGQPSZHVNA-UHFFFAOYSA-N 429.448 2.046 10 20 IECD CC[S@](=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919033609 RNVSVBAWWOIXOX-HKBQPEDESA-N 448.516 2.263 10 20 IECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc(N2CCN(C)CC2)cc1 1139408442 MHUQJZWCAUDDQW-NRFANRHFSA-N 446.592 2.423 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)cc2F)CC1 1325022668 GUKNZEXFBFZVOH-UHFFFAOYSA-N 441.507 2.444 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)c1ccc2c(c1)OCCO2 1325382423 OCSZNYCYINDGNN-INIZCTEOSA-N 429.469 2.437 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]3OCCC[C@@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1340897165 FBWLZOYZPMLYMM-VGOFRKELSA-N 431.558 2.425 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)cc1F 1353486299 KFJDTSWVWNBCFD-HNNXBMFYSA-N 437.537 2.261 10 20 IECD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1810999171 LEWICKQBCHFGGK-JLTOFOAXSA-N 437.456 2.072 10 20 IECD CCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1827140318 FBYDLPJOLJCXBT-FLUIGGAXSA-N 447.513 2.312 10 20 IECD CCCNC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423792 HSWUZAOXGUCOLL-GOSISDBHSA-N 446.548 2.033 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(F)s2)C1 1842127133 KIYMEWWMVLVEGY-UHFFFAOYSA-N 426.473 2.497 10 20 IECD Cc1cccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1847252803 VXGHLPFJOUFXNJ-MXHXMMGCSA-N 435.480 2.435 10 20 IECD COC(=O)CN(CCC(=O)NC(=O)NCc1ccccc1)Cc1cc(Cl)ccc1O 731846405 MYLNRYPFJKYIPQ-UHFFFAOYSA-N 433.892 2.437 10 20 IECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 732933943 NPJQZYDUUVPOJM-IBGZPJMESA-N 432.502 2.130 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@@H]3CCC[C@H]3O)CC2)c([N+](=O)[O-])c1Br 742254944 KNUPIEXLJHCSRX-ZWNOBZJWSA-N 445.270 2.310 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nnn(-c4ccc(C)cc4)c3C)CC2)cc1 742917501 YLERNKUPYKFLGB-UHFFFAOYSA-N 434.544 2.445 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCc2n[nH]cc2C1 744356575 RLQHDNRDAQBGGU-UHFFFAOYSA-N 443.441 2.023 10 20 IECD CCCCn1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 746363787 ITIIPVMTYQCQOG-UHFFFAOYSA-N 427.549 2.455 10 20 IECD CC1(C)CN(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCO1 751060293 JGNDHVKMSGKIMD-UHFFFAOYSA-N 439.559 2.095 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751236354 IHNQJARLUQIKKJ-UHFFFAOYSA-N 436.505 2.300 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCCS(=O)(=O)N2CCCC2)cc1 751405346 LNCTVKZVOBTAHY-OAQYLSRUSA-N 437.606 2.466 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4cccc(F)c4)CC3)CC2)cc1 754097628 KIKLZJIQALVUSG-XMMPIXPASA-N 442.579 2.135 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](C)S(=O)(=O)CC1 759986825 CZFYHAXEYGLZCO-CABCVRRESA-N 440.521 2.298 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1F 761981847 IPMFAAUGQFOBSG-OAHLLOKOSA-N 441.912 2.227 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](S(C)(=O)=O)C1 763913843 BPUJPKBMONTQFC-CABCVRRESA-N 440.521 2.298 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ncnc4ccc(S(C)(=O)=O)cc34)cc2)CC1 764916994 RDMMVNOFWAJWCT-UHFFFAOYSA-N 439.541 2.314 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CSc3nnc(CO)n3C3CC3)cc2F)C[C@@H](C)O1 767217823 TWRSDGZQOUHCFJ-ZIAGYGMSSA-N 449.552 2.267 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 768040439 OHPGLOINNSQZMD-IYBDPMFKSA-N 429.558 2.404 10 20 IECD COc1ccc(N2CCN(CCCNc3ccc(C(C)=O)cc3S(N)(=O)=O)CC2)cc1 769356369 SLBHYRPTMKAZJK-UHFFFAOYSA-N 446.573 2.169 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(OC(F)F)cn3)cc2)C1 774764440 UZNTXJMYYKCMDX-HNNXBMFYSA-N 433.459 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@@H]3c3ccc(C)o3)CC2)cc1 778283295 FDUXQOJFROOMFF-LCCNJJIFSA-N 439.512 2.402 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2)C[C@H](O)C(F)(F)F)c1 781372840 YQTQGMIBDZLODH-INIZCTEOSA-N 432.420 2.329 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC1CCN(C2CCCC2)CC1 787193693 RPZBFRHZRLVAQC-UHFFFAOYSA-N 430.618 2.379 10 20 IECD CCOCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 787519959 OMHXBTJIXRBQEF-UHFFFAOYSA-N 429.492 2.131 10 20 IECD CC[C@H]1CN(c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313368 RPPCPPGMVUOVND-NRFANRHFSA-N 436.556 2.267 10 20 IECD CCC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716283 BRNLHJAZTQJGBS-SVFBPWRDSA-N 428.577 2.480 10 20 IECD CCN(CC)c1ccc(CN(C)c2nnc([C@H]3CCS(=O)(=O)C3)n2CCOC)cc1 802348496 DNWKRCHVUMHWMV-SFHVURJKSA-N 435.594 2.309 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 802553003 VUTSUABWPLUWBD-ZDUSSCGKSA-N 447.438 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(F)(F)Br)CC2)cc1 805249087 RJYVSFPNGFEXOA-SREVYHEPSA-N 432.265 2.004 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1 807100330 JEWSFKRUMZWPCM-HXUWFJFHSA-N 437.588 2.004 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)nc1 807100905 OHDJPOFYIZSFMX-IBGZPJMESA-N 437.544 2.258 10 20 IECD Cc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 918202509 KHALAJUSUIJTTK-UHFFFAOYSA-N 432.471 2.339 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1OC 918284417 GBHDPWZYNLUAFV-UHFFFAOYSA-N 431.464 2.325 10 20 IECD CCOC(=O)c1cc(N/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)cc(C(=O)OCC)c1 920978449 BWFQXQWECQQVMF-YBEGLDIGSA-N 447.513 2.235 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)cc1 1320365654 NUGLLQJWMAPIAD-UHFFFAOYSA-N 436.556 2.416 10 20 IECD C/C=C(/C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1781716107 JNOCKKHWQXIOKM-QUKSXRCGSA-N 438.528 2.259 10 20 IECD COc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424283 RAWUBPUFEYFVGF-UHFFFAOYSA-N 435.440 2.353 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721728 ONUHZEPFDHEDFN-CQSZACIVSA-N 439.497 2.121 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(F)nc1 1820366083 FKIKACJFTZQELO-LLVKDONJSA-N 429.433 2.023 10 20 IECD COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(F)c1 1843249384 FIBYPLMWBJJZJZ-UHFFFAOYSA-N 429.448 2.090 10 20 IECD CN(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cn1 1845501687 PVXJPEUVKMUNFG-UHFFFAOYSA-N 430.892 2.343 10 20 IECD CCS(=O)(=O)N(C)CCCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726610095 BXASYCZWZYMZAZ-UHFFFAOYSA-N 448.536 2.228 10 20 IECD Cc1cc(-n2c(C)cc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)c2C)no1 727177855 PPPULKMGLGHWFL-NTEUORMPSA-N 440.572 2.141 10 20 IECD CN(CCS(C)(=O)=O)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 728026240 FCFDWRYWILHNQR-QBFSEMIESA-N 432.614 2.233 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 729786711 SHBARTWBXSIFIN-UHFFFAOYSA-N 439.512 2.226 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3c(F)cccc3Cl)cc2)C1 730590897 WDQZOMKOKMJROI-OAHLLOKOSA-N 446.910 2.227 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)cc1F 731408666 UCXICAKGLGLUAB-UHFFFAOYSA-N 425.468 2.211 10 20 IECD Cn1ncc2c(N3CCN(C(=O)CN(Cc4ccccc4O)C4CCCC4)CC3)ncnc21 731845520 CIGFPZHZNACWAY-UHFFFAOYSA-N 449.559 2.162 10 20 IECD C[C@]1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOC1 733344401 VLPLURMNMQEOKF-JOCHJYFZSA-N 428.512 2.168 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c1 734072505 DEGAXHCROLNDTR-UHFFFAOYSA-N 434.514 2.369 10 20 IECD CN(C)c1ccc(CN(C(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1 737492704 HYMSCQIEMYTUOH-UHFFFAOYSA-N 446.529 2.473 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(O)nc4ccc(F)cc34)nc12 738817286 UWTMGSIVMNUDDC-UHFFFAOYSA-N 426.360 2.362 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCOCC3CCOCC3)cc2)C1 740918871 UEISVZSOLXYMOH-FQEVSTJZSA-N 432.565 2.021 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N(C)C)cc2C)CC1 753523695 QGTHTTBFFNCUON-UHFFFAOYSA-N 439.626 2.255 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccn(Cc2ccccc2)n1 759025684 GCYDZWYBIKAUBR-UHFFFAOYSA-N 447.539 2.395 10 20 IECD NC(=O)[C@@H]1CC(C(=O)NCc2cccc(Br)c2O)=NN1c1ccc(F)cc1 765731239 IMBVVRQINAOKQO-HNNXBMFYSA-N 435.253 2.030 10 20 IECD CCc1ccc(O[C@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768446461 KJDYAHQRWYAQJU-ZHRRBRCNSA-N 426.513 2.492 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)CN3CCCC[C@@H]3C)cc2F)C[C@@H](C)O1 768516171 BBIRHNKUWUSWCP-OKZBNKHCSA-N 449.571 2.428 10 20 IECD CCOC(=O)C1CCN(C(=O)CN(C)Cc2cc(Br)cc(OC)c2O)CC1 769307037 YYSBKUAJHPIPJH-UHFFFAOYSA-N 443.338 2.397 10 20 IECD Cc1ccc(C(=O)OCC(=O)N(c2ccc(F)cc2)[C@H]2C=CS(=O)(=O)C2)c(O)c1O 770005682 IKMVSPRCIZAKQY-HNNXBMFYSA-N 435.429 2.046 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCNC(=O)OC(C)(C)C)n3)CC2)cc1 771057551 PERAEQLSEFSUFC-UHFFFAOYSA-N 445.520 2.037 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCCS4(=O)=O)cc3)c2)CC1 781045856 SYKCDVNGAUFFGG-UHFFFAOYSA-N 442.541 2.147 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccccc1OCC(=O)N(C)C 785421737 FFBYZIDUZSVDTR-FQEVSTJZSA-N 440.544 2.103 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2OC)cc1 785486853 JFZCJIXGEYGAOM-UHFFFAOYSA-N 442.515 2.434 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccccc1Cn1cccn1)c1ccc(N2CCOCC2)cc1 785640188 KOVYAWLFTHOOJQ-LJQANCHMSA-N 447.539 2.262 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(Cc4cccc(F)c4)nn3)cc2)CC1 786259495 QJNSOWLOFKBEIC-UHFFFAOYSA-N 436.491 2.064 10 20 IECD CCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 787282588 CQRHGYBHNKUOHQ-IYBDPMFKSA-N 444.507 2.166 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1C(=O)N1CCOCC1 787558533 IVXNLWSXKWSKGM-QGZVFWFLSA-N 438.528 2.349 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C2CC2)O1 789821562 TYCRBXJHEVYXHW-PTDBIEIZSA-N 433.524 2.081 10 20 IECD CCc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789825583 MYHCCJWDQXSCIQ-HOTGVXAUSA-N 428.508 2.329 10 20 IECD CN(C)c1ccc(CNC(=O)C2(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC2)cc1 794810178 VXSNUGNGAWMZCV-UHFFFAOYSA-N 439.578 2.183 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1 797745189 XPMFRYUSJHQPQF-LRTDBIEQSA-N 434.514 2.033 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C3=C(C)N(C)c4ncnn4[C@H]3C)cc2F)CC1 798958934 PMMKONWALGHBHY-INIZCTEOSA-N 427.528 2.160 10 20 IECD O=C(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)Nc1ccccc1 806251363 VFQLLKMXCOHWCJ-IBGZPJMESA-N 425.485 2.045 10 20 IECD CC(C)(O)CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 807769444 UKESKPOGYMBNBY-AWEZNQCLSA-N 425.476 2.135 10 20 IECD CCn1nc(C)c(Cc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)c1C 813892724 RAIIWRQONXCVEF-UHFFFAOYSA-N 438.532 2.394 10 20 IECD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCc1ccc(N2CCCC2)cc1 915198464 ICCWLTWAMVQRJN-UHFFFAOYSA-N 449.598 2.228 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1C 917758373 SZOXRWKPZTVVSF-UHFFFAOYSA-N 425.488 2.002 10 20 IECD COc1cc(CCNC(=O)NCc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])cc1OC 919791172 WHAYBZHSXXORJA-UHFFFAOYSA-N 444.488 2.491 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCn1c(=O)oc2ccccc21 1325762086 HVLPYMVXCFMFFY-HNNXBMFYSA-N 428.441 2.077 10 20 IECD CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1342447055 AKWQORFCNGAAMW-IYBDPMFKSA-N 449.548 2.206 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cc1)C2)c1cc(O)nc(O)c1 1777847476 BQEZXJKYSUFUJC-WZONZLPQSA-N 443.475 2.002 10 20 IECD CCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782004317 BJPJVIMVKLCLDN-JOCHJYFZSA-N 445.903 2.466 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785704105 WYJAZAJDXWUGPB-STEQJIOHSA-N 449.507 2.058 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1CCCS1 1791804339 RTPPCIIETSYHDH-SCTFDZSOSA-N 440.949 2.240 10 20 IECD Cc1oc(C(C)(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796137716 SNIVYKUWAXFJRL-YVWYUNDQSA-N 443.500 2.209 10 20 IECD C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)NC(=O)OC(C)(C)C 1796601179 BVLFBRCNTSNMRT-DMRZNYOFSA-N 448.520 2.048 10 20 IECD O=C(Cc1ccc(F)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931968 WULFSJVNXLKOIR-FNLKRUPLSA-N 449.486 2.194 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(O)n1 1799376288 FTARFNYVWGLSEZ-PNEROLJOSA-N 439.468 2.178 10 20 IECD CCN(CC)C[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801287961 QBJLMPPDYPWERU-OICROHLBSA-N 445.560 2.433 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1CCCSC1 1814136329 GYMJHZYOSITWCB-TWOQFEAHSA-N 442.541 2.351 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc(O)cc3F)sc2C1)c1cc(O)nc(O)c1 1823342348 SQWKOGDEDKSUIG-SNVBAGLBSA-N 444.444 2.334 10 20 IECD Cc1noc(C)c1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1848227693 FIVAZWPLIMXSJZ-SFTDATJTSA-N 449.511 2.219 10 20 IECD CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)C2=S=C(C(N)=O)C=C2)cc1 465263719 YKYWPWMPTPHVIT-UHFFFAOYSA-N 430.507 2.344 10 20 IECD O=S(=O)(Nc1cc(N2CCCS2(=O)=O)ccc1F)c1cccc2nsnc12 518090254 WOCBLCQUYOFLKW-UHFFFAOYSA-N 428.492 2.171 10 20 IECD COC(=O)c1ccc(N2CCN(S(=O)(=O)c3cccc4nsnc34)[C@@H](C)C2)cc1 523365878 APZVRXPQWDEXHX-ZDUSSCGKSA-N 432.527 2.377 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccc(S(N)(=O)=O)c4cccnc34)cc2)C1 726377029 YNRQZQQFZVACLF-MRXNPFEDSA-N 439.541 2.196 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCS(=O)(=O)NCc3ccccc3)CC2)cc1 726706301 GNTMUNGOXQRRBM-UHFFFAOYSA-N 446.573 2.083 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN(C)S(=O)(=O)c2cccnc2)cc1 728836898 IHTHWRABNAXWEO-UHFFFAOYSA-N 444.479 2.359 10 20 IECD COC(=O)Nc1ccccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 729750620 WVADKGLUDZTSEN-UHFFFAOYSA-N 445.447 2.314 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1c(F)cccc1-n1cccn1 730385673 ILSINEYQPKBNEE-UHFFFAOYSA-N 437.475 2.445 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3sc(-c4cnn(C)c4)nc3C)nc12 734605027 QSFZSOTWLODGIY-UHFFFAOYSA-N 442.457 2.134 10 20 IECD CCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 737139134 LWVRUUHEXGJNMY-GOSISDBHSA-N 448.527 2.013 10 20 IECD O=C(NCCCCN1CCN(c2ncccn2)CC1)NCc1c(O)ccc2c1CCCC2 743593585 UECSMAFCSGBWPW-UHFFFAOYSA-N 438.576 2.463 10 20 IECD COc1ccc([C@H](CNC(=O)NCc2cccc(OC)c2O)N2CCOCC2)cc1OC 745291534 XTTQMUHAHYATLS-SFHVURJKSA-N 445.516 2.291 10 20 IECD NS(=O)(=O)c1cnn(CC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 748426755 KQVOIKAGQPXBAZ-UHFFFAOYSA-N 442.457 2.128 10 20 IECD O=c1[nH]c2ccc(S(=O)(=O)N(Cc3ccccc3O)C3CCCCC3)cc2[nH]c1=O 751137389 QRYHMUJRTQNPGJ-UHFFFAOYSA-N 429.498 2.446 10 20 IECD Cc1cc(C(=O)COC(=O)c2coc(S(N)(=O)=O)c2)c(C)n1-c1ccc2c(c1)OCO2 757770668 BMDGFQQKEFWKJN-UHFFFAOYSA-N 446.437 2.103 10 20 IECD CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 762609842 MYOQJKCJWPTQRC-UHFFFAOYSA-N 436.528 2.453 10 20 IECD C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1ccc(N2CCOCC2)c(F)c1 764846625 IHELGMIAFUMMTO-LJQANCHMSA-N 428.556 2.315 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nnc(CC(F)(F)F)s1 766246184 YIRXODIFXRFPMV-UHFFFAOYSA-N 449.480 2.199 10 20 IECD CCCn1c(=O)nc(O)c2c(C(=O)NCCc3ccc(O)c(O)c3)cc(C(C)C)nc21 768903414 DXNMVNBXUJKVKS-UHFFFAOYSA-N 426.473 2.414 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771066185 PFPYVKFUZORZFG-GOSISDBHSA-N 437.949 2.229 10 20 IECD CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)n1 775737679 YQDKJKVBLOSINM-LJQANCHMSA-N 428.581 2.237 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)cc(C)c3C)c2)CC1 780407601 NHVSTJWJONTANA-UHFFFAOYSA-N 431.514 2.471 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2cccc(C(N)=O)n2)NC(=O)OC(C)(C)C)cc1 782003947 WTXNSIQBQWGONK-SFHVURJKSA-N 427.505 2.242 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(OC[C@H]2CCOC2)c1 785424001 JURZDYRVQJOOPK-IBGZPJMESA-N 425.529 2.409 10 20 IECD CCN1CCN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 787908209 HNRUSDBSSDLRNT-UHFFFAOYSA-N 443.636 2.169 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C[C@@H]3CCOC3)C3CC3)cc2F)C[C@@H](C)O1 789812550 MGJYGYIIKJKUHN-JZXOWHBKSA-N 433.524 2.083 10 20 IECD CN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951699 YYLKOLFTMCNOFZ-UHFFFAOYSA-N 425.407 2.410 10 20 IECD CC[C@]1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 791428720 ZZRRANQVOVLBMY-IBGZPJMESA-N 435.458 2.400 10 20 IECD CC[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 805636310 MXYWGNJQJXBNKE-HXUWFJFHSA-N 444.620 2.498 10 20 IECD O=C(N[C@H]1CCCC[C@@H]1N1CCOCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806090357 JVVHGYRNDFMPCH-SFTDATJTSA-N 441.528 2.274 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 806282881 XFJJWFAWZOVWII-UONOGXRCSA-N 441.600 2.154 10 20 IECD C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H](C)C1 806877613 AZMYZSBMUNUZHZ-YESZJQIVSA-N 426.508 2.353 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 808611310 BAQCNTKADZHFFV-LJQANCHMSA-N 446.910 2.425 10 20 IECD COC(=O)CNC(=O)c1ccc(N2CCCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 917094519 SXUPOWSWYSYLKX-UHFFFAOYSA-N 442.472 2.223 10 20 IECD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NCc1ccc(N2CCCC2)cc1 917117112 ITEXNYABGJGEOI-UHFFFAOYSA-N 445.541 2.043 10 20 IECD C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 917417047 GTBBMVPFBXBTDH-INIZCTEOSA-N 442.585 2.342 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1 920481952 ACIMAPSZHYRGGC-UHFFFAOYSA-N 439.559 2.318 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 920785980 DNOQXMGYOKXOHY-UHFFFAOYSA-N 425.485 2.088 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2ccc(OC)cc2)CCOCC1 1320692963 RYMNMFFKWOCZGC-IBGZPJMESA-N 443.496 2.445 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)cc1F)C2)c1cc(O)nc(O)c1 1777852898 ZOXLYAHSOLWYIG-VGOFRKELSA-N 447.438 2.212 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2 1785503287 GTOIDZJMDQDBDB-YAZYHYQQSA-N 428.485 2.003 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1C(F)(F)F)c1cc(O)nc(O)c1 1797098868 NFYHDPBVKRTFRF-CLLJXQQHSA-N 436.390 2.472 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993256 TWSUEILZUFGKDA-SCLBCKFNSA-N 432.427 2.253 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cnc4ccccn34)CC2)C1 1810551377 IWIMMAYJCHZOJV-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CCN1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1832950578 PVZZEFKKJMSMNR-FQEVSTJZSA-N 444.576 2.458 10 20 IECD C[C@@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841528355 NSVJIEMJDJVNBQ-CQSZACIVSA-N 449.623 2.231 10 20 IECD CSc1ncccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844581248 AREDAWBXSUCNLB-UHFFFAOYSA-N 449.536 2.413 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1C(=O)CCOc2ccccc21 7121163 OUAKASPBNNPCBT-UHFFFAOYSA-N 425.485 2.070 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCN([C@@H]4CCS(=O)(=O)C4)CC3)c2C)cc1 61085749 XTUVHRLJLYTLRR-LJQANCHMSA-N 431.558 2.048 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3cccc(C(=O)NCCC(N)=O)c3)CC2)cc1 733631523 IKVQHRPSBJGKJA-UHFFFAOYSA-N 439.516 2.091 10 20 IECD NS(=O)(=O)c1ccc(F)c(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 734675826 KFWAOONYVBQDAC-INIZCTEOSA-N 437.493 2.070 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 741806222 LZIOXPMZEOEJPQ-SFHVURJKSA-N 428.485 2.275 10 20 IECD CCCS(=O)(=O)c1ccccc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742920717 REVRWZRFYLSBEV-UHFFFAOYSA-N 445.585 2.431 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cnc4ccccc4c3)CC2)cc1 743432800 SIQUROYBGJPLAV-UHFFFAOYSA-N 433.512 2.120 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCC([C@]4(C)NC(=O)NC4=O)CC3)cc2)CC1 754376612 VNWHHCBSUFRVHJ-QHCPKHFHSA-N 427.549 2.443 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)Nc1ccc2c(c1)OCCO2 756337295 RNLVEGFXLSTXKW-GOSISDBHSA-N 441.484 2.493 10 20 IECD CN1CCC([C@H]2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)CC1 756683375 OBYQCLBOYNTXAX-LEWJYISDSA-N 427.593 2.262 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ccc2c(c1)C(=O)NCC2 758378693 ANSWMUXDONSJMS-UHFFFAOYSA-N 426.492 2.072 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2cccc(Br)c2O)cc1 765731580 JRPRWNVDBONZPX-NSHDSACASA-N 443.319 2.147 10 20 IECD COc1cc(Br)cc(CN2CCN(c3nccn4cnnc34)[C@H](C)C2)c1O 770282353 UNDMGHSRHYFXAP-GFCCVEGCSA-N 433.310 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(Br)cn3)CC2)cc1F 773382169 MISKBVBALGTBRG-UHFFFAOYSA-N 437.269 2.279 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnn(CC(F)(F)F)c3)n2)c[nH]1 775150393 YNQZRBMYEMBZIV-UHFFFAOYSA-N 435.409 2.484 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)C(=O)C1 777397410 WUOJJUCRTBPDPJ-NBEHIINDSA-N 445.516 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3ccc4c(c3)CC(=O)N4)CC2)cc1 778235105 VMGIFTQMBBJNNA-IBSYWUHOSA-N 448.523 2.272 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])c(O)cc3C)c2)CC1 780408498 IZOGLNPFOWADKL-UHFFFAOYSA-N 434.474 2.078 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1 785294510 MXSXOMQGEDELQZ-AWEZNQCLSA-N 446.935 2.189 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1 785427890 GRRYQLGWZQMOFC-LJQANCHMSA-N 428.920 2.286 10 20 IECD COCCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 787979677 OMKDJWYAERIEFL-UHFFFAOYSA-N 440.544 2.276 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)COCc1ccccc1 788320933 RTKSOEFUSSLJBV-LJQANCHMSA-N 425.529 2.109 10 20 IECD CC(C)(C)OC1CC(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789813315 SWNPFGLXQFVGOO-UHFFFAOYSA-N 435.540 2.379 10 20 IECD Cc1ccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)cc1 793733326 MGVRBHQIICWBST-VXKWHMMOSA-N 448.567 2.329 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1Br 795141860 YMYPVOYFLQJGFT-NXEZZACHSA-N 433.259 2.165 10 20 IECD CCc1nc(CN(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cs1 805008652 PRSKRPJJSBFGEP-UHFFFAOYSA-N 447.580 2.261 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCOc4cc(O)ccc4C3)CC2)cc1 806620166 QFMYTRKRUADLDZ-UHFFFAOYSA-N 426.517 2.127 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1 807692134 CRAHDUOMBAJEKE-HXUWFJFHSA-N 428.577 2.399 10 20 IECD C[C@@H](C(=O)N1CCN(c2ccccc2O)CC1)N(C)Cc1ccc(N2CCOCC2)cc1 857758636 PMTNRPQWGCRVJP-FQEVSTJZSA-N 438.572 2.398 10 20 IECD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCc1ccc(O)c(O)c1 917371593 JEBOVEZADULPQC-INIZCTEOSA-N 433.486 2.216 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2cccc(S(C)(=O)=O)c2)c(C)n1-c1ccccn1 917439646 APLFBQQCJRKVDB-UHFFFAOYSA-N 433.511 2.011 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 918287099 OBBGVHNZOMMNNM-GJZGRUSLSA-N 443.475 2.481 10 20 IECD O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1320543351 JGOSCYDLPZXEQP-SJORKVTESA-N 434.518 2.161 10 20 IECD C[C@H](Nc1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798463816 WZJMTBRWVOMKST-MHEUCROKSA-N 445.907 2.294 10 20 IECD Cn1cccc1C(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1803105963 FHOYPJKUSLIPFO-BTTYYORXSA-N 431.876 2.224 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1cc(O)nc(O)c1 1817844758 KEIXYPKXXVUAJX-MRXNPFEDSA-N 429.477 2.339 10 20 IECD Cc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)o1 1838031727 IFYPJBVULUYJKW-UHFFFAOYSA-N 443.500 2.249 10 20 IECD CC(C)(C)c1cc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)ccn1 1842177077 CDMISOQQALIKQC-UHFFFAOYSA-N 446.598 2.056 10 20 IECD Cc1nc(F)ccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844575967 XGJGUZBLNLOFBC-UHFFFAOYSA-N 435.459 2.139 10 20 IECD Cc1cc(C(=O)COC(=O)C2CC(=O)NC(=O)C2)c(C)n1-c1ccc(OC(F)F)cc1 726821262 MIRWBZZCUDOLHD-UHFFFAOYSA-N 434.395 2.474 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(Cc4cnn(C)c4)CC3)cc2F)C[C@@H](C)O1 730064869 PXHWSWCTAWWSFI-QZTJIDSGSA-N 444.555 2.200 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)ccc2OC)cc1C 747606284 DJUQVOPVOBQCIZ-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227461 JDKJDNQYDCOFPU-UHFFFAOYSA-N 436.505 2.442 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)CC2)cc1F 754217569 WMKOKOFSMGJNCL-UHFFFAOYSA-N 426.448 2.006 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(Cl)n3)cc2F)C[C@H](C)O1 758626375 ZAGVJWSKZNZCIR-STQMWFEESA-N 436.871 2.356 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)nc1 761010594 IFRLFVFJXGBRKN-UHFFFAOYSA-N 428.470 2.180 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1F 765468834 OGAJYJQHRDUMHQ-UHFFFAOYSA-N 442.539 2.207 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 769560447 DIJMUYHBLMGXIS-UHFFFAOYSA-N 446.525 2.042 10 20 IECD COC(=O)c1cc(Br)c(S(=O)(=O)NCc2cc(OC)ccc2O)s1 777968076 REMWJPFVCVWPOE-UHFFFAOYSA-N 436.305 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3c3noc(C)n3)CC2)cc1 778287325 MSJFDQNRZGWISO-CTDFXDFQSA-N 439.516 2.345 10 20 IECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCN1CC(C)(C)O 782005058 WQAVZQGOCLKLDB-INIZCTEOSA-N 435.524 2.178 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1nnc2n1CCCCC2 785921819 VZYXLOGEUDMIKO-UHFFFAOYSA-N 426.565 2.166 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)cc3F)cc2F)CC1 786981988 TWTHBNZPXXYMND-UHFFFAOYSA-N 434.462 2.178 10 20 IECD CCc1nsc(N2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)n1 788909227 DXJVSMWSFCNLGH-UHFFFAOYSA-N 442.589 2.056 10 20 IECD CC(C)c1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 789859710 FRBNFFBZCGCMCP-UHFFFAOYSA-N 427.574 2.428 10 20 IECD COc1ccc(CNC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)c(O)c1 792952751 KZLOICVFHUFAIR-UHFFFAOYSA-N 427.501 2.442 10 20 IECD O=C(NCc1cccc2c1OCO2)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793738019 QTRCBUKZLDESSQ-HNNXBMFYSA-N 447.438 2.418 10 20 IECD C[C@H](NC(=O)C(=O)N(C)CCOc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803300276 RTLUEYWTJRZMQZ-KRWDZBQOSA-N 429.492 2.377 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccc(N(C)C)cc1 803399516 BXQFYHRYBZBNAC-VGSWGCGISA-N 442.535 2.259 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCCN2CCN(C)C(C)(C)C2)cc1)C1CCCCC1 803676607 NPYUURNYRLXGQY-UHFFFAOYSA-N 443.636 2.214 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)c3ccncc3)cc2F)CC1 805008646 POBOILBWSSBPRS-KRWDZBQOSA-N 427.524 2.198 10 20 IECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCCCSc2nccs2)Oc2ccccc21 806277083 PJTAICLXPLTADV-OAHLLOKOSA-N 434.587 2.487 10 20 IECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)CC2 807292879 BCNZAIJKJPGJJB-PMACEKPBSA-N 440.544 2.351 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)c3ccc(Cl)cc3F)CC2)cc1 811370757 LPVYQSADNJZIIE-HXUWFJFHSA-N 436.867 2.413 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(CO)C[C@H]3c3ccccc3)cc2)C1 812011328 ZFEZIIXRBAYFDT-KJWPAHLWSA-N 436.556 2.354 10 20 IECD CN1CCN(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 914445152 IGLXZBRRKNVOEL-PEZBUJJGSA-N 438.644 2.093 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 916649882 VVKAAEULQXRKDJ-UHFFFAOYSA-N 434.562 2.019 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)S(=O)(=O)N(CCOC)C3=O)cc1 917694630 JXIINSZSZVOOGF-UHFFFAOYSA-N 445.541 2.254 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCn3cc(Br)cn3)cc2)C1 917837218 VMHHTYZEPSQZPZ-HNNXBMFYSA-N 434.338 2.054 10 20 IECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917930830 VSDTWZMDCFOKLW-MRXNPFEDSA-N 432.502 2.083 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(CC(=O)Nc3cc(C)on3)CC2)cc1 918228105 GTNHPIVLPMUVTC-UHFFFAOYSA-N 428.537 2.295 10 20 IECD O=C(Nc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1)NC1CC1 918337255 HZQMECFYQOINBP-UHFFFAOYSA-N 442.541 2.135 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nc4ccccc4n3C)CC2)cc1 1320144558 XFPKTISGERYEIH-VAWYXSNFSA-N 447.539 2.146 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(Cl)o1 1778409312 IGZIDQFZNRXHSE-JLTOFOAXSA-N 435.864 2.181 10 20 IECD O=C(Cc1ccccc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782001861 NMPWJOZKIAOQFR-JOCHJYFZSA-N 430.888 2.437 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccc(O)cc1 1789599636 WUKFUXSFZXWHFE-AXHNFQJDSA-N 446.887 2.364 10 20 IECD Cc1cc(F)cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1802478343 ZGGUEDXKLMGLGC-BJWYYQGGSA-N 449.573 2.175 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)C(F)F 1806430582 BIZIEJNNIAGRGQ-KXBFYZLASA-N 441.438 2.145 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831913189 IMNBWVQRQPHMTC-ZYMDLIBXSA-N 432.517 2.471 10 20 IECD O=C([C@H]1CNc2ccccc21)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442103 YKOCOOKAMWSVRZ-IBGZPJMESA-N 443.507 2.192 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C(F)(F)c2ccco2)C1 1845795860 FXNVGWHLBWJCGG-FNORWQNLSA-N 434.395 2.405 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 472798945 XYSLFYQAWFOYKB-UHFFFAOYSA-N 444.495 2.335 10 20 IECD COc1ccc(N2CCCN(C(=O)NCC(=O)N(C)CCc3ccccn3)CC2)cc1 727479860 DQKWHVQRIAUFMR-UHFFFAOYSA-N 425.533 2.013 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(CN4CCOCC4)c3)cc2)C1 727768287 ZEMLIPNUENMXOT-QFIPXVFZSA-N 436.556 2.151 10 20 IECD O=C(COC(=O)[C@H]1CCOc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 728355823 FNCILFOZSHMCEM-SFHVURJKSA-N 428.460 2.388 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C 728758507 SMWUPBUSFVPYOD-UHFFFAOYSA-N 425.485 2.215 10 20 IECD COCCNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731857051 WPNGKZUXVPCGPJ-LJQANCHMSA-N 448.541 2.138 10 20 IECD Cn1c(=O)nc(O)c2cc(S(=O)(=O)Nc3cccc(N4CCCCCC4)c3)cnc21 743248712 OFEPXLRVWGLLQV-UHFFFAOYSA-N 429.502 2.215 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc(CN(C)C)c3)CC2)cc1 743363975 ZEKVODKVHAXZRG-UHFFFAOYSA-N 425.577 2.378 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 743868700 BZPNPGWFNHOXRF-QGZVFWFLSA-N 444.557 2.080 10 20 IECD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 748616409 ZXEWIUIOYBTDCC-CVEARBPZSA-N 426.439 2.105 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 749646086 VBJSIBIPBAIGMB-CYBMUJFWSA-N 429.473 2.317 10 20 IECD O=S(=O)(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn([C@H]2CCOC2)c1 752000423 ZLTNDZNLKFQGGR-HOCLYGCPSA-N 442.488 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)CC2)cc1 752258609 WZQVFSNAYGQCRH-UHFFFAOYSA-N 427.885 2.098 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1cccc2ccsc12 752397233 ZQEYONMBSLBBCN-UHFFFAOYSA-N 443.550 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)CC2)cc1F 753739273 CODHLOREBFQDKK-QRFRQXIXSA-N 436.553 2.209 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1Cl 754211632 IYYYYVRAIAPHNK-UHFFFAOYSA-N 448.882 2.135 10 20 IECD COC(=O)Nc1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1F 754214128 ZCNQLFYGKLZCLB-UHFFFAOYSA-N 448.426 2.439 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)c(F)cc1O 756706442 QWTCVQJOYIHRFB-RYUDHWBXSA-N 439.347 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3C[C@@H](O)c3ccccc3)CC2)cc1 763431866 XENKSLXVQLJTMB-ISKFKSNPSA-N 439.556 2.168 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c([N+](=O)[O-])ccc(C)c3C)CC2)cc1 765185507 PSMOQTMCFMRUEL-UHFFFAOYSA-N 448.545 2.321 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)n(C2CCOCC2)n1 765925817 KUALUFLRZFRNHF-UHFFFAOYSA-N 437.294 2.266 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccs1)N(C)C)c1ccc(N2CCOCC2)cc1 774853082 GMDIZGVBDOXAHV-QFBILLFUSA-N 430.574 2.181 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 774920505 SBHWOFXTONAAOV-GDBMZVCRSA-N 444.482 2.160 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3COC4(CCCCC4)O3)CC2)cc1 778419562 MCLQQRBQBQZIBD-LCCNJJIFSA-N 443.544 2.092 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4cc(F)ccc4F)CC3)CC2)cc1 779222900 YCZVFRCWROQOKL-OAQYLSRUSA-N 446.542 2.279 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1O 780394728 ASHWFAXEUMDJQD-UHFFFAOYSA-N 425.362 2.185 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(c4ccccc4)CCC3)cc2)C1 785833498 AYOCUTAUALRROE-FQEVSTJZSA-N 448.567 2.243 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 788012604 DNERPLUVCSRGQI-UXHICEINSA-N 437.588 2.257 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 788311774 ZQRZIBSIXWPEJU-UHFFFAOYSA-N 442.535 2.441 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(CCCO)[C@H]1CCc2ccccc21 788312250 FHNGUUZDBIHLLS-QHCPKHFHSA-N 437.540 2.038 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1cccc(F)n1 792956584 NBXHTJOYNMTXHX-UHFFFAOYSA-N 426.370 2.331 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](c4ccccc4)C3)cc2)C1 793734204 RIVANFZODIPDDO-RTWAWAEBSA-N 434.540 2.021 10 20 IECD COc1ccc(CNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c(O)c1 794388898 BPLHUYGCGJJERF-AWEZNQCLSA-N 430.457 2.096 10 20 IECD COc1ccc(CNc2ccc(S(=O)(=O)NCCCN(C)C)cc2[N+](=O)[O-])c(O)c1 795283612 DMYKDXISXNOKDD-UHFFFAOYSA-N 438.506 2.151 10 20 IECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1OC 795811905 MKWBWARYPRFILP-UHFFFAOYSA-N 429.901 2.392 10 20 IECD CN1CCN(S(=O)(=O)c2cccc(NCc3ccc(N4CCOCC4)cc3)c2)CC1 796431302 NNLMWVPFGBYLEE-UHFFFAOYSA-N 430.574 2.071 10 20 IECD COc1ccccc1CCNC(=O)CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 798060932 OWVWQYDCHCGXCI-GOSISDBHSA-N 440.544 2.251 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)CC2)cc1 804317573 IACFZWPTQJRKSI-PWRODBHTSA-N 427.545 2.244 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807100120 KFARAKVLUCRZJR-SFHVURJKSA-N 431.558 2.046 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 807291814 IAWAXNYJDODJFL-RDPSFJRHSA-N 448.567 2.085 10 20 IECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C[C@H](C)S1(=O)=O 813062908 KEMFYEKSQOAPCO-WMZOPIPTSA-N 440.585 2.075 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 813590292 KBWLNSKEBCKFQS-HLLBOEOZSA-N 427.542 2.015 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)cc2F)C[C@@H](C)O1 814327696 PVJDRDTUSIROPL-ZIAGYGMSSA-N 440.475 2.051 10 20 IECD CCn1c(-c2cc(O)c(O)c(OC)c2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 916856829 QEDRLJOBTACSJS-UHFFFAOYSA-N 433.486 2.164 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)CC2)cc1 917822253 HIUTTZKTEDCMQW-UHFFFAOYSA-N 433.530 2.425 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NCc2ccc(N3CCCC3)cc2)CC1 918133690 BOKAJPYWYVLAIV-UHFFFAOYSA-N 445.564 2.165 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1 918428942 DFAKGQZMIKXYPH-UHFFFAOYSA-N 426.517 2.255 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CSCCS3)cc2F)C[C@@H](C)O1 918985611 DKWUYPXWNQNLNO-HBUWYVDXSA-N 442.578 2.447 10 20 IECD O=C(CCc1ccc(O)nn1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788428852 DGVBPZYZFOTYDH-UHFFFAOYSA-N 449.467 2.369 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCN(C)C)C3)cc1 1799620614 XCYCXBPLQUQJML-RUMRUAAYSA-N 438.572 2.249 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)C(F)F 1806438761 JDNARMXSJAXVCX-JUALTMEFSA-N 433.411 2.183 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993348 IGBJNZBFHSDRBS-VGOFRKELSA-N 440.500 2.024 10 20 IECD Cc1ncccc1C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1808192366 FILDOMPGHOVUHA-UHFFFAOYSA-N 446.598 2.095 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc[nH]1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362259 SZHUGGMWMNRVMA-CYBMUJFWSA-N 448.508 2.490 10 20 IECD O=C(c1ccc(O)cc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030350 QBDCWMJTQMTDKF-UHFFFAOYSA-N 441.484 2.124 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc([N+](=O)[O-])c1 18221821 NBJGODMKEPWLHD-UHFFFAOYSA-N 429.429 2.263 10 20 IECD Cc1c(CNC(=O)N2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)n(C)c2ccccc12 472240315 NSDVJWCUIXZGPD-UHFFFAOYSA-N 439.560 2.132 10 20 IECD C[C@H](OC(=O)CCN1CCCC1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 727913338 DJYMAULPZLLVQJ-AWEZNQCLSA-N 434.448 2.345 10 20 IECD Cc1cc(C(=O)CN2CCN(CC(N)=O)CC2)c(C)n1-c1cccc(Br)c1 730806253 MYDRGKMTYYAMAV-UHFFFAOYSA-N 433.350 2.142 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 731038549 KGMGOMPSMKELDJ-UHFFFAOYSA-N 437.587 2.310 10 20 IECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc2c(c1)CCCN2C 731543648 OKKSQGPYRVECJS-JOCHJYFZSA-N 432.528 2.408 10 20 IECD COC(=O)CN(CCN1CCOCC1)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 731882398 QLVCVQGUZLXCOI-UHFFFAOYSA-N 429.517 2.050 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCCN(S(=O)(=O)c2c(C)noc2C)CC1 734687083 GRTGYSNHMWBXJA-UHFFFAOYSA-N 449.577 2.272 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cnn(CC(F)(F)F)c1 741072466 ZYLOWMOXZHVHJN-UHFFFAOYSA-N 431.440 2.002 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCn4c(Cc5ccccc5)nnc4C3)CC2)cc1 741793881 CLDDWOIERRYXOC-UHFFFAOYSA-N 446.555 2.042 10 20 IECD C[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 746048836 JJPYAJRAAMVOMG-YLJYHZDGSA-N 444.601 2.489 10 20 IECD CCC[C@H](C)NC(=O)[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 747836022 YIMHIMPGWKWCKX-ICSRJNTNSA-N 448.583 2.295 10 20 IECD CCCN(CC(=O)NN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O)Cc1ccccc1O 750872399 LBBUHPXQOFQXBX-QHCPKHFHSA-N 440.500 2.111 10 20 IECD COc1cccc(CNS(=O)(=O)c2cc3c(cc2Br)OCCO3)c1O 751309934 UHRVWZCRCAENDL-UHFFFAOYSA-N 430.276 2.413 10 20 IECD C[C@H](NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccc(N(C)C)cc1 773016345 BPYPBQPRSDQZOO-HNNXBMFYSA-N 437.587 2.255 10 20 IECD C[C@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 775258128 RCEHRQLXHNYXNF-INIZCTEOSA-N 440.500 2.293 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-n4ccnn4)cc3)CC2)cc1 778255796 ZPVKYYOIBUOBFZ-ZHACJKMWSA-N 432.484 2.119 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H](O)[C@@H](O)c3nc4ccccc4[nH]3)cc2F)C[C@@H](C)O1 779607793 UFCABMNDBXRSAX-VMHCRYLRSA-N 442.491 2.026 10 20 IECD O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N(CCO)[C@@H]1CCS(=O)(=O)C1 782941461 YCWWASSCRSKZMX-GOSISDBHSA-N 430.486 2.049 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@@H]2c2ccccc2F)c1 784037771 ZUDTYFCZCJMAMT-QFIPXVFZSA-N 441.503 2.239 10 20 IECD Cc1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(=O)n1C 787602824 MPTMBBATYAIUGG-UHFFFAOYSA-N 433.511 2.192 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 787984487 UXAHNTDIDURTJG-LJQANCHMSA-N 427.501 2.398 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3nnc(C4CC4)n3)c2C)c1 788508479 HDUJCFZVIHEEJX-UHFFFAOYSA-N 437.456 2.414 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCSC(F)(F)F)cc2F)C[C@H](C)O1 788539093 LAUJOJPAXIBYRQ-RYUDHWBXSA-N 437.459 2.425 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1 788978639 QDAIYPFPVAKVLG-QFIPXVFZSA-N 436.556 2.456 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4nccs4)CC3)cc2)C1 798383028 HBZHTBKXHBIBQG-QGZVFWFLSA-N 442.589 2.313 10 20 IECD Cc1ccc(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 804033452 PFDNYSUFBXIYID-KRWDZBQOSA-N 432.471 2.435 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)CC2)cc1 804314876 BOZGRQMRQGEZDZ-GUDVDZBRSA-N 435.615 2.276 10 20 IECD CCN1CCCC[C@H]1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804420705 DITDQMOMAVLSSO-WMZOPIPTSA-N 438.519 2.364 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cc(F)cc(OC)c3)cc2F)CC1 805007197 GVVROIMQWYVLNB-UHFFFAOYSA-N 446.498 2.048 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3cccnc3)cc2F)C[C@@H](C)O1 805644421 ZWFIFVYAYYGSPN-CALCHBBNSA-N 445.491 2.211 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 806277224 UINGUYYFGUKMEV-IAGOWNOFSA-N 435.571 2.093 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@H]3[C@H]5OC)CC2)cc1 806332830 BGALOTRPHNRRMY-MENMYXSPSA-N 428.577 2.272 10 20 IECD CC1(C)[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H]2CCO[C@H]21 807195235 AJTBQOUQFZQAKL-BNEJOLLZSA-N 437.487 2.303 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@@H]1[C@H]1CCCO1)c2[N+](=O)[O-] 808902504 MXKIAVPTBAGSDW-QZTJIDSGSA-N 436.420 2.390 10 20 IECD Cn1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccccc21 809319282 BHNACXQRFDLODW-SFHVURJKSA-N 436.512 2.145 10 20 IECD CN(Cc1cc(Br)cc(Br)c1O)[C@@H]1CCN(S(C)(=O)=O)C1 814171194 JINQQBWQFRQDPY-LLVKDONJSA-N 442.173 2.383 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 815459234 WBCHLODZFMXYDT-UHFFFAOYSA-N 426.473 2.137 10 20 IECD CC(C)n1ncc2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cnc21 916676745 PVYLTWJNQWKUML-UHFFFAOYSA-N 427.530 2.177 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](C(=O)NCC3CC3)C2)c1 917468513 RPNNEQRKPCZSES-IBGZPJMESA-N 429.561 2.165 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2)C1 918121130 DNJWHQFYPWRYBA-KRWDZBQOSA-N 440.504 2.208 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2ccc(F)cc2)CC1 918223730 JGWSMSTVAUANBX-UHFFFAOYSA-N 444.482 2.469 10 20 IECD Cc1cc(C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1cccc(Cl)c1 920289821 DACICOGLOALZSZ-MRXNPFEDSA-N 437.949 2.123 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 921247677 JDBDGYSTWKBHEV-UHFFFAOYSA-N 449.533 2.171 10 20 IECD O=C(CCC1CCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1784307468 JVKFZRLGRNHIOD-IYIYPWCISA-N 444.528 2.377 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(C)n1 1798380114 JMLYNZAARWRFDV-CCWDJLKJSA-N 445.903 2.280 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1 1799057052 WUPVBWKPHGPCGV-CLLJXQQHSA-N 432.864 2.115 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccsc2[nH]1 1800953336 OWSFZZWVPNWGCD-CLLJXQQHSA-N 448.595 2.342 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 1802010861 FINMIRIMEMTJAH-JNAKVWCCSA-N 428.485 2.022 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCC=C1F 1804571319 MCCQYQZHIOLAOX-RJAOAUJVSA-N 443.541 2.231 10 20 IECD C/C=C/C=C\C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821916601 DRYFMALYYNBVMF-KOJPTDIOSA-N 433.559 2.394 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cnc[nH]2)CC1 1825132994 NBPZCFHTDIXAMW-GOSISDBHSA-N 427.505 2.082 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccc[nH]2)CC1 1829160750 UNSDKHMSEZYLKA-INIZCTEOSA-N 434.587 2.108 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc3nn[nH]c3c2)C1 1845734475 GWTSJQHHVBOXGX-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CN(Cc4ccccc4)CCO3)cc2F)CC1 303811602 CTBNXURVDAYSEN-DEOSSOPVSA-N 440.563 2.485 10 20 IECD Cn1c(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nnc1-c1ccccc1 728165249 FZTMMQFLSDCQKP-IBGZPJMESA-N 432.528 2.043 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)NC(=O)[C@H](CC)N4)nc12 729721816 SWOUKPAJRGQWAL-AWEZNQCLSA-N 439.428 2.111 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)CC2)cc1 732923059 KKOVETWQGBVLHT-FQEVSTJZSA-N 433.597 2.056 10 20 IECD CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCc2cc(OC)ccc2O)CC1 734072846 QGTAIFSTVZDIJY-UHFFFAOYSA-N 446.935 2.451 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 736376184 PUGLDPHHBJEGOE-QKPAOTATSA-N 427.542 2.156 10 20 IECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 741358750 MRIFSNDTEKFWID-LJQANCHMSA-N 432.565 2.332 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCNC(=O)[C@@H]3c3cccs3)cc2F)CC1 745807191 AAURFQKBCOBGOY-FQEVSTJZSA-N 445.564 2.412 10 20 IECD COC(=O)c1cc(NC(=O)CN2CCOc3cc(N(C)C)ccc32)cc(C(=O)OC)c1 746492290 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20 IECD O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NCc1cccc(Br)c1O 765752270 WBHSDLDTUIYWAW-UHFFFAOYSA-N 447.333 2.295 10 20 IECD C[C@@H](NC(=O)c1nccc2c(S(N)(=O)=O)cccc12)c1ccc(N2CCOCC2)cc1 768481403 NIUKUVNSQVHLAF-OAHLLOKOSA-N 440.525 2.210 10 20 IECD Cc1noc(C)c1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 774176093 BUTQFBLULWJETG-KBPBESRZSA-N 432.496 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nn(C)c4ccccc34)CC2)cc1 774655136 BIAUEVICSGDDOI-VAWYXSNFSA-N 447.539 2.146 10 20 IECD O=C(N[C@H]1CN(c2ccccc2)C1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 782876092 JGDFBFAIXVMYAY-INIZCTEOSA-N 443.506 2.400 10 20 IECD Cc1cccc(N2CCN(CCCNC(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 785424806 VIRYZKVQAHXQCJ-UHFFFAOYSA-N 437.588 2.006 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@@H](CC(C)C)C3)CC2)cc1 785529239 WCMBTHUXIIQXTB-FQEVSTJZSA-N 430.593 2.218 10 20 IECD COc1ncccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787280318 MWSMABSIOMAEDY-OAHLLOKOSA-N 434.443 2.093 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1 788013651 ICEQMIVIFIAZLI-FQEVSTJZSA-N 438.572 2.458 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 788773557 BEMHBNOUQYIJNU-QGZVFWFLSA-N 428.499 2.490 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 789813271 RLBTUJWLPFWHQV-DENIHFKCSA-N 441.503 2.173 10 20 IECD COc1cc(N2CCN(C(=O)c3cnnn3-c3cccc(F)c3)CC2)cc(OC)c1OC 790023026 BXDOWBIUALUODK-UHFFFAOYSA-N 441.463 2.395 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn(C(C)(C)C)nn3)cc2F)C[C@@H](C)O1 791636712 GJXGSPPDHKWKLS-GASCZTMLSA-N 447.511 2.259 10 20 IECD O=C(CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)NC1CCCCC1 793763558 ZUTKJDNURFKUNA-UHFFFAOYSA-N 427.501 2.469 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 800839398 FMPRJCFUGOHIAS-UHFFFAOYSA-N 429.476 2.132 10 20 IECD COc1ccc(C2=NO[C@H](CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1C 801370506 PKSKYXXZNLSAQQ-HNNXBMFYSA-N 433.486 2.004 10 20 IECD CC(C)(C)OC(=O)N1CCC(C(=O)OCC(=O)c2ccc(O)c(O)c2)(n2cccn2)CC1 803619566 GYJHBVYYYHKVCK-UHFFFAOYSA-N 445.472 2.447 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCN(C(=O)C(C)C)CC3)cc2)CC1 805025908 ZWBCQJHDWWEFEO-UHFFFAOYSA-N 428.577 2.256 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1F 806878739 OOGNIHZJJIGANI-UHFFFAOYSA-N 431.443 2.205 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(O[C@H]2CCOC2)c1 807100355 JZXTUZVNFLDTJL-NRFANRHFSA-N 425.529 2.470 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 807100398 MGCXOMAJSOBDHJ-JOCHJYFZSA-N 440.613 2.411 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CNC(N)=O)C3)cc2Cl)C1 807953996 DWCKRMNVPFWEPZ-NVXWUHKLSA-N 449.983 2.099 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 808816330 OKVNPHOYAGKCKQ-LJQANCHMSA-N 445.585 2.470 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 809232832 UBRJYDRRIYCNRM-QSIMJKBBSA-N 436.574 2.096 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@@H](C4CCC4)C3)CC2)cc1 817041744 KDPVDSMJSGRPFK-QJRAZLAKSA-N 427.545 2.175 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)n2)o1 906485568 KHJZJHWKGLQOGK-UHFFFAOYSA-N 448.482 2.285 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1Cl 917833005 KDZDUPYEDUCYDA-INIZCTEOSA-N 449.960 2.375 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)C1 917834249 HFEVBVGWNQQFIZ-KRWDZBQOSA-N 425.489 2.415 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 918439605 NUPVVLVWPBXRPL-UHFFFAOYSA-N 445.491 2.449 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccnc3N(C)C)cc2F)C[C@@H](C)O1 919139108 ACMQXQCQJBVLKP-HZPDHXFCSA-N 444.507 2.374 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 920436956 HECNZMPGVIBLHU-UHFFFAOYSA-N 434.518 2.426 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N3CCC(C(=O)N4CCCC4)CC3)CC2)cc1 1323178093 RLFPXTGKGBUULP-UHFFFAOYSA-N 428.577 2.068 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccoc1Cl 1780257733 MDUAUZFAHGTLNP-JLTOFOAXSA-N 435.864 2.181 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)cn1 1790241993 CGDUPOZHWNRFIY-QOKNQOGYSA-N 445.903 2.362 10 20 IECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cs1 1795283267 WOMNESJRWQSQJR-ACHSLPGTSA-N 437.525 2.496 10 20 IECD C[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CC1(F)F 1804149944 LWARNGIBWGYODB-CRKCHWSSSA-N 430.455 2.463 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cncc(F)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807989789 CZMSEZDKUBSGFW-XOBRGWDASA-N 437.431 2.055 10 20 IECD CC1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817843183 GTOCDIJNXHVYMP-QGZVFWFLSA-N 442.520 2.254 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C=CCN2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293435 LOQOCWKPQKDPNE-DZGCQCFKSA-N 431.880 2.308 10 20 IECD Cn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)c1 1832898712 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10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)cc2F)C[C@@H](C)O1 732572309 SNUIBUWFGNOIHZ-XJKCOSOUSA-N 446.445 2.402 10 20 IECD O=S(=O)(Nc1ccc(NS(=O)(=O)N2CCCC2)cc1)c1ccc2c(c1)OCCO2 742026166 MOVANVCOJALSTK-UHFFFAOYSA-N 439.515 2.011 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1sccc1S(=O)(=O)N1CCOCC1 743715706 CLSGQLOCCQDVBB-UHFFFAOYSA-N 436.555 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)CN(CCN3CCOCC3)c3ccccc3)CC2)cc1 746463743 UGJFOEHMVYNLEN-UHFFFAOYSA-N 438.572 2.183 10 20 IECD COc1ccc(N2CCN(CCN[C@@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 749130751 ZJCFTBQGSUKTCC-IBGZPJMESA-N 446.617 2.418 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4sc5c(c4c3=O)CCC5)CC2)cc1 758195209 SWMFBYZVFGYXLO-KRWDZBQOSA-N 440.569 2.138 10 20 IECD COCCNc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 762653001 BXLRMCONTWWNBL-HXUWFJFHSA-N 439.560 2.446 10 20 IECD O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)cc1 765041847 RDJLPTPFGBKGHH-UHFFFAOYSA-N 436.556 2.268 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3c(C)noc3C3CC3)cc2F)CC1 768145597 SDQFDJYWSXKLCH-UHFFFAOYSA-N 429.496 2.396 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccnn1CC1CC1 769021346 GYANIWLWCQNMHM-UHFFFAOYSA-N 436.560 2.080 10 20 IECD O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 776434743 MOGJQMJYCBKZAE-UHFFFAOYSA-N 440.499 2.066 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(CC(C)C)nn3C)CC2)cc1 778252889 VHDWZHKNESKFLP-KTKRTIGZSA-N 425.533 2.471 10 20 IECD CCC[C@@]1(C)C(=O)NCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783871912 DNXVAZFTSCKZEQ-IBGZPJMESA-N 437.543 2.385 10 20 IECD CSCC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nnc2ccccn12 785426446 ZHHVQHZKEFTGPK-KRWDZBQOSA-N 426.546 2.022 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cc(F)ccc1N1CCC(O)CC1 785438949 IPDCGYQRMHFPSS-INIZCTEOSA-N 442.535 2.346 10 20 IECD CCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786689973 LHZFMUSCCAKFNH-UHFFFAOYSA-N 429.492 2.118 10 20 IECD CCCOc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788324917 ZRWPPPSNXFBPAX-UHFFFAOYSA-N 425.529 2.287 10 20 IECD O=C(N[C@@H]1CCN2CCC[C@H]2C1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788571091 JHGDYQMAGDJQRH-NUJGCVRESA-N 436.503 2.116 10 20 IECD Cc1cc(C(=O)CN2C[C@H](O)Cc3ccccc32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 789354109 OPHANEKRHYKTND-LJQANCHMSA-N 439.537 2.348 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCN(C2CCC2)C1 789813279 RNRFLPRSJRYOLJ-PKOBYXMFSA-N 446.567 2.048 10 20 IECD CC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789950811 QSSCPOSBHQOKPX-HXUWFJFHSA-N 443.466 2.186 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1Cl 791340731 RPGWNDNSDDCFJN-IBGZPJMESA-N 430.936 2.429 10 20 IECD COc1c(C)cnc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 803296567 DXOYZJYPAZRSPF-QGZVFWFLSA-N 426.517 2.037 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@@H]3C[C@H](C)O)CC2)cc1 804449364 YYRVCTVVWJPPOB-RTIYCVIDSA-N 429.561 2.442 10 20 IECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NCc1ccc(N3CCSCC3)cc1)C2 804970293 WKVCCOFGVMIGOF-SFTDATJTSA-N 445.633 2.123 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC3(S(C)(=O)=O)CCCC3)cc2F)CC1 805840955 ZJCVHVWBHFYTDR-UHFFFAOYSA-N 440.585 2.124 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccn(-c2ncccc2F)n1 807385562 MXGQVVBUICRPFS-UHFFFAOYSA-N 434.225 2.129 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387827 ZALMVZCUIQQZES-UHFFFAOYSA-N 437.246 2.205 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807511858 YMASOPLUEIFKGH-UHFFFAOYSA-N 431.297 2.499 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769766 VOKXYPJLIBLKFI-KRWDZBQOSA-N 440.535 2.419 10 20 IECD CC(=O)C(=O)COC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 808542769 TWVSJPIQKMAEKD-UHFFFAOYSA-N 440.817 2.364 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)CC2)cc1 917209978 HXOXFABSSQPNQR-UHFFFAOYSA-N 428.445 2.483 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(N2CCCS2(=O)=O)cc1 917709699 VZTCPUCHDJEBRR-UHFFFAOYSA-N 433.505 2.132 10 20 IECD O=C(CC1CCC1)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823433778 OYDVPJRGJZSLKT-CQSZACIVSA-N 435.575 2.452 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1 1832316964 FNUZHDBJVZDYOI-LJQANCHMSA-N 440.500 2.069 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(F)nc1F 1847183530 LFAWTFBMJHFWAI-VMSBINOKSA-N 431.395 2.005 10 20 IECD COC(=O)NCCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733542210 DFYGCVWAQDMURH-ZDUSSCGKSA-N 438.436 2.468 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(I)c2)c1 734072733 PUYPJNCUYSNSSS-UHFFFAOYSA-N 426.210 2.260 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4ncsc4c3)CC2)cc1 743433009 UYLRDHDISKVWPO-UHFFFAOYSA-N 439.541 2.182 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3cccc4ccccc34)cs2)c(=O)n(C)c1=O 748674225 QNNKSJJUYODIHS-UHFFFAOYSA-N 428.495 2.162 10 20 IECD Cc1cc(C(=O)COC(=O)CC[C@@H]2CCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 751708854 JOLKLEGXBHLLDH-MRXNPFEDSA-N 434.514 2.284 10 20 IECD Cc1c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 752154042 IFMDOUIEUOSKJY-HNNXBMFYSA-N 449.485 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cn4cccc(C)c4n3)CC2)cc1 752191709 PXVZHSJLEGLIMI-PMERELPUSA-N 426.542 2.249 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCNS(=O)(=O)/C=C\c1ccccc1 752809252 RGGSXSQYCJQFOU-PDGQHHTCSA-N 443.569 2.462 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3ncccc3F)CC2)c1 761298216 HEVAFHDMWUVCHF-UHFFFAOYSA-N 428.508 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(NC(N)=O)c4)n3)CC2)cc1 771081386 GMRGZWVYPYYRAB-UHFFFAOYSA-N 436.472 2.127 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773617334 DDUBDELLGCPCSC-CABCVRRESA-N 447.561 2.048 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)N(C)C 773844885 DLSOVRVMUVWPHJ-HNNXBMFYSA-N 432.546 2.127 10 20 IECD CCNC(=O)CN1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775649473 SCTWLVLIFLRQFB-UHFFFAOYSA-N 435.160 2.171 10 20 IECD CN(C)[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 780094993 UYGXERQEQLONAN-QFIPXVFZSA-N 429.492 2.125 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 783329810 XRRQVUYPKWDQOV-UHFFFAOYSA-N 446.573 2.379 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)cc2)CC1 786660115 WBKFRDBKHLFNCM-NCXUSEDFSA-N 425.451 2.327 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N(C)c1ccccc1 787642143 VMKUVCXMGWCSAN-GOSISDBHSA-N 426.586 2.497 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccsc1 787655799 RKXDCJNCLAHZFI-RTBURBONSA-N 431.558 2.380 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@]2(CCO[C@H](C)C2)O1 789862548 VSBQUXDNAVVHSM-STSQHVNTSA-N 447.601 2.041 10 20 IECD CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734020 OWMHJAHISBQEGF-GIVPXCGWSA-N 428.577 2.336 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806847176 IVJKXXMCCCEGGT-UHFFFAOYSA-N 439.438 2.181 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@H](c2ccccn2)C1 808853673 BCXWMIYWZOYLFY-QFIPXVFZSA-N 447.583 2.246 10 20 IECD COc1ccc(N2C[C@@H](C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2=O)cc1 913320718 BWFXYHXVXFVCFP-SFHVURJKSA-N 439.512 2.316 10 20 IECD O=C(CN1CCN(C[C@H]2CCCO2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 916150083 SVYAVGFUWYODDT-GOSISDBHSA-N 433.508 2.197 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918029748 RLTOOPAPJSFTSR-QGZVFWFLSA-N 444.557 2.422 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(=O)(=O)NC2CC2)cc1 918138840 XYTMCYGXSUSCSA-UHFFFAOYSA-N 433.505 2.033 10 20 IECD NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 918213372 BNBNYECJRHGCJB-CQSZACIVSA-N 443.470 2.132 10 20 IECD COc1cccc(/C=C(/C(=O)NCc2ccc(N3CCOCC3)cc2)n2nnnc2C)c1 919860329 UOYKUPDBQRVCPA-JCMHNJIXSA-N 434.500 2.141 10 20 IECD COc1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 920786215 HSDAJCADBXITQZ-OAHLLOKOSA-N 444.919 2.305 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(F)cn1 1805985137 YGJHHRUXYWMSQK-XOBRGWDASA-N 437.431 2.055 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807996135 YRDWHYNNETZAGU-KKVAFCGZSA-N 428.489 2.021 10 20 IECD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cs1 1816722709 VFFSGDFANQZZTJ-JTQLQIEISA-N 431.499 2.254 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cn3ccccc3n2)[nH]n1)c1cc(O)nc(O)c1 1817845406 MBHWPIXMRPWTMQ-INIZCTEOSA-N 447.455 2.483 10 20 IECD Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426888 MEYLTDDUYSNLEG-SFHVURJKSA-N 425.489 2.138 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnc(O)nc3O)C2)cc1 1843352818 ATKCHXFNJZAHNQ-UHFFFAOYSA-N 447.495 2.426 10 20 IECD N[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1cccnc1 1845501033 RJDCXTRTARUAPR-MRXNPFEDSA-N 430.892 2.053 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccnc(N4CCN(C)CC4)c3)CC2)cc1 110460912 BONODLQMTYBLAT-UHFFFAOYSA-N 438.576 2.310 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C(=O)N3CCCC[C@H]3C)CC2)cc1 726616486 MWCNWSLRLYIYLN-WOJBJXKFSA-N 445.608 2.296 10 20 IECD CC(=O)Nc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1F 738888898 HPYAYJGGWKHLOZ-UHFFFAOYSA-N 434.493 2.341 10 20 IECD COC(=O)NC(C)(C)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 744962152 WVBZECGVTVPSTF-LBPRGKRZSA-N 438.436 2.467 10 20 IECD CC(C)(C)n1ccnc1SCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749571544 HIZJFMFRCWWDCS-UHFFFAOYSA-N 436.603 2.281 10 20 IECD C[C@H]1[C@H](C)CCN1CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 752318197 IGHPWDGSVWFAGU-PJHVSOERSA-N 447.582 2.463 10 20 IECD COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754068183 RZSIIGZJESWWEW-GGAORHGYSA-N 427.545 2.024 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(-c4cccnc4)n3C)CC2)cc1 758198429 VYRFNBZQDUVZON-IBGZPJMESA-N 440.573 2.161 10 20 IECD COc1cc(N2CCN(C(=O)Nc3nc4nc(C)cc(C)n4n3)CC2)cc(OC)c1OC 759198445 GHPZYULOZQGJJI-UHFFFAOYSA-N 441.492 2.121 10 20 IECD CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 760106638 CXEDKKUQASSGPG-UHFFFAOYSA-N 431.489 2.001 10 20 IECD Cn1cc(-n2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc2=O)cn1 760917150 ARGZKXLUTUGQLH-GOSISDBHSA-N 441.919 2.324 10 20 IECD COc1ccc2c(c1)CCCN2CN1C(=O)N[C@](C)(c2ccc(S(C)(=O)=O)cc2)C1=O 766342627 VBVRYXCNPGHQJF-JOCHJYFZSA-N 443.525 2.276 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]4[C@@H](CCCN4C)C3)CC2)cc1 766845890 MHPVKAYGMSAVCP-REWPJTCUSA-N 429.609 2.333 10 20 IECD COc1cc(N2CCN(CC(=O)N3CCc4ccccc43)CC2)c([N+](=O)[O-])cc1OC 766931980 NZKVCOQAYPIION-UHFFFAOYSA-N 426.473 2.323 10 20 IECD Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 768443984 KKVDHRXVBFZYDY-IIBYNOLFSA-N 432.542 2.317 10 20 IECD CC[C@@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 776040028 ZNYMIHFMZPJWEX-CRAIPNDOSA-N 440.548 2.119 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 779489502 PYJZXUATNTWBAN-UITAMQMPSA-N 428.510 2.133 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCCCCN2CCOCC2)cc1)C1CCCCC1 787893041 BMGNDVROMLDSNV-UHFFFAOYSA-N 430.593 2.300 10 20 IECD CO[C@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1(C)C 789816105 BUSJNEQVSIUJAP-PTLSTEMOSA-N 435.540 2.375 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccc(O)c3)cc2F)C[C@@H](C)O1 789824538 IRZKXTQXQUEPKX-HZPDHXFCSA-N 429.492 2.420 10 20 IECD COCc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 806844476 YGDHZUQUEFPMTD-CHWSQXEVSA-N 436.509 2.297 10 20 IECD C[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CN1C1CC1 807770559 MOQGTUYYTHWHQB-OAGGEKHMSA-N 436.503 2.114 10 20 IECD O=C(Cn1cnc2cc(Cl)ccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 917202739 SEETTYCFYNLWBQ-UHFFFAOYSA-N 430.867 2.342 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCc1ccc(N2CCSCC2)cc1 917386181 RDEHCVPXSJUDBA-UHFFFAOYSA-N 437.562 2.364 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc(O)c4ccccc4n3)cc2)C1 917832228 OUMRHPDWLAELPD-KRWDZBQOSA-N 433.512 2.286 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1Cl 920926445 OGHRYHSEHNJRQF-AWEZNQCLSA-N 444.919 2.352 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC1)C2 1783220306 XBXFRLIGBLRWMA-TVFRQAABSA-N 430.501 2.131 10 20 IECD O=C(CCc1ccsc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804333659 ODFRWDVRVCAVFM-QDMKHBRRSA-N 437.612 2.179 10 20 IECD COc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)n1 1807875468 INHCWPHQFHNHJX-UHFFFAOYSA-N 426.473 2.055 10 20 IECD C[C@H](CN)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811804309 UZFCCWDLONETGC-RVZJWNSFSA-N 432.908 2.061 10 20 IECD CC(C)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825146822 UPCSGNXAZQXCGB-LLVKDONJSA-N 440.616 2.352 10 20 IECD COc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825901855 MZDNJWWRMOQVLY-GOSISDBHSA-N 440.500 2.444 10 20 IECD CC[C@@H](NC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1827043349 JXESYUUHQZWJOV-MWGMDKCCSA-N 445.560 2.434 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O)c1ccc(N2CCOCC2)cc1 109180429 OGGMBSBGTKJRST-DGGJZMOXSA-N 428.533 2.201 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNC(=O)c1c(F)cccc1Cl 731079685 NRHYDIRLBJUXRD-UHFFFAOYSA-N 435.883 2.477 10 20 IECD CCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1=O 735520355 YRVQOJQETOCCQP-SFHVURJKSA-N 437.496 2.097 10 20 IECD O=C(CN1CCN(C[C@H]2CCOC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749853384 YPVDWBXFPVUCKS-QGZVFWFLSA-N 433.508 2.055 10 20 IECD Cn1cnc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)c1 751267888 OYPUVUFWPRRBEY-UHFFFAOYSA-N 428.442 2.300 10 20 IECD CCN(CCS(C)(=O)=O)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753204614 VRVBWADVJJNDJF-CQSZACIVSA-N 428.510 2.156 10 20 IECD CCCCS(=O)(=O)N1CCC(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753738999 WNSMQVLGDQEIER-UHFFFAOYSA-N 441.569 2.325 10 20 IECD CCc1nn(C)c(CC)c1S(=O)(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 753983794 MJPOCGCBOMQYSP-UHFFFAOYSA-N 449.621 2.044 10 20 IECD C[C@@H](OC(=O)c1cccc(=O)n1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 757736670 GLBBPKKKVLGEMN-CYBMUJFWSA-N 430.416 2.345 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cccn(CCS(C)(=O)=O)c3=O)ccc21 760766449 KUPBFDVPYUWBJP-UHFFFAOYSA-N 445.541 2.363 10 20 IECD Cc1cc(C(=O)COC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c(C)n1-c1ccccc1 762385786 VNGYANNDGDFNGY-UHFFFAOYSA-N 439.493 2.318 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NCc3cccc(Br)c3O)nc2)CC1 764935385 SOTDDKMHFZCVNR-UHFFFAOYSA-N 441.351 2.098 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)CC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 768521263 GKSBQVJLWXRZRU-IYBDPMFKSA-N 431.508 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(CCCC(C)(C)C4)C3=O)CC2)cc1F 768569498 AJVYUFIUAUAXKE-QHCPKHFHSA-N 446.523 2.374 10 20 IECD COc1ccc(CCN2C[C@H](C(=O)NCc3cccc(OC)c3O)CC2=O)cc1OC 769503972 RGWWMHBHYPJHKD-QGZVFWFLSA-N 428.485 2.125 10 20 IECD CCN1C(=O)[C@H]2CN(Cc3cc(Br)cc(Br)c3O)CCN2C1=O 775736263 QVLWIXPTNQPRNL-GFCCVEGCSA-N 447.127 2.386 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(C)c1 778560153 MSDMNRYCROTAAU-UHFFFAOYSA-N 430.504 2.499 10 20 IECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)c1 780300815 KLOLAQJFTFFUIY-UHFFFAOYSA-N 431.464 2.186 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCN1CCCCC1 785518258 SLNBPBFKKBVDBR-UHFFFAOYSA-N 426.355 2.495 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Cc1ccccc1 785525140 SKFORHZJGBFMSO-UHFFFAOYSA-N 440.613 2.494 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cnn(-c4ccccc4)c3)CC2)cc1 785969467 IBWFJGKQGMAJCC-UHFFFAOYSA-N 433.512 2.236 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)[C@H](C)N4C)cc2)CC1 786258524 YXWOTRVZAVSWNT-INIZCTEOSA-N 435.528 2.062 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2cccnc2N2CCOCC2)cc1 787283211 HLMTYULFKVBOEJ-UHFFFAOYSA-N 439.560 2.039 10 20 IECD COC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789948566 CWPHMSCBIGJTNE-OAHLLOKOSA-N 443.466 2.043 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccccc1-n1ccnc1)c1ccc(N2CCOCC2)cc1 793716525 DYGYUACMCOFNPJ-SFHVURJKSA-N 433.512 2.203 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2O[C@H](C)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 800302769 BMXVHBSHCRSHDJ-KBARZSOFSA-N 434.514 2.281 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C3CCN(S(N)(=O)=O)CC3)cc2Cl)C1 800571587 KRLNEKZMLGTBLK-CQSZACIVSA-N 428.986 2.108 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2Br)cc1 801686959 YDCACGCADUMRFU-UHFFFAOYSA-N 447.376 2.397 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687534 FPUSSKJPUUSYDM-FQEVSTJZSA-N 449.599 2.012 10 20 IECD CCO[C@@H]1COCC[C@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 807121341 CNKODNAJZVQDMI-NHCUHLMSSA-N 429.517 2.185 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)nc1 807290780 OFEMTYHOAYQOKF-FQEVSTJZSA-N 447.539 2.260 10 20 IECD COCc1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc(C(=O)OC)c1 815526676 BIGIUEJBHIRBCG-UHFFFAOYSA-N 426.469 2.459 10 20 IECD CC(C)COC[C@@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916514695 ZIDJJVMUXQBIDT-KRWDZBQOSA-N 433.471 2.375 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1C 918456875 WGVYCMRHOFGJRU-UHFFFAOYSA-N 444.557 2.099 10 20 IECD COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1NC(C)=O 920924796 FVFFSCBSWYGPOQ-OAHLLOKOSA-N 440.500 2.306 10 20 IECD O=C(O)[C@H](Cc1cn(-c2ccccc2)nn1)NCc1ccc(N2CCOCC2)c(F)c1 1116780523 QTLOADICJZFUCO-FQEVSTJZSA-N 425.464 2.029 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 1342915940 NJMIPIPDJPPGIS-PMPSAXMXSA-N 436.505 2.382 10 20 IECD Cc1ccc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc2c1 1777740348 UJKQCDKIWZYCTN-HSZRJFAPSA-N 436.468 2.040 10 20 IECD C/C(=C/C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1)C(=O)O 1792315383 IVXBXHITWFLQQW-XFXZXTDPSA-N 447.538 2.012 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc2c(c1)OCO2)c1cc(O)nc(O)c1 1795743097 NWEZZRUZZNHCCL-BJWYYQGGSA-N 439.468 2.106 10 20 IECD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)c1ccc(Cl)cc1 1796136525 GDBQICYBPLOFAJ-NZNSQFJMSA-N 445.903 2.153 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718490 ZXHBJWUWSHGLDF-MHEUCROKSA-N 437.924 2.308 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1807993983 BLEULKJOBSXRBM-DNVCBOLYSA-N 437.456 2.126 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3ccon3)C2)CC1 1808738536 WSFYCYSFZNXOIH-HWKANZROSA-N 427.457 2.350 10 20 IECD CCc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1842357053 QFDFXOJSKRURDC-UHFFFAOYSA-N 431.496 2.254 10 20 IECD CC(C)c1nn2ccccc2c1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843220200 GDGOTLTWZWJIGV-UHFFFAOYSA-N 435.484 2.395 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc3c(n2)OCCO3)C1 1843313869 SFCNMDGMOFEMAN-UHFFFAOYSA-N 445.859 2.048 10 20 IECD Cc1nc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cs1 1847034057 YDEGUEMCHHMXFN-GQCTYLIASA-N 429.498 2.028 10 20 IECD CCn1c(COC(=O)c2ccc(C)c(O)c2O)nc2cc(S(=O)(=O)N(C)C)ccc21 110522986 HEQIEMOCKQZDLJ-UHFFFAOYSA-N 433.486 2.383 10 20 IECD Cc1c(CNC(=O)C(=O)NCCCS(=O)(=O)c2ccccc2)n(C)c2ccccc12 557083653 FUVTZMGARFDGIE-UHFFFAOYSA-N 427.526 2.083 10 20 IECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 726244241 BRDDMYFXPXLPLP-QWFCFKBJSA-N 432.565 2.157 10 20 IECD CO[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 728130289 XLCKMCFGRFICEJ-SFHVURJKSA-N 428.512 2.263 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 728301641 JPJQULYIZZMDRB-UHFFFAOYSA-N 426.473 2.210 10 20 IECD C[C@@H](OC(=O)CN(C)C(=O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733513269 DALKIPCUUPREJF-CYBMUJFWSA-N 434.448 2.201 10 20 IECD CN(C)CCOc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738899039 ISPMNPNKTBXMSW-UHFFFAOYSA-N 446.573 2.184 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(C(=O)Nc3cccnc3)cc2)c1 748332622 YNLBPGYRCZNOIJ-UHFFFAOYSA-N 440.481 2.341 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4cccs4)CC3)CC2)cc1 754008871 IEPLEYNFOBKBHH-OAQYLSRUSA-N 430.618 2.057 10 20 IECD CCOC(=O)c1cccc(OC[C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755303576 KCDNKCVDWVMKDJ-OAQYLSRUSA-N 442.512 2.351 10 20 IECD COC(=O)C12CCC(C(=O)NCCCN3CCN(c4ccc(OC)cc4)CC3)(CC1)C2 757876467 ZIQFURDHMZEGLL-UHFFFAOYSA-N 429.561 2.447 10 20 IECD CC(C)Oc1ccc(N(C)CC(=O)c2c(N)n(Cc3ccccc3)c(=O)n(C)c2=O)cc1 759928802 RUWGCDWUJPHZRD-UHFFFAOYSA-N 436.512 2.284 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(-n4cnnn4)cc3)CC2)cc(OC)c1OC 759933108 CGEWIIDCYBHEHV-UHFFFAOYSA-N 439.476 2.042 10 20 IECD Cc1noc(C)c1CN(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774254875 WYEDLZADSVFKTK-UHFFFAOYSA-N 439.560 2.098 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 774750255 CFDSGHCPWKDQSL-UHFFFAOYSA-N 428.508 2.244 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccs1 774862205 WGTWASNSQBZEAQ-ROUUACIJSA-N 431.558 2.380 10 20 IECD COc1nc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)ncc1Br 779527231 DJNUDEJWQJFONE-HWKANZROSA-N 435.278 2.021 10 20 IECD CCO[C@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 780417890 YTTTUPVIRRIHFQ-NZQKXSOJSA-N 436.572 2.333 10 20 IECD C[C@@H]1CN(CC(C)(C)O)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781942146 WQITYIIYUOMYQY-MRXNPFEDSA-N 435.524 2.178 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NCCCSc3nccs3)c2)CC1 782115632 SKYJKHRFTZHPHP-UHFFFAOYSA-N 447.586 2.049 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](O)Cc3ccccc3Cl)CC2)cc1 785730206 NQMBPJCYVCSKQB-FQEVSTJZSA-N 432.904 2.144 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccsc3)N(C)C)CC2)cc1 787656923 WAGPNVQKBMDGGT-HXUWFJFHSA-N 430.574 2.215 10 20 IECD CC(C)(C)c1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 789381374 CXNMMAMVFUYOEM-HNNXBMFYSA-N 443.573 2.397 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)N(C)C)cc1 793716382 AZFKCNHWACKQDS-XXBNENTESA-N 438.572 2.428 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3nc(-c4cccs4)no3)CC2)cc1 796100073 PNILMBHZWJRDOD-SFHVURJKSA-N 443.573 2.422 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3cnccc3=O)c2C)cc1 796330575 QNMUJDUJGZIQRO-UHFFFAOYSA-N 437.452 2.254 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccn(-c2ccccc2)n1 804106138 HWDGPDYXZJVQFA-UHFFFAOYSA-N 447.539 2.026 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccn(CC(F)F)n4)n3)CC2)cc1 809465073 QRBPXVFIKXMRKV-UHFFFAOYSA-N 432.431 2.098 10 20 IECD COCCN1C(=O)/C(=C\Nc2ccnn2Cc2ccc(C(C)(C)C)cc2)C(=O)NC1=S 814316620 DSFSDOHICWUMKC-LGMDPLHJSA-N 441.557 2.414 10 20 IECD CCOc1ccccc1N1C(=O)C(=O)N(CN2CCN(c3ccc(OC)cc3)CC2)C1=O 818201037 NDSYKELGJXIEFW-UHFFFAOYSA-N 438.484 2.169 10 20 IECD C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 818641776 WJPNAIZUFYYMNB-SCLBCKFNSA-N 449.504 2.385 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 1256244944 NLWHNDVBDABAQE-UHFFFAOYSA-N 439.484 2.363 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cc(Cl)ccn3)cc2F)CC1 1326910554 LHVGQAUPSORTEU-UHFFFAOYSA-N 433.915 2.062 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(Br)c(OC)c1 1343481668 RUQHNSGQPVUQFT-LBPRGKRZSA-N 439.262 2.168 10 20 IECD O=C(Cc1ccsc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795830734 JCWNHNJODDYDQN-ZSBFGKGUSA-N 436.917 2.259 10 20 IECD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc2c1OCCO2 1796600658 XOOHAVBNXMSCTN-MUJYYYPQSA-N 439.468 2.138 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H]1CCC[C@H]2CCCC[C@H]21 1797258137 VWLREXMFLRZDQR-NLWWWPPXSA-N 443.544 2.303 10 20 IECD O=C(c1cnnc(Cl)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547382 MSOPPRKDFFDANP-UHFFFAOYSA-N 431.880 2.095 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843465 PJGIYEQVFLBBSQ-HNNXBMFYSA-N 439.476 2.186 10 20 IECD O=C(Cn1nccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1820989571 YZSDXWYATKVCJZ-AWEZNQCLSA-N 445.867 2.072 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c(O)n1 1829734570 CPWPXCLYWOHVAO-GOSISDBHSA-N 440.500 2.449 10 20 IECD O=C(c1cn2ccsc2n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037209 FYTAIEKAUYTIND-HWKANZROSA-N 440.481 2.043 10 20 IECD CCOCCN1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 729995191 RIHNDLXEVVYNDK-KRWDZBQOSA-N 435.524 2.443 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCn3cnc4ccccc4c3=O)cc2F)CC1 730194961 STKBBKOESXZLQF-UHFFFAOYSA-N 437.519 2.384 10 20 IECD CC1CCN(c2ccc(CNC(=O)Cn3cc(Br)c(O)nc3=O)cc2)CC1 731015586 XEFOBMAZSYFQJA-UHFFFAOYSA-N 435.322 2.264 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCn1cc([N+](=O)[O-])cn1)c2[N+](=O)[O-] 748102372 HADLYCQDLPLXMS-UHFFFAOYSA-N 436.336 2.332 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C(F)(F)C3(O)CCC3)cc2F)C[C@H](C)O1 753417806 NTNHCNQGPKOENK-KBPBESRZSA-N 444.450 2.149 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC(S(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 760745417 VRTWCYROBYBZNT-HUUCEWRRSA-N 427.542 2.158 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](S(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 763640344 GIWLBAGPQUVLRV-BFYDXBDKSA-N 427.542 2.158 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3cccc(F)c3)C(=O)C2)c1 764952369 ZTGUYEOIGFDOTO-UHFFFAOYSA-N 441.503 2.415 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1OC 773249953 UWYRFLZSGUDFMF-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CCn1c(O)nc2cc(C(=O)N(CC(=O)OC)Cc3cc(Cl)ccc3O)ccc2c1=O 777829377 VEHKLMUQTNEQDF-UHFFFAOYSA-N 445.859 2.296 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1SCCc2ccccc21 788312111 CUGBQNUVNCYCMS-OAQYLSRUSA-N 425.554 2.286 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)c(O)c1 797388469 ZOOQDRDGGRMTJG-IYBDPMFKSA-N 427.501 2.265 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cn1 800148726 QRYSWFFIWKXVAM-CQSZACIVSA-N 440.953 2.424 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](Cn3ccccc3=O)c3ccccc3)nc12 800505036 HUCNERCEAPUPDO-LJQANCHMSA-N 433.468 2.304 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 803135708 PDADZHKDEGOHDX-MRXNPFEDSA-N 436.528 2.271 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)Cc3ccc(C)s3)CC2)cc1 803747599 RPVFKZGQRVYBIW-KRWDZBQOSA-N 444.601 2.051 10 20 IECD C[C@H]1COCC[C@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977729 XSJORMYTWGLNBN-HKUYNNGSSA-N 442.539 2.414 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCSc1nccs1 806279408 NENOICPDTQXSKJ-UHFFFAOYSA-N 434.587 2.237 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)NCCCSc2nccs2)CC1 806280071 IXPSQEFZMHXIQD-ZDUSSCGKSA-N 428.580 2.115 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807512953 DIYWWTGQSRLJBO-UHFFFAOYSA-N 446.312 2.170 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1 808032454 XJOFIXIWXRPGLO-HKUYNNGSSA-N 432.565 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)CC2)cc1 809522555 GYJUJLFBDIKDNE-GUDVDZBRSA-N 435.615 2.230 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 810368651 CTDSGGBTTHOHAT-WOJBJXKFSA-N 428.533 2.397 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN(C2CCC2)C1 813594632 LJDLKGDOAOGMSU-ICSRJNTNSA-N 427.593 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@]4(CCCO4)[C@H]3C3CC3)CC2)cc1 819261430 MNUHPKDLYXNKKV-FIOVZVJTSA-N 425.529 2.070 10 20 IECD Cc1cc(C(=O)COC(=O)CN(C)S(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 914923309 FWWMNCVTQMRHAA-UHFFFAOYSA-N 444.456 2.313 10 20 IECD C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)C1 917126488 GBWKDMHVIZVHAL-ZDUSSCGKSA-N 431.543 2.103 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Nc3cnn(CC(=O)NC4CC4)c3)cc2F)C[C@@H](C)O1 918219662 MRNDBIGRMCPMJN-HUUCEWRRSA-N 444.511 2.236 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1 919895679 SCTNNAABKTYLIA-UHFFFAOYSA-N 428.558 2.379 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1319763259 VMJBHONIMSGDIE-NRFANRHFSA-N 436.556 2.497 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(N)=O)nc2)NC(=O)OC(C)(C)C)cc1 1330013066 OYXYRUBZKQMJLJ-SFHVURJKSA-N 427.505 2.242 10 20 IECD CN1CCN(c2ccc(CNCc3ccc(N4CCCS4(=O)=O)cc3)cc2F)CC1 1337962063 XUGZISCMJPYUBJ-UHFFFAOYSA-N 432.565 2.407 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCCN3Cc3cccnc3)nc12 1338740707 VNIZXFHKVBQEBX-GOSISDBHSA-N 439.472 2.105 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c([N+](=O)[O-])c1 1344750087 VJAPLFTXJFHRMF-UHFFFAOYSA-N 434.474 2.160 10 20 IECD CC(C)(O)CC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787847674 VNPIWLVXJIERIO-UHFFFAOYSA-N 435.571 2.142 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792221406 WOKHGWZVZPPNAU-WOHHUZNTSA-N 430.501 2.153 10 20 IECD Cc1onc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1C 1793820438 MXRYJHCJLFNSKA-SEDYWJOHSA-N 427.457 2.373 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCS1)C1=NN(c2ccccc2)C(=O)C1 1803321764 ZNJFNGOTMISJOX-RUENVJTFSA-N 426.542 2.313 10 20 IECD O=C(/C=C/c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804332186 QGVGNXGCLYYSKO-FTVYIWHSSA-N 429.567 2.198 10 20 IECD Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805496119 QKAQCHRHVSCADS-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2cccnc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993871 PAQVNWHYTOTOMO-GSBCXDHFSA-N 445.479 2.316 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994229 DTGFNPATYBHZBV-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccnc(Cl)n3)CC2)C1 1810547197 RTJOMDXPEMLXCO-UHFFFAOYSA-N 431.880 2.095 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3cncn3c2)[nH]n1)c1cc(O)nc(O)c1 1817846428 WYEOFVBYFSPCPR-KRWDZBQOSA-N 447.455 2.483 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@H]3COC[C@H]31)CC2)c1cc(O)c(O)c(Cl)c1 1823713490 NKNQWNUVKLQWBS-UDKBDQPSSA-N 449.916 2.326 10 20 IECD O=C1CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1830737940 ZLYADTOZIURBBH-IRXDYDNUSA-N 449.935 2.263 10 20 IECD CC[C@@H](NC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877534 PWHILTYBDHFJPS-MWGMDKCCSA-N 445.560 2.434 10 20 IECD CCC(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878150 FLASNKXFNLWOCB-UGAXZCSASA-N 430.501 2.415 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCCN3C(=O)NC4(CCCC4)C3=O)CC2)cc1 726609729 DWHJLRLLHPYKNO-UHFFFAOYSA-N 443.548 2.218 10 20 IECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 726976040 IAVUNVJPCLRGOP-UHFFFAOYSA-N 438.571 2.107 10 20 IECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333951 AZFJDBFZPMYUTR-YOEHRIQHSA-N 447.504 2.119 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CSc3ccc4c(c3)OCCO4)CC2)cc1 742911344 XJCRWNHKLVNFNA-UHFFFAOYSA-N 443.569 2.497 10 20 IECD CC(C)C[C@@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746950677 PALYZKPFDREXPP-GOSISDBHSA-N 430.528 2.149 10 20 IECD NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)C(=O)[C@@H]2C1 748692296 AJQSJNPUWLYMQB-KRWDZBQOSA-N 435.444 2.068 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(N(Cc3ccc(N(C)C)cc3)C3CC3)nc2)CC1 749271412 DKTZZECYBUUQOX-UHFFFAOYSA-N 429.590 2.253 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(N2CCCS2(=O)=O)cc1 756834891 DTKPAQKMOXERIN-UHFFFAOYSA-N 445.541 2.108 10 20 IECD COCCCOc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759221169 OTKHXFAVXVGGDM-UHFFFAOYSA-N 445.516 2.485 10 20 IECD COC(=O)COc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759242808 REDZESUECGTRFO-UHFFFAOYSA-N 444.484 2.227 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 767937698 RLVGWKXOLWVAEQ-FCHUYYIVSA-N 434.556 2.229 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3SCCS3)cc2F)C[C@H](C)O1 768585334 ZDIULWOXKWHLDE-STQMWFEESA-N 428.551 2.405 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1COCCN1CC(F)F 771623064 LHUUSILZJNTVMG-MRXNPFEDSA-N 437.409 2.124 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)cc2)C1 778245580 JSVYFJPGNCYEHV-CYBMUJFWSA-N 440.485 2.231 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781457757 OJNFLNMYKRUPGY-OAHLLOKOSA-N 441.484 2.134 10 20 IECD CN1CCC(N(C)[C@@H]2CCCC[C@@H]2N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785445898 ZYGCMONUYVQSFO-PKTZIBPZSA-N 443.636 2.164 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@H]4CCC[C@@H]43)CC2)cc1 785529114 LNKNNEKJNMGMJR-KNQAVFIVSA-N 428.577 2.115 10 20 IECD COc1cc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc(OC)c1OC 786659084 ICHUSJPRXFHZJC-UHFFFAOYSA-N 441.528 2.240 10 20 IECD COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 790068370 JZFFWEUDLPQODX-UHFFFAOYSA-N 428.850 2.255 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317315 ZQLZCXRNKKUJJR-GOSISDBHSA-N 429.517 2.137 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCc4cnn(C(C)C)c4C3)CC2)cc1 804317738 NVRWOYRHPVNDNR-LJQANCHMSA-N 439.560 2.231 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3nc(C)n(C)c3Br)CC2)cc1 804985757 FTNRYLYYMOPPLZ-UHFFFAOYSA-N 443.367 2.447 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ncccn3)cc2F)C[C@@H](C)O1 812603523 XZSKZWQJWVGJLJ-IYBDPMFKSA-N 430.480 2.022 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 918303289 AGRRWVADPYCFQC-UHFFFAOYSA-N 438.528 2.212 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1nccs1 1786193539 YGWHXXQWQRLSRI-WBIUFABUSA-N 437.905 2.115 10 20 IECD CCc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)co1 1798909843 WQGBZNZLLZEFEK-ACHSLPGTSA-N 435.484 2.282 10 20 IECD COc1cc(OC)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1799641376 ONYPEQUUFHMVQA-MUJYYYPQSA-N 427.457 2.076 10 20 IECD COCc1c[nH]c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804288854 NFRQYMRNYLSVKK-ZURAMSNBSA-N 441.484 2.243 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cnoc1C1CC1 1806136934 QJOXTVRNDLTHDY-QRWLVFNGSA-N 449.467 2.387 10 20 IECD CCOCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1826454860 OZLYEOPBOBXVAH-OAQYLSRUSA-N 440.544 2.436 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)ncn2)CC1 1829465537 CZENYTXGWXILCH-MRXNPFEDSA-N 445.907 2.483 10 20 IECD CN(C)c1ccc(CNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 18215169 HCCKVNAXEJNHCH-UHFFFAOYSA-N 431.558 2.023 10 20 IECD CCn1nc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccc1=O 732369652 HYFDNEXHSFYZNH-ZDUSSCGKSA-N 445.431 2.223 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 738929100 UDGSVCVUPYBLKP-UHFFFAOYSA-N 431.514 2.338 10 20 IECD CC(C)(C)OC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 746759108 OKXGCUSTEAHZRV-LJQANCHMSA-N 437.512 2.039 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)C1 749178600 MJZLGBFQSSZIGZ-VXKWHMMOSA-N 435.572 2.312 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCc2n[nH]cc2C1 756940555 NTKKVRIRYNVYQF-QGZVFWFLSA-N 435.507 2.087 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC(C)C)cc3)C2=O)cc1 759933860 RKMPDXUZZRWJOE-HSZRJFAPSA-N 440.500 2.417 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(-c4ncccc4F)n3)cc2)C1 760077722 CFWJBDMCOLQTRV-MRXNPFEDSA-N 437.479 2.430 10 20 IECD CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c1cccc2nonc12 765089142 GJIBQMGBIJTGQH-UHFFFAOYSA-N 440.503 2.061 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N(CCCCO)C1CC1 770098372 RWSBJXIUSQBTIZ-UHFFFAOYSA-N 449.485 2.478 10 20 IECD CC(=O)[C@@H]1C[C@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 772663052 YYZHSMHKVGZIMT-MSOLQXFVSA-N 434.508 2.463 10 20 IECD C[C@@H](NC(=O)C(=O)NCC1(N(C)C)CCCCCC1)c1ccc(N2CCOCC2)cc1 775221563 FVSKYROAFZSKDX-LJQANCHMSA-N 430.593 2.471 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(C(=O)NC4CC4)cc3)CC2)cc1 778222683 AWNUDQUHCYKEJU-SEYXRHQNSA-N 448.523 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CCO)c3cccs3)CC2)cc1 778371328 GZHBOLCQXNRGCA-SGQUHAKNSA-N 429.542 2.201 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)CCC[C@H]3C)CC2)cc1 785531338 UWKWZZCDIWFECD-WOJBJXKFSA-N 430.593 2.361 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](c3cccs3)C3CC3)cc2)C1 785787092 IAMWLJCAHPBMQY-XLIONFOSSA-N 440.569 2.334 10 20 IECD C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 785898616 XQUOTGAWXJYZCJ-GOSISDBHSA-N 425.529 2.325 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788724193 JRNJDHVRQFTVCY-QFBILLFUSA-N 426.521 2.295 10 20 IECD CN(Cc1nc(O)c2sccc2n1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788913285 WZISHDUQQBBMID-UHFFFAOYSA-N 425.514 2.272 10 20 IECD CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788929429 IAMHMEYENWQQHM-SFHVURJKSA-N 430.549 2.276 10 20 IECD CN(CCc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840656 LYAHZTBGPDNSMZ-UHFFFAOYSA-N 431.483 2.243 10 20 IECD CC(C)COC1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789843731 OOBADANJIOVMDI-UHFFFAOYSA-N 435.540 2.067 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789854547 IVJTUGTWIFFGIK-QHCPKHFHSA-N 447.601 2.294 10 20 IECD COC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 790290907 YOVOZSWJRGJAMM-UHFFFAOYSA-N 432.448 2.153 10 20 IECD C[C@H]1CCC[C@@](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)(N(C)C)C1 793808252 AFHNUKZDTSOVAP-YADARESESA-N 430.593 2.108 10 20 IECD Cc1ccc(Br)c(S(=O)(=O)NCCNCc2cc3c(cc2O)OCO3)c1 796529018 LKULXECRAKBEJB-UHFFFAOYSA-N 443.319 2.260 10 20 IECD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 804366572 SJWSWPRMQNUENE-HNNXBMFYSA-N 438.488 2.099 10 20 IECD CC(C)(C)[S@@](=O)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806194910 MUDSBQFZSHILMQ-WYIRRWHOSA-N 445.532 2.036 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CCOCC(F)(F)F)cc2F)C[C@@H](C)O1 809808934 BNIGGAWRKXBTJR-CHWSQXEVSA-N 428.448 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC4(CCOCC4)[C@H]3C3CC3)CC2)cc1 818781698 KRSWTJGVESWHEF-HCXLOTKHSA-N 439.556 2.318 10 20 IECD O=C(O)c1cc(F)c(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 871824089 VOSGMUOQOPZPRL-UHFFFAOYSA-N 430.404 2.117 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1 920482569 TZVDXQZPJBZPJU-UHFFFAOYSA-N 428.488 2.103 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1Cl 920926548 RBMJESCFNCQCQV-AWEZNQCLSA-N 444.919 2.352 10 20 IECD CC(C)OCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1785922305 BHHVOUIIBYIXJV-UHFFFAOYSA-N 435.571 2.406 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3F)C[C@@H]21)c1cc(O)nc(O)c1 1787292408 OPFMBVNPRCZACK-KCTSRDHCSA-N 449.866 2.192 10 20 IECD Cc1ccc([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1 1787295231 XOCLFBVFWPINQO-UHMOLFJZSA-N 439.512 2.198 10 20 IECD Cc1ccn(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727338 PFBQLRCACJIWJY-LBPRGKRZSA-N 427.486 2.136 10 20 IECD CCc1noc(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820649572 LSKVRLBPTBLFOV-NSHDSACASA-N 443.485 2.348 10 20 IECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)c[nH]1 1832901107 BTZZZWSUGODVAH-KRWDZBQOSA-N 448.614 2.417 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(F)nc2F)C1 1840978096 MKBZRVKBMFLRAW-XVNBXDOJSA-N 431.395 2.007 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2[nH]cc3c2CCC3)C1 1844646359 KSEXZXDQTXDUPK-UHFFFAOYSA-N 431.496 2.113 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C2=CC=S=C2NC(=O)c2ccco2)cc1C 731472467 DVIUEWFCEYAEOI-UHFFFAOYSA-N 433.511 2.323 10 20 IECD CCNC(=O)c1cccc(NC(=O)CN(CC(=O)OC)Cc2cc(Cl)ccc2O)c1 731845308 UXYDUEJNULGLBN-UHFFFAOYSA-N 433.892 2.409 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1 733350818 CXXHDPTWYBGQJF-QGZVFWFLSA-N 432.565 2.486 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c1 734018443 ROIDZGXTGMPEQP-QGZVFWFLSA-N 433.486 2.477 10 20 IECD O=C(Nc1ncn(Cc2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 737111220 UCQCXWDHBALQCE-LJQANCHMSA-N 435.484 2.178 10 20 IECD CN1C(=O)CCc2cc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc21 738931073 HXNCAYTVHFILBM-UHFFFAOYSA-N 442.541 2.152 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C)nc3-c3cccnc3)CC2)cc1 743845165 WGRQWUWRBLWKNR-UHFFFAOYSA-N 434.544 2.433 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 754213784 UVAQVZAHIXALET-UHFFFAOYSA-N 429.448 2.217 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ncn(C2CCCCC2)n1 755201923 KJCWLABJXJDOPF-UHFFFAOYSA-N 440.548 2.247 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4cc(Cl)ccc4c3=O)CC2)cc1 758195192 SRJQYHYITUJUJX-GOSISDBHSA-N 428.920 2.242 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N(C1CCCCC1)[C@@H]1CCS(=O)(=O)C1 759588102 IEMHHINJDKZWTC-UGAXZCSASA-N 437.514 2.003 10 20 IECD O=C(NCCCSc1nccs1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 759590925 QUQNREQTUWDJDB-UHFFFAOYSA-N 444.579 2.481 10 20 IECD COC(=O)C1=C(COC(=O)/C=C/c2ccc(O)c(O)c2)N(C)C(=O)N[C@H]1c1ccccc1 759591002 YQNDVSKUSPRRPS-ZUURVNMSSA-N 438.436 2.478 10 20 IECD COCc1ccc(CNC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759878966 QCUPECJMSCINES-UHFFFAOYSA-N 443.544 2.297 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC2)cc(OC)c1OC 760084764 AFZIDWXPQYHJBX-UHFFFAOYSA-N 434.424 2.304 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4cc(F)ccc4F)C3=O)cc2)C1 761117629 GRYSFQZSQJWPDT-IFXJQAMLSA-N 428.439 2.460 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1 773739796 KMBSCPYDVOXHKR-NSHDSACASA-N 436.515 2.055 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C(N)=O)sc3C)CC2)cc1 778324787 PAWRUYCOTJVPKC-FPLPWBNLSA-N 428.514 2.008 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1 785304570 PVQGOKGDXQPUAC-INIZCTEOSA-N 440.544 2.314 10 20 IECD CCC(CC)CNC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 786771689 WJQSIUPLPRRSEN-UHFFFAOYSA-N 442.539 2.111 10 20 IECD O=C(NCc1ccnc(-n2cccn2)c1)C(=O)N(Cc1ccco1)Cc1ccccc1O 787239645 CMHHOWUIHDZPRX-UHFFFAOYSA-N 431.452 2.411 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCS(=O)(=O)c3ccccc3)cc2)CC1 788734265 KTOPZQVREDCDAJ-UHFFFAOYSA-N 443.569 2.129 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 788913201 VIKYKIMAKGWEPE-QFIPXVFZSA-N 448.567 2.253 10 20 IECD COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 792934039 KDCIZSBHMDINDW-CVDCTZTESA-N 439.556 2.354 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](CS(C)(=O)=O)C1 795091330 STERBKIHLMSSDI-LSDHHAIUSA-N 440.521 2.156 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@H](C(=O)OC)c2ccccc2)cc1C 795304130 JNPAWMIYSCJSPJ-KRWDZBQOSA-N 440.543 2.455 10 20 IECD COc1ccc(OCCN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 803297932 KFNVZQCGLZIRAQ-SFHVURJKSA-N 441.528 2.246 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(OCC2CC2)nc1)c1ccc(N2CCOCC2)cc1 803307019 YYIUINCELVFBDC-KRWDZBQOSA-N 438.528 2.201 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)cc1F 803663484 PSGWOFFKPOUJMK-UHFFFAOYSA-N 448.583 2.438 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 804004804 QNELRCFPEGVNBZ-JOCHJYFZSA-N 436.556 2.407 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387171 BIAPRMUSWDTZPI-UHFFFAOYSA-N 434.290 2.040 10 20 IECD CC(C)[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769023 QWJAIDSFFWDSRO-CRAIPNDOSA-N 425.476 2.256 10 20 IECD CC(C)N(CCN(C)C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769555 HJDUIRXCJSMDGW-MRXNPFEDSA-N 426.508 2.172 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)[C@H]4CC=CC[C@H]4C3=O)cc2F)C[C@@H](C)O1 815062959 RYIUYTCCSCQUBW-LVYXFOGZSA-N 429.492 2.007 10 20 IECD CCN(CCO)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 914532436 IBCLJBIZUGJXQN-LCYFTJDESA-N 429.361 2.491 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H](C)O1 918117713 HXAVQUJUTCYYSY-WSTZPKSXSA-N 445.608 2.075 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(N2CCOC2=O)cc1 918440974 XWMBARAOULDVCR-UHFFFAOYSA-N 440.525 2.451 10 20 IECD C[C@H](NC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(N2CCOCC2)cc1 920921609 NHCYXFQAMBEQOI-KRWDZBQOSA-N 443.548 2.138 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)c2C)cc1 925670009 FJOCHCKFTMZHRP-SJORKVTESA-N 427.501 2.372 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)CCC1CCC1)CCO2 1785503221 CWTUFSAHBQRSDV-MFJULSPGSA-N 430.501 2.227 10 20 IECD Cc1cnn([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796935369 BERJNBNKEIWHNN-IZBJGVDFSA-N 448.527 2.184 10 20 IECD COC(OC)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811797901 XHMDCUPCYYTGFT-CXAGYDPISA-N 449.891 2.085 10 20 IECD O=C(CCCn1cccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1826920141 UOXWBQGNRBITGC-CQSZACIVSA-N 441.513 2.457 10 20 IECD Cc1ncncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427955 FGCADPYGGFGNNB-GOSISDBHSA-N 425.489 2.138 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1 1836658047 HGTOMUKWOBOVAK-RBUKOAKNSA-N 429.517 2.151 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2onc3ccccc23)C1 1845636555 MKRCEXIPLVDLHL-UHFFFAOYSA-N 443.463 2.438 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 727563778 IFTSQRTWVFRQCM-UHFFFAOYSA-N 429.429 2.247 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC(C)C)nc3)cc2F)CC1 730392057 UVUJQTHXWQMPOV-UHFFFAOYSA-N 443.523 2.405 10 20 IECD O=C(NCCCSc1nccs1)c1ccccc1S(=O)(=O)N1CCOCC1 733884837 ZYDZTKXMPRMOOM-UHFFFAOYSA-N 427.573 2.076 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H](O)C1CCOCC1 736653656 SDNOQYVHLVRKQY-SFHVURJKSA-N 431.455 2.129 10 20 IECD CCc1nsc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)n1 743559042 GMGJHWIEMXKPFY-UHFFFAOYSA-N 430.578 2.359 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3CN3CCOCC3)cc2F)C[C@@H](C)O1 745648345 JXOWDEJBSYXNHO-GGPKGHCWSA-N 434.556 2.446 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O 749730835 GBWBULMKRZXCHZ-UHFFFAOYSA-N 444.538 2.386 10 20 IECD CCCCN(C(=O)CN(C)c1ccc2c(c1)OCO2)c1c(O)nc(=O)n(CC(C)C)c1N 756653411 IXIKEDNINHKJEO-UHFFFAOYSA-N 445.520 2.185 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(C(C)=O)c3)CC2)cc(OC)c1OC 759411795 GSAYBZFFUFMMIG-UHFFFAOYSA-N 441.484 2.202 10 20 IECD O=C(c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1F)N1CCCC1 763382802 LTBLPKRIQHGDEX-UHFFFAOYSA-N 447.532 2.377 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4c(F)cccc43)cc2F)CC1 763403554 QDVFIIQEOUXBIM-UHFFFAOYSA-N 428.483 2.312 10 20 IECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)c1C 768499706 SASZLJAVGBHLAC-UHFFFAOYSA-N 429.520 2.371 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(OC)c3F)CC2)cc1 770712049 OISUJTHTTBPBAK-UHFFFAOYSA-N 444.507 2.110 10 20 IECD C[S@@](=O)CCN1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775716775 FWCQBZMHLHGXGP-OAQYLSRUSA-N 440.201 2.413 10 20 IECD C[C@@H](NCC(=O)NN1C(=O)N[C@](C)(CCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 775832348 ZHRNYROBFUXULP-MZNJEOGPSA-N 437.544 2.378 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@]4(C3)C(=O)Nc3ccccc34)CC2)cc1 777475468 IVYREKAEGIUUEF-RUZDIDTESA-N 449.555 2.123 10 20 IECD CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 786777746 XCCQMWBUZJRUQA-HNNXBMFYSA-N 432.502 2.312 10 20 IECD C[C@H]1C[C@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 787916638 XSKPXEVJTYDVCT-PMACEKPBSA-N 430.593 2.014 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788256706 XCOWZZGZFCDBBU-GOSISDBHSA-N 430.549 2.419 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccnc(OC3CCOCC3)c2)cc1 788955925 XZUOHXKORGZSBC-UHFFFAOYSA-N 440.544 2.418 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cn1cccn1 790218469 YMZLUGCWQIAXHP-JKSUJKDBSA-N 435.475 2.022 10 20 IECD Cc1[nH]c(C=O)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 801409471 TYWDQQBBYUNMNJ-UHFFFAOYSA-N 443.481 2.230 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)NCCCSc2nccs2)CC1 806280070 IXPSQEFZMHXIQD-CYBMUJFWSA-N 428.580 2.115 10 20 IECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCCCSc3nccs3)C2=O)cc1 806280580 RJUZKUGJUBAXBE-MRXNPFEDSA-N 432.571 2.362 10 20 IECD COc1ccc(CN2CC[C@H](NC(=O)NCc3cccc(OC)c3O)C2=O)c(OC)c1 807577549 WERGROIXALYPIV-KRWDZBQOSA-N 429.473 2.018 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)c(C)o1 807672910 KFAOOUCZRBOONA-MRXNPFEDSA-N 426.517 2.124 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)N[C@@H]1COC(=O)C1 820069178 BREHNPLOACDHES-FIJZOYEMSA-N 441.328 2.082 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNS(=O)(=O)c2cccc(F)c2)cc1 916566449 YSHJQQOECXIQNK-FQEVSTJZSA-N 449.548 2.378 10 20 IECD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1ccc(N3CCSCC3)cc1)C2=O 917386319 UHIVAISBJANPIK-AOMKIAJQSA-N 430.574 2.357 10 20 IECD CS(=O)(=O)c1ccccc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918030636 QNAJYNDMUPKSGI-MRXNPFEDSA-N 430.530 2.114 10 20 IECD COc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918463587 LFHXOWSVCXCQNW-HNNXBMFYSA-N 444.919 2.305 10 20 IECD COc1ccc(CCNC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 920994532 DUOJQJHMGOKSRX-UHFFFAOYSA-N 433.599 2.137 10 20 IECD CC(C)=CCCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1781120829 MRCNWCLIOOORMY-DEOSSOPVSA-N 438.528 2.356 10 20 IECD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(C)o1 1794709067 GWOQNMAWLHTPIK-ZSBFGKGUSA-N 434.876 2.478 10 20 IECD COc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c(F)c1 1807718548 UYTLWOCAOCVXIL-UHFFFAOYSA-N 444.463 2.194 10 20 IECD CCc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)co1 1811009038 NTMXJHFFSPOUDV-VLIAUNLRSA-N 437.456 2.072 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)c2ccco2)[nH]n1 1823496705 PLUBWAFLFZZWCQ-GFCCVEGCSA-N 433.515 2.169 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CC2)CC1 1824216859 UEEOCKUJCVCTLS-LXXRFIIISA-N 435.615 2.433 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)no1 1832130406 RYCPDOOBBRYYTN-SFHVURJKSA-N 428.489 2.265 10 20 IECD NC(=O)COc1ccc(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)cc1 728876536 FDDOPBMLTYXXOL-UHFFFAOYSA-N 432.480 2.295 10 20 IECD CCS(=O)(=O)N(C)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 731361555 NVOVTSSDBYHAMP-KRWDZBQOSA-N 438.594 2.040 10 20 IECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)N(Cc1ccccc1O)C[C@H]1CCCO1 731858273 JQBNTAXGKFFFEO-QGZVFWFLSA-N 441.440 2.234 10 20 IECD C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732451542 VVMYQYDBHXKHLF-AEFFLSMTSA-N 447.580 2.443 10 20 IECD C[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C(=O)N1c1cnn(C)c1 745919059 QJJOLPADKSTJCP-ATZDWAIDSA-N 427.505 2.010 10 20 IECD Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n[nH]1 747510316 BRRTZGKEAUEVNC-UHFFFAOYSA-N 426.496 2.457 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(F)cc(C(C)=O)c3O)CC2)cc1 748050985 KZDHSBKEIDCCAZ-UHFFFAOYSA-N 434.489 2.443 10 20 IECD Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 748981013 STIPJGFUJIUPAR-UHFFFAOYSA-N 442.535 2.412 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)CC(C)(C)CN3CCOCC3)cc2F)CC1 752664330 FKGCRRNBVYGKHC-UHFFFAOYSA-N 449.615 2.467 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 754067073 NKEGVQONSLYBQJ-TZIWHRDSSA-N 438.572 2.297 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(O[C@H]4CCOC4)c3)cc2F)CC1 754249805 VLMIETOARARWOM-IBGZPJMESA-N 428.508 2.460 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccccc3CC(N)=O)cc2F)C[C@H](C)O1 758426112 PPPLIVRAGZADSZ-HOTGVXAUSA-N 429.492 2.162 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc(OC)c1OC 759258091 LVTAVYVJRJCBDC-IRXDYDNUSA-N 448.564 2.334 10 20 IECD COC(=O)CS(=O)(=O)Cc1ccc(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 759838388 DDUAPKBZUITKGU-UHFFFAOYSA-N 442.877 2.331 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@]4(CCN(C(=O)OC(C)(C)C)C4)C3)nc12 765037388 YDSKWMNCISCAKH-QFIPXVFZSA-N 445.520 2.445 10 20 IECD C[C@H](CCCOc1ccccc1C(N)=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769517996 SQSBEMSKJOKCNL-GOSISDBHSA-N 445.585 2.358 10 20 IECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 769643858 PHYNOGBTKXLTNQ-SFHVURJKSA-N 435.521 2.190 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 773763561 RVGIFSDTHWDYBU-LPHOPBHVSA-N 432.542 2.387 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 774856372 GRIGSYRZTMBTOV-IRXDYDNUSA-N 434.556 2.045 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)Cc1ccccc1 774926881 XSAGIZXRUFYVIF-YADHBBJMSA-N 439.556 2.189 10 20 IECD CCCCCCn1cc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c(O)nc1=O 776794164 YFNHRNBBCGUGIW-UHFFFAOYSA-N 438.535 2.187 10 20 IECD COC[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789821556 TXGUPYRXBAQWFQ-ZIFCJYIRSA-N 435.540 2.331 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](c4cc[nH]n4)C3)cc2F)C[C@@H](C)O1 789827210 RVCGRMJDDNFIMO-JFIYKMOQSA-N 443.523 2.185 10 20 IECD Cc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 793735783 YTQPEMOPRXISDI-VQIMIIECSA-N 440.544 2.043 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccco1 793842633 IFMLWCQKQIXCLD-NRFANRHFSA-N 442.560 2.274 10 20 IECD COCCn1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 800576978 CTDIINFKYKZKAV-UHFFFAOYSA-N 436.515 2.027 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CCNC(C)=O)Cc3ccc(C)s3)nc12 801562677 ZVKGABZZTCUKRE-UHFFFAOYSA-N 431.518 2.120 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccc(F)c(OC)c4)CC3)CC2)cc1 801963523 GFBMBKHBJGTPIS-UHFFFAOYSA-N 442.535 2.314 10 20 IECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 806985265 AIJXQOJHGKGZON-AWEZNQCLSA-N 433.530 2.122 10 20 IECD C[Si](C)(C)c1ccc(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 810173035 VTMLUYSPQVJKAN-UHFFFAOYSA-N 430.646 2.326 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](n4cc(Cl)cn4)C3)cc2)C1 812009326 FTJCFDAINKHVNQ-QFBILLFUSA-N 430.940 2.395 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)C[C@H](C)COC3CCCC3)cc2)CC1 815036170 PFVFGYGCMWAXNZ-GOSISDBHSA-N 437.606 2.370 10 20 IECD C[C@H](CN1CCOCC1)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916466459 QVTUGANNLNLBTR-OAHLLOKOSA-N 430.471 2.062 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)ccc2F)cc1OC 920313956 OXFDAVDBXFWOBG-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)CSc1cccc(F)c1 1117114923 XFIOAKWEHGBUJT-HRAATJIYSA-N 437.489 2.371 10 20 IECD CCc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)cc1 1777852270 NIOWFSXWEMZMLG-NTKDMRAZSA-N 439.512 2.497 10 20 IECD C[C@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789612826 NAHMFDZQFWNCFU-CQSZACIVSA-N 436.472 2.168 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1nccc2nc[nH]c12 1804286456 PSOQCRWYALTARJ-BPQKRJORSA-N 449.467 2.040 10 20 IECD C[C@@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815299196 MHZMJVVCEJXFJJ-HZMBPMFUSA-N 449.895 2.292 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cccnn2c1 1821495863 WKKBJZVYOJQKRH-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@@H]1F)CC2 1828197724 HJHKAYAOSSJVFX-KUYPFPNRSA-N 433.461 2.243 10 20 IECD CC[C@H](C)CC(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828243372 RJTFGUWPPREICY-QWRGUYRKSA-N 440.616 2.352 10 20 IECD COc1ccc(-c2nnc(SCC(=O)NCc3ccc(N(C)C)cc3)n2N)cc1OC 27446453 BPNIAGTZHAMXGY-UHFFFAOYSA-N 442.545 2.151 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3ccc(NS(C)(=O)=O)cc3)C=C2)cc1 467295377 NUHIEDNSSVHBPD-UHFFFAOYSA-N 445.522 2.041 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C 472073893 JUANZLMDELBCTQ-XMMPIXPASA-N 434.496 2.477 10 20 IECD COCC(=O)NC1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726722673 VEBYKVSRCWTFAL-UHFFFAOYSA-N 440.491 2.193 10 20 IECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)c1O 727760923 DPXSLWGYWUXWAF-UHFFFAOYSA-N 446.525 2.321 10 20 IECD O=C(NCCCCN1CCN(c2ncccn2)CC1)NCc1ccc(N2CCCC2)cc1 729224188 PHXBLQFTDUQPIY-UHFFFAOYSA-N 437.592 2.478 10 20 IECD O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NCc1ccc(N2CCCCC2)cc1 732064180 AGDVYZOJBDVSCO-JOCHJYFZSA-N 428.577 2.006 10 20 IECD O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 735463447 LHEQYSIUPCRRNI-UHFFFAOYSA-N 437.905 2.342 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 735518379 JHCRQABNCHVARH-INIZCTEOSA-N 438.571 2.367 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1)c1ccc(N2CCOCC2)cc1 737157628 KYNKAJIGQYPPSE-HNNXBMFYSA-N 438.463 2.059 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cnc(Cl)c(Cl)c3)CC2)cc1 738377452 VTKHUPFOYZEPGU-UHFFFAOYSA-N 445.372 2.498 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(C)c1S(=O)(=O)NC1CC1 741094742 OPOGNHAHNPJFAB-UHFFFAOYSA-N 444.557 2.065 10 20 IECD COc1ccc(I)c(NC(=O)C(=O)NCc2ccccc2O)c1 748476662 MXDJNMOJAKUNFY-UHFFFAOYSA-N 426.210 2.260 10 20 IECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)C1 748485294 GWFRKTNFOPQEMC-OAHLLOKOSA-N 431.514 2.068 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1cnc2nc(O)nc(O)c2c1 749313658 IYBKMMHIYJUEJV-UHFFFAOYSA-N 429.502 2.247 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751291667 NWRHBVRXILVXRD-QFBILLFUSA-N 448.541 2.275 10 20 IECD C[C@H]1OCC[C@@]1(C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 753123674 VXTLVXYTWUMLFG-OPAMFIHVSA-N 428.512 2.309 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754213426 SAZOOQGSNFJOJC-UHFFFAOYSA-N 448.882 2.135 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(Br)nn3C)CC2)cc1 757874732 PVRJJGDBNKEUGS-UHFFFAOYSA-N 436.354 2.133 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)CC1 759588676 NOPZKOQCCAVKDG-VQHVLOKHSA-N 438.480 2.384 10 20 IECD Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 760096105 YONUXMVWLKRRAE-OAQYLSRUSA-N 426.492 2.353 10 20 IECD CS(=O)(=O)Cc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 766199810 JGDBJZIPYFIQJJ-UHFFFAOYSA-N 434.333 2.178 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(C(=O)N=c3cc[nH]cc3)c2)c1 769748433 RIGWSCADLXQATE-UHFFFAOYSA-N 426.454 2.085 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c(C)n1[C@@H]1CCS(=O)(=O)C1 772766109 PUJYWEKQYLDNJH-MQDFFIGUSA-N 433.482 2.315 10 20 IECD CCNC(=O)c1ccc(C)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772902944 BEPMTAMUBZYREX-UHFFFAOYSA-N 428.508 2.449 10 20 IECD Cc1ccn(C)c(=O)c1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774278304 HIFPJTJLNZKNEH-CQSZACIVSA-N 434.443 2.019 10 20 IECD Cc1cc(C(=O)CN(C)C[C@@H]2CCCC[C@@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778247130 UVUSHSJTZPSBHA-UWJYYQICSA-N 433.574 2.407 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(OC[C@@H]4CCCCO4)CC3)CC2)cc1 779222224 JLXBZXDEMXBXNO-DHLKQENFSA-N 447.620 2.228 10 20 IECD C[C@H]1CN(CC(C)(C)O)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781941747 SYEWILWOERMPRZ-INIZCTEOSA-N 435.524 2.178 10 20 IECD CC1CCN(CCCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 785519950 LFNWKSXTFIODRB-RTBURBONSA-N 448.583 2.294 10 20 IECD O=C(CN1CCC[C@@H](Oc2ncccc2F)C1)NCc1ccc(N2CCOCC2)c(F)c1 785837677 GHXXKZOZCRBCFL-GOSISDBHSA-N 446.498 2.356 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)CC1 786069198 PYOLGEBSYCVDIR-UHFFFAOYSA-N 438.531 2.340 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccccc3CO)cc2F)C[C@H](C)O1 787065924 JBNKSLSRGPQLMJ-IRXDYDNUSA-N 444.503 2.334 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnc(O)c(Br)c3)cc2)CC1 787319581 MOZAMXXWDAGURE-UHFFFAOYSA-N 433.306 2.148 10 20 IECD CC(C)(CO)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 788324878 ZDEXNLYQLCEBAE-JOCHJYFZSA-N 439.556 2.058 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 788950906 MESOUTMTNWRFMI-OAQYLSRUSA-N 440.519 2.205 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 788955556 XIXZXHIRLVZPAB-MRXNPFEDSA-N 446.573 2.016 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 789813849 WEWDUHJLRUZZHY-OAQYLSRUSA-N 445.466 2.018 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1 789840711 MUUVRBGPHWHBGP-UHFFFAOYSA-N 427.520 2.379 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCN(C2CCCC2)CC1 789845727 KQZMJUVIRHCHCS-UHFFFAOYSA-N 430.618 2.333 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)sc2C(C)(C)C)cc1 797431375 NLOSWNODTLOQNQ-UHFFFAOYSA-N 447.560 2.421 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(C)cc2Br)cc1 797431491 QIVOXCOAFLZJEZ-UHFFFAOYSA-N 440.366 2.496 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@](F)(CO)C3)c2C)c1 802012889 PMDYGYPALSIXGU-HSZRJFAPSA-N 446.475 2.256 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 803146049 HEYCUPJIORXDTA-UHFFFAOYSA-N 426.517 2.280 10 20 IECD CN1CCC(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 803376502 FDLDQWFZRZQXIF-KRWDZBQOSA-N 438.519 2.221 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1F 803663437 ZENSLNJNTWRHCY-UHFFFAOYSA-N 441.551 2.068 10 20 IECD COc1ccc(CN2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1 807103665 TZANYMSHTYTSER-UHFFFAOYSA-N 438.572 2.420 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 807846151 IKLVBXVANVQPSB-NRFANRHFSA-N 437.540 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@](C)(O)c3ccc(Cl)cc3)CC2)cc1 815499158 WCBMUMXNZOZSNM-JOCHJYFZSA-N 432.904 2.448 10 20 IECD O=C(CN1CCCN(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917089053 PHQXEELLOKTPAY-UHFFFAOYSA-N 426.536 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccccc4C3=O)cc2F)C[C@H](C)O1 917714992 XWLDQNCROQBVEI-GJZGRUSLSA-N 425.460 2.352 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918285118 ZJOKEOBLNZUHHU-UHFFFAOYSA-N 430.436 2.096 10 20 IECD Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 918443690 FMFBIVJXMBDEJY-UHFFFAOYSA-N 433.530 2.327 10 20 IECD Cn1ncc2cc(S(=O)(=O)Nc3nc(-c4ccc(S(C)(=O)=O)cc4)cs3)cnc21 1321448225 NOOAOMYITQDXEK-UHFFFAOYSA-N 449.539 2.296 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc(F)cc1)CCO2 1785510166 PTDGJFBBWMOSAG-WAWJGKILSA-N 442.443 2.099 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccc(C(F)(F)F)n1 1796601492 PXKUEZNKJATUHO-CLLJXQQHSA-N 436.390 2.472 10 20 IECD Cc1ncsc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991041 MXDQBOLSGVIPSX-KSSFIOAISA-N 439.497 2.286 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1Cl 1847051026 PJZGZAAYMAXVRJ-UHFFFAOYSA-N 437.974 2.326 10 20 IECD COc1ccc(N(CCn2cnc3c2c(=O)n(C)c(=O)n3C)Cc2cccs2)cc1 216786254 NSOVQMFSPMIPOR-UHFFFAOYSA-N 425.514 2.211 10 20 IECD COCCNS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726561274 JHXIQJMMYRUDDH-UHFFFAOYSA-N 447.557 2.019 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C4OCCO4)C3)cc2F)C[C@@H](C)O1 728053416 JUBOYPHTABAEDI-LMMKCTJWSA-N 435.540 2.140 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NCCS(=O)(=O)NC[C@@H]3CCCCO3)c2C)cc1 732163637 GIVHCJJEQGOMNL-FQEVSTJZSA-N 449.573 2.321 10 20 IECD CCn1nc(C)c(S(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1C 742272133 SCDVFRGMKIJGCY-UHFFFAOYSA-N 435.594 2.019 10 20 IECD O=C(CSc1ncc[nH]1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 742455812 WHHQWBUVOOTLQQ-ZSOIEALJSA-N 448.551 2.248 10 20 IECD Cn1cc(N2CC[C@H](NC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2=O)cn1 745832281 XMUBTFHONPAKRY-KDOFPFPSSA-N 448.474 2.095 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1cnn(Cc2ccccc2)c1 746703146 YOVHMXKGQVTXIJ-UHFFFAOYSA-N 430.505 2.386 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]([C@@H]3CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750251912 CGHFIKVXJXDWAG-QZTJIDSGSA-N 431.558 2.283 10 20 IECD CNC(=O)[C@@H](NC(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1)c1ccccc1 751930297 CJWFBYLPSCGUHP-FQEVSTJZSA-N 438.509 2.076 10 20 IECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccc(C(=O)O)cc4C)C3=O)CC2)cc1F 753977601 GDDMZMJDSNWGOJ-IBGZPJMESA-N 441.459 2.295 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCO[C@@H]([C@H]2CCCO2)C1 757425491 MHJYULLDGIPZMF-IAGOWNOFSA-N 438.527 2.275 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(CN4CCOCC4)cc3)no2)c1 758283268 LLDJPMXXWHJWHJ-UHFFFAOYSA-N 430.486 2.313 10 20 IECD CC(C)N(CCS(C)(=O)=O)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759231425 LOJQRXOBHSMWCW-UHFFFAOYSA-N 428.510 2.156 10 20 IECD CC(=O)Nc1nnc(S(=O)(=O)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)s1 759513775 WBGFIAUGVDLEOJ-UHFFFAOYSA-N 433.515 2.331 10 20 IECD O=C(COC(=O)c1cnc([C@@H]2CCCO2)s1)NCc1ccc(N2CCOCC2)c(F)c1 760661945 CUWNEDPPQLFIMS-KRWDZBQOSA-N 449.504 2.444 10 20 IECD Cc1cc(F)ccc1-n1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1 767298226 KYSCYQXLHUQQBK-QGZVFWFLSA-N 436.491 2.347 10 20 IECD NC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 769647516 NBQVSRFDQHYVSQ-KRWDZBQOSA-N 431.495 2.211 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnc(-n5cccn5)c4)n3)CC2)cc1 771054745 DRXYAZWUWOBZGW-UHFFFAOYSA-N 445.483 2.217 10 20 IECD CNC(=O)COc1cccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 772487233 GUYWEBVVTIZSGQ-LJQANCHMSA-N 445.947 2.494 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(I)cn1 773328583 UQYLJMHSMLVYOE-UHFFFAOYSA-N 448.264 2.317 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4ccccc4[C@@H]3CO)CC2)cc1 773511373 VMKHYQDKHILKEW-JCKUYFFHSA-N 435.524 2.018 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cc1F 775287006 VEJIXYRWUVGKQU-UHFFFAOYSA-N 446.478 2.270 10 20 IECD CCc1ccc([C@@H]2COCCN2C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)o1 779222461 OESPBDJZNCNELL-OFNKIYASSA-N 429.561 2.407 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N2CCOCC2)cc1 785397175 LAQQIVXSKLKGQK-QZTJIDSGSA-N 448.527 2.159 10 20 IECD COc1cccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1OC 787927608 YUIYKVDZOZGEGN-LJQANCHMSA-N 442.512 2.276 10 20 IECD COc1ccc2nc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)sc2c1 788679495 XFLLZQUWLAOBEI-XYOKQWHBSA-N 429.570 2.055 10 20 IECD CC(C)N(CCc1nccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798061 AYQZQJIEAHTFKL-UHFFFAOYSA-N 434.537 2.215 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819206 MLYFSMNSZLJSMP-ZHALLVOQSA-N 434.556 2.046 10 20 IECD Cc1cc(F)cc2c1CN(C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 789839856 BQJKWPGFEWQWIT-UHFFFAOYSA-N 443.494 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)CC2)cc1 791690815 YAFNCAWERIDLOM-UHFFFAOYSA-N 443.456 2.426 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@H]1c1ccccc1 793732566 IPVYWTRIIXGQMN-NQSCKRDGSA-N 434.540 2.224 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[nH]1 796351575 QSAFWCCHVFNXJD-KBPBESRZSA-N 447.463 2.027 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 803311690 XUOIPTGZOUNJIV-MRXNPFEDSA-N 429.492 2.207 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3COC4(CCCCCC4)O3)CC2)cc1 804319839 STLSDROOMOBNCY-NRFANRHFSA-N 445.560 2.362 10 20 IECD CN(C[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1)C(=O)OC(C)(C)C 806275343 CHJQUECMTJYQQS-CQSZACIVSA-N 442.607 2.457 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc(Cl)cn1 806721549 ICLHCCFPAUEQTL-UHFFFAOYSA-N 441.963 2.200 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1 807100161 KZPZUMYIVCZMOE-AUSIDOKSSA-N 438.572 2.083 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 807100382 LZCOMECVVRHAEY-IBGZPJMESA-N 428.920 2.252 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290146 QVUFOOHMSQVSMU-PXNSSMCTSA-N 442.560 2.441 10 20 IECD CC(C)(O)[C@@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770090 YAODGFKNTWHQGT-PBHICJAKSA-N 425.476 2.135 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3COC4(CCCCCC4)O3)CC2)cc1 809672204 AGBMQGLNYGNMBQ-OAQYLSRUSA-N 445.560 2.316 10 20 IECD Cc1cc(C(=O)O[C@@H](C(=O)N2CCC[C@H](C(N)=O)C2)C(C)C)c(C)n1-c1ccccn1 914903370 LTARHHUQPPJHJY-FXAWDEMLSA-N 426.517 2.394 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)cc2F)C[C@@H](C)O1 917714020 LZKBBKAEXLHNRA-OKILXGFUSA-N 439.509 2.213 10 20 IECD CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918439184 UMYSHHDUNVNREL-UHFFFAOYSA-N 442.491 2.390 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(-c2nnco2)c1 918442618 LSDLTHSQZTVJTP-UHFFFAOYSA-N 435.484 2.200 10 20 IECD CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920194836 JMRZKEVSKMBRNZ-UHFFFAOYSA-N 430.892 2.390 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 1117669349 IKSANROHHIOAIJ-NRFANRHFSA-N 427.549 2.231 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1 1254761173 KRCOWDIWIQOJOP-AEFFLSMTSA-N 447.532 2.052 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](NC(C)=O)c1ccc(C)cc1 1321362145 YVTGJHACUCIEHL-MOPGFXCFSA-N 428.485 2.264 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1778469921 MSGVQRVOYFOOPU-QFIPXVFZSA-N 443.525 2.190 10 20 IECD Cc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c(C)c1 1784985885 KPAFPQNJGSNGJH-QHCPKHFHSA-N 425.485 2.175 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1csc2c1CCCO2 1796600610 TUPZVWJPDYAWEY-BTTYYORXSA-N 429.498 2.445 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)c(F)c1 1799758700 ZSSYLFZOUJIAAT-CLLJXQQHSA-N 439.509 2.077 10 20 IECD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c(C)o1 1799767413 OEIWLECFUBCZHD-ZSBFGKGUSA-N 434.876 2.478 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)C(=O)C1CC1 1803060655 GJLLJEXPHLSLKB-KSSFIOAISA-N 443.887 2.445 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3csnn3)C2)CC1 1806229152 XYLCXDJNSBSSDO-HWKANZROSA-N 444.513 2.213 10 20 IECD Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1811605158 MTPDQMZZYMQFHE-IERDGZPVSA-N 435.484 2.168 10 20 IECD CN(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811802720 ABRNQCVFPFIPMQ-YWZLYKJASA-N 446.935 2.418 10 20 IECD CC1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827423976 MATDUYRIXUSBFF-FQEVSTJZSA-N 444.576 2.458 10 20 IECD O=C(CCc1ncc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428687 BWVTUQRSYZSZLP-KRWDZBQOSA-N 427.505 2.082 10 20 IECD Cc1ccccc1OCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038879 DVOYZRMNIQNKIQ-CSKARUKUSA-N 438.480 2.407 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2nc(C)n(C)c2Br)cc1 326786838 WCVIFKRYMNQGAO-UHFFFAOYSA-N 437.341 2.053 10 20 IECD COCCOC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729063092 YBCFQHSJPXPXLU-ZDUSSCGKSA-N 431.445 2.412 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCCC(=O)NC)cc1 729787352 VUEUBUWLMQRYIW-UHFFFAOYSA-N 426.517 2.255 10 20 IECD COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)C1=O 746753717 HIXFVGUXHKYAPW-OAHLLOKOSA-N 434.493 2.345 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cccc(Br)c3)c2)CC1 748674987 SIUQZTCVHKQYKP-UHFFFAOYSA-N 445.360 2.485 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](C)N3CCc4sccc4C3)CC2)cc1 758208509 GSRLHSQQBYIFRA-KNQAVFIVSA-N 444.645 2.276 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@@H]1CCOC1 764372383 KFKVJVXJGGVXHH-QWHCGFSZSA-N 435.458 2.256 10 20 IECD COc1cc(N2CCN(c3cc(N4CCSCC4)ncn3)CC2)cc(OC)c1OC 764889095 UXGUXDAYNCIVHB-UHFFFAOYSA-N 431.562 2.382 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913883 BAJZRJQGNFWOOZ-INIZCTEOSA-N 429.908 2.013 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccccc4n3)cc2F)C[C@H](C)O1 775125156 CMSIMCXQKCIOJU-HOTGVXAUSA-N 439.491 2.020 10 20 IECD C[C@@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 775191351 NDCDAWDCSQHQEQ-QGZVFWFLSA-N 432.590 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc(C)c4ccccc4n3)CC2)cc1 778253397 FPNFRGUVQBAGSV-VAWYXSNFSA-N 445.523 2.468 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784766001 FVJNSWRFZAVTKU-GOSISDBHSA-N 444.919 2.125 10 20 IECD Cc1cccc(C)c1OC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323227 KMYXPHVQMJYAND-IBGZPJMESA-N 425.529 2.340 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1nc2c(s1)CCCC2 789377428 JZESGEVCGGWKTM-UHFFFAOYSA-N 432.521 2.377 10 20 IECD O=C(NCc1ccn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793664683 MKMLSRHWVOCLDP-NRFANRHFSA-N 434.496 2.402 10 20 IECD Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1Cl 793722346 LCCORHWFUAYPRW-GOSISDBHSA-N 442.947 2.283 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCC(C)(C)CC1 793724965 PQZMOJHLJJVGNI-GOSISDBHSA-N 428.577 2.432 10 20 IECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)n2C 803299061 ICRQCKGNFIQDJS-KRWDZBQOSA-N 435.528 2.212 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)cccc2OC(F)(F)F)cc1 808111409 MVGXUNPJHXSFEV-UHFFFAOYSA-N 443.400 2.401 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCCN1CCNC1=O 808500494 OILJWYPMYZHWIE-ACCUITESSA-N 425.557 2.298 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(CN4CCCC4)on3)CC2)cc(OC)c1OC 812547162 HOSAQRKDQDURBL-UHFFFAOYSA-N 430.505 2.259 10 20 IECD CC(=O)Nc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 917930244 NQEODGPIBAOJLQ-GOSISDBHSA-N 444.557 2.134 10 20 IECD CN(C)c1ccc(CN(C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)C2CC2)cc1 918063974 CLZFEIJFMJZIST-UHFFFAOYSA-N 449.555 2.199 10 20 IECD CCNC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918295327 DLRKWXCUMLTYSH-LJQANCHMSA-N 425.485 2.288 10 20 IECD CC(C)Cn1c(N)c(C(=O)CN2CCCc3cc(OC(F)F)ccc32)c(=O)n(C)c1=O 919804856 NVZWVUAXRIPRQF-UHFFFAOYSA-N 436.459 2.022 10 20 IECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCCC1 920445001 GNIOLYUIWRITPC-CQSZACIVSA-N 448.501 2.315 10 20 IECD COC(=O)c1cc(Br)ccc1N/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 920979085 UHILNSPGUZLSAS-KPKJPENVSA-N 440.319 2.431 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@]1(F)Cl)CCO2 1782009249 VCYTVDFJVDIUSW-FJNPEDAXSA-N 433.263 2.119 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nc1C 1794487728 CJDRYIMYXBYSFN-CCWDJLKJSA-N 445.903 2.280 10 20 IECD Cc1nn(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825628624 CYPFNLADEQIQMG-MRXNPFEDSA-N 445.495 2.221 10 20 IECD CN(C)c1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)o1 1825754238 IHSAHBROKPUIQA-MRXNPFEDSA-N 443.504 2.094 10 20 IECD CCOC(=O)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1831252037 YPSJYRLCQUJTFT-KRWDZBQOSA-N 445.516 2.069 10 20 IECD CC[C@H](NC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877532 PWHILTYBDHFJPS-FQPQFXKESA-N 445.560 2.434 10 20 IECD CC(C)(C)n1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1842205655 ABSLZOCKEURGBN-UHFFFAOYSA-N 448.527 2.248 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)NCC(=O)Nc2cccc3c(=O)[nH][nH]c(=O)c23)c1C 65309448 SFWDCHHSOLEGAD-UHFFFAOYSA-N 445.479 2.301 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 730369230 QGKQIBIRUNDLNW-QGZVFWFLSA-N 427.476 2.446 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 743179669 ZNZSKDFHSQUDKQ-SFHVURJKSA-N 448.531 2.383 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 749313585 HKKZLWXAEXLXPK-UHFFFAOYSA-N 439.921 2.179 10 20 IECD Cc1oc(S(N)(=O)=O)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754205853 VALDDPKZLSPERU-LBPRGKRZSA-N 429.445 2.236 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc(OC)c1OC 760083193 CVWZJDMKNLUYHP-KGVIQGDOSA-N 449.592 2.495 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ccc(Cl)cn3)CC2)cc1 760743492 RHQLPSAJERCDPX-UHFFFAOYSA-N 433.940 2.244 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C(F)F)c3)cc2F)C[C@@H](C)O1 767999359 OOSXXKBUSDDLCZ-VXGBXAGGSA-N 425.411 2.286 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@](C)(C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 774841136 SUQBUICPGGLMAW-GGOJBBCOSA-N 448.539 2.412 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccccc4F)CC3)cc2)CC1 775745125 QDHUPHVEOSURLZ-UHFFFAOYSA-N 425.552 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 778234144 MLLJPCWRUXGTFP-MHACMEGNSA-N 442.604 2.384 10 20 IECD CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1CCS(=O)(=O)C1 778515243 PTYNXJJCXQBHCR-MRXNPFEDSA-N 440.521 2.300 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(CC1)COC(=O)N2 784465928 VMLODLAEXOBRKH-AWEZNQCLSA-N 433.464 2.363 10 20 IECD COC(=O)CCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785399220 OUXQXTQEXWSSGB-UHFFFAOYSA-N 438.414 2.211 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)cc1 786960978 XLUNOAXEAFRAIV-UHFFFAOYSA-N 448.926 2.042 10 20 IECD COc1cccc2c1CC[C@@H]2NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800839 QIGPVCWKOFKCOB-IBGZPJMESA-N 427.476 2.091 10 20 IECD Cc1csc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C2CC2)n1 789843021 HDYAJHHAORMGJZ-IBGZPJMESA-N 446.548 2.435 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C)ccc2Br)ccc1O 790408134 UBJQLOOWTRNJJM-UHFFFAOYSA-N 435.321 2.172 10 20 IECD Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793754659 DPIXNHOQIQJVJR-HIFRSBDPSA-N 435.475 2.292 10 20 IECD C[C@@H]1CCC[C@@](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)(N(C)C)C1 793808250 AFHNUKZDTSOVAP-NTKDMRAZSA-N 430.593 2.108 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@H]4C[C@H]4N3C(=O)OC(C)(C)C)nc12 796037807 QPRJTNRAAWNGFX-DFBGVHRSSA-N 446.460 2.053 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 803134575 KXNMBTAHUDXSNA-QFIPXVFZSA-N 448.523 2.113 10 20 IECD COCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309777 BRZYDGYPUKSMDX-YLJYHZDGSA-N 429.517 2.496 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4cccc(C)c4)CC3)CC2)cc1 804315613 NGTGLJPSSMYUGM-UHFFFAOYSA-N 436.556 2.437 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCN(C(=O)N2CCCC2)C1 806457298 JHTYLQJEWOYZSS-SFHVURJKSA-N 447.555 2.266 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 806545504 XXCYGQLLCPMXKV-UHFFFAOYSA-N 440.472 2.031 10 20 IECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 810318004 LOXCRJUUHIQSCI-UHFFFAOYSA-N 431.558 2.376 10 20 IECD COCCN1C(=O)/C(=C(\C)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(=O)NC1=S 814336755 IWMSBPPGGJCFSO-LDADJPATSA-N 449.488 2.038 10 20 IECD O=C(CSCc1cc(=O)n2ccsc2n1)NCc1ccc(N2CCOCC2)c(F)c1 917708086 FTSGEGLCUISGJQ-UHFFFAOYSA-N 448.545 2.281 10 20 IECD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 919779443 SCZFDEOEEARMDR-KRWDZBQOSA-N 446.573 2.334 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2 1782003051 MJXFDANDXYSHRG-SFHVURJKSA-N 430.835 2.240 10 20 IECD N=C(N)SCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796034410 FVTNACCQSPUNNJ-ZSBIGDGJSA-N 426.926 2.020 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cn1)C1=NN(c2ccccc2)C(=O)C1 1796238286 RXIHKGBJPYSNHL-FNLKRUPLSA-N 449.486 2.194 10 20 IECD O=C(CCc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931824 NLMXUYFSWJDYNT-NUZGMZIFSA-N 445.523 2.445 10 20 IECD Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1807994805 BVLUBAICMZCJNO-LIRRHRJNSA-N 439.497 2.286 10 20 IECD Cc1cc(/C=C/C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1810385662 JELKYTYWCUBXMQ-ARKKOZOFSA-N 449.467 2.217 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnc(Cl)nc2)CC1 1823630463 SOYHRMYOLDAQAH-MRXNPFEDSA-N 445.907 2.483 10 20 IECD Cc1[nH]ccc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031648 ZXQGPYJIQPFUHC-UHFFFAOYSA-N 428.489 2.055 10 20 IECD Cc1noc(C)c1S(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccccc2)c1C 19610502 UVRCMWJDJGOMTA-UHFFFAOYSA-N 445.497 2.403 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(NC(=O)c4ccccc4)CC3)CC2)cc1 25827229 SWNNNOLBURMLDJ-UHFFFAOYSA-N 436.556 2.238 10 20 IECD COCCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)CC(F)F 728928865 IKLKVEHGVRTSFP-UHFFFAOYSA-N 429.489 2.138 10 20 IECD C[C@@H]([C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCOCC1 729594377 PHXOXDQHHVFHKD-CVEARBPZSA-N 444.498 2.450 10 20 IECD O=C(NCCOCC1CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 731053704 UHMKQHHIBSKJIK-UHFFFAOYSA-N 435.458 2.258 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)cc1F 732098257 UHHWJQNMKADILB-OAQYLSRUSA-N 434.556 2.001 10 20 IECD Cc1cc(O)ccc1NS(=O)(=O)c1cc2c(cc1Br)n(C)c(=O)n2C 743260079 SWHHZBLLMKJLKH-UHFFFAOYSA-N 426.292 2.454 10 20 IECD COC(=O)CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CCOCC1 744425666 IUVMTPSUJNBIRZ-UHFFFAOYSA-N 436.464 2.055 10 20 IECD C[C@H]1OCC[C@]1(C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 753123675 VXTLVXYTWUMLFG-ZHRRBRCNSA-N 428.512 2.309 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(c4ccccc4OC)C3=O)CC2)cc1F 757284145 FCSVJTKSVNLQSY-GOSISDBHSA-N 442.491 2.480 10 20 IECD CC(=O)Nc1nnc(S(=O)(=O)NC(=O)c2sccc2-n2c(C)ccc2C)s1 759510639 QWHDVNUIIXQJEE-UHFFFAOYSA-N 425.517 2.084 10 20 IECD CC1(C(=O)OCC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)CC1 761441479 HFZZYMTYGKWPHD-OQLLNIDSSA-N 448.522 2.076 10 20 IECD CN(C)S(=O)(=O)c1cccc(CNC(=O)NCc2cccc(Br)c2O)c1 764806099 NWPHQSJIUIDUPR-UHFFFAOYSA-N 442.335 2.404 10 20 IECD C[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CCOCC1 771060560 WNZJCIFFYRRAKO-WMLDXEAASA-N 444.981 2.109 10 20 IECD C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 776718448 QXTWTLDZQMUXAE-QWHCGFSZSA-N 427.523 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cc1 778255115 BNNVLPPIIXKLAW-SREVYHEPSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3nnc(SC)s3)CC2)cc1 782651884 APJRDNCOOQOFIL-UHFFFAOYSA-N 436.607 2.280 10 20 IECD CN(C)Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 789862851 XJEBFVPNGYJEQU-UHFFFAOYSA-N 444.576 2.373 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(COC)ccc2OC)cc1OC 795305725 XLWANKYBZJBMDR-UHFFFAOYSA-N 444.531 2.413 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 795802825 IANIFMSLPHTETO-UHFFFAOYSA-N 431.558 2.482 10 20 IECD CS(=O)(=O)C1(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCC1 797157578 QWFUHFAGOWSNDS-UHFFFAOYSA-N 442.449 2.067 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)cc1F 803539736 ZZNMWJBKAZYSNF-INIZCTEOSA-N 436.528 2.414 10 20 IECD CCc1ccc([C@H](O)CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 805013973 LSXIXLHPXLONAT-HSZRJFAPSA-N 426.561 2.412 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3cccnc3)cc2F)C[C@H](C)O1 805644429 ZWFIFVYAYYGSPN-IRXDYDNUSA-N 445.491 2.211 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 806774468 VUFURCSJZGBQCK-UHFFFAOYSA-N 444.557 2.335 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C 807095918 CEZPSKGEAGXOTR-BEFAXECRSA-N 432.565 2.439 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292799 ZDHLXBBNNCYWEL-HKUYNNGSSA-N 428.533 2.052 10 20 IECD COC(=O)c1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)nc1 816500791 IGKPIKHNPLHDOU-UHFFFAOYSA-N 447.494 2.366 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Cl)cn1 816891577 WYRTWBONLAHWDG-UHFFFAOYSA-N 427.885 2.044 10 20 IECD COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2cccc(S(N)(=O)=O)c2)n1 917898049 SVWPHJJPMRHRAK-UHFFFAOYSA-N 443.503 2.406 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCNC(C)=O)s2)cc1C 918727493 CHHGLHQLSQVZBL-UHFFFAOYSA-N 445.588 2.298 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 920196005 HCHLHJCVCPLYIK-UHFFFAOYSA-N 436.512 2.014 10 20 IECD C[C@H](OC[C@H]1CCCO1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 921006567 CYQSICVDAFTBII-PKOBYXMFSA-N 443.523 2.143 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)C(F)F 1320392915 CMFNFTZCAIYPLI-JTQLQIEISA-N 449.453 2.060 10 20 IECD Cc1ncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C2CC2)n1 1339827708 XPEFSYWBYCSOEV-UHFFFAOYSA-N 428.464 2.111 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnc(O)[nH]2)CCO3)cc1 1781753022 FDIQZGFMHMZWPP-XMMPIXPASA-N 449.511 2.280 10 20 IECD Cc1nn[nH]c1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753614 LHKRPCGPJHLEID-DEOSSOPVSA-N 448.527 2.278 10 20 IECD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1C 1782005376 BUCYSSKBARMONQ-NRFANRHFSA-N 433.892 2.155 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(N2CCCC2)ccn1 1796601211 FQIDIGPKKJFOPH-VBUUOAMHSA-N 437.500 2.054 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1N(C)C 1796604861 RXFLLJJLVRTXKQ-BJWYYQGGSA-N 440.500 2.133 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ncn1 1798998764 LQLISANSXFRYDQ-LJWNITHASA-N 444.875 2.212 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1cc(O)nc(O)c1 1817843442 OKYWCJRBQHFPMD-CQSZACIVSA-N 426.408 2.370 10 20 IECD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccn1 1827067398 VKBJTOGQBFKEGV-DGCLKSJQSA-N 439.497 2.374 10 20 IECD Cc1nnsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427600 MYJRNLNBIASYNC-OAHLLOKOSA-N 431.518 2.200 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836252685 FPRKLQXSZUHZAH-UHFFFAOYSA-N 438.528 2.300 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)NCC(C)(C)N3CCC[C@@H](C)C3)nnc2n1 115726623 BWCLTKGEIVPYMD-CQSZACIVSA-N 449.629 2.102 10 20 IECD COc1ccc(N2CCN(CCNc3ncnc4c3c(Br)nn4C)CC2)cc1 728051503 NRDYSKZZMINQRF-UHFFFAOYSA-N 446.353 2.369 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3O)C[C@@H]3CCCO3)nc12 731844525 JKQAYIBRWBMNCE-KRWDZBQOSA-N 426.473 2.498 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CC(N)=O)Cc3ccccc3)cc2F)C[C@@H](C)O1 732808240 KDMOOHYXLHAOJO-HDICACEKSA-N 442.535 2.043 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)cc1 732989847 RNXIBWCGPNDYKV-UHFFFAOYSA-N 436.500 2.251 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCc2ccccc2S(=O)(=O)N(C)CCO)cc1 733038510 PJLCMIUZZNKCSI-UHFFFAOYSA-N 448.589 2.145 10 20 IECD CC(C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 737244904 DLNFDWVHTTWOAF-UHFFFAOYSA-N 429.542 2.300 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)c1O 737285901 MQFXAYIZYSIMMI-UHFFFAOYSA-N 443.525 2.153 10 20 IECD CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 741095268 IVEXCBAHCAFOII-UHFFFAOYSA-N 449.529 2.027 10 20 IECD CN1CCN(Cc2cccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)CC1 741096744 FMDBPQQOFIWGCX-UHFFFAOYSA-N 433.556 2.065 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C)C(=O)N3CCS(=O)(=O)CC3)c2C)c1 749376379 NPPYCUJKYSPGKI-KRWDZBQOSA-N 431.558 2.086 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 750276502 JAPSQRNYCOIFJI-GGPPTIHXSA-N 436.622 2.196 10 20 IECD CC[C@H](NC(=O)N(CC)Cc1cc(Br)ccc1O)C(=O)N1CCOCC1 753060852 XENIANGGRPVDHD-HNNXBMFYSA-N 428.327 2.324 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C)c(S(C)(=O)=O)c3)CC2)cc1 758992874 PFPOXXQAANFHLQ-UHFFFAOYSA-N 445.541 2.131 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(F)c2I)c1 759013240 NVJXPYCJHSOELN-UHFFFAOYSA-N 444.200 2.399 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc2)[nH]1 761967069 GDDUPYWILCVHHA-ZDUSSCGKSA-N 425.441 2.086 10 20 IECD CCN1C(=O)c2ccc(C(=O)NCc3cccc(Br)c3O)cc2S1(=O)=O 765754973 YXRBRVXUMWRAGK-UHFFFAOYSA-N 439.287 2.249 10 20 IECD O=C(COC(=O)c1ccnn1C1CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 767455347 JOVJCEIWQCBWIT-UHFFFAOYSA-N 430.480 2.447 10 20 IECD CC(C)c1ccc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768438564 UTKXVHOTNYSTIK-NRFANRHFSA-N 432.542 2.448 10 20 IECD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769736294 WHLKTXVGRJLXEY-UHFFFAOYSA-N 433.486 2.261 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3cc(Cl)ccc3F)cc2)CC1 769900200 BKMKPYSQYFQTIM-UHFFFAOYSA-N 446.953 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(CNC(C)=O)cc4)n3)CC2)cc1 771054473 ARQKLYLAAJUJTI-UHFFFAOYSA-N 449.511 2.273 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CS(=O)(=O)c1cccc(Br)c1 773750140 UQSOEHPITQGCDG-LLVKDONJSA-N 428.304 2.381 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c1O 775146112 HBBYCLBVFUQTAH-UHFFFAOYSA-N 426.517 2.186 10 20 IECD CC[C@]1(CO)CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 778330989 IDUQQKUYPORYOT-QFIPXVFZSA-N 433.574 2.409 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 779478108 FMGMIZIQCIITMJ-XSFOEPMVSA-N 426.469 2.101 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 785423821 HIXUNXAMGLKMOW-PKTZIBPZSA-N 438.572 2.165 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785599762 GFJZRCSNOYZZFL-UHFFFAOYSA-N 444.464 2.119 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cnc4ccsc4c3)cc2)CC1 786119723 DZUQQHNDFPDBHE-UHFFFAOYSA-N 430.555 2.443 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1CCN(C)CC1 786648496 HNYNNGPBKDMRFA-HSZRJFAPSA-N 443.636 2.024 10 20 IECD Cc1cccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)C 789812229 LHVALHUPEIGRGC-FQEVSTJZSA-N 428.508 2.495 10 20 IECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NCc2c(O)ccc(Cl)c2F)C1 792173640 ANADGZQACNRTSN-UHFFFAOYSA-N 428.869 2.119 10 20 IECD CN(CC1(c2ccccc2)CC1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793729994 BJWGACIUAKHFLG-FQEVSTJZSA-N 448.567 2.195 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccc(O)cc3)cc2F)CC1 793822313 BPZUSMJXTBUFRB-QGZVFWFLSA-N 442.535 2.037 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(Cc4ccccn4)CC3)cc2)CC1 805023019 LQFWUTOYCJFRGY-UHFFFAOYSA-N 435.572 2.279 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCN(C(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 807672148 WUSRHBPFDHNYDM-QGZVFWFLSA-N 440.519 2.444 10 20 IECD COc1ccc(N2CCCN([C@H](C)C(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 917088078 NUIWRVFPVLIJMA-LJQANCHMSA-N 440.544 2.173 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccc(F)cc3)cc2)C1 918118119 VYJOKIGAMDXZRD-WOJBJXKFSA-N 442.535 2.178 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918439090 ROUGRNZFURXBFJ-UHFFFAOYSA-N 442.585 2.435 10 20 IECD CN(C)c1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1 919807748 CYRIWZYPCZXYPY-KRWDZBQOSA-N 446.529 2.378 10 20 IECD COc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccn1 1323973296 GHLQFHZYJZARCT-GASCZTMLSA-N 431.464 2.316 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=COCC1)C2)c1cc(O)c(O)c(Cl)c1 1781123553 VPVNNMKNEHMRES-DYESRHJHSA-N 436.892 2.183 10 20 IECD Cn1nncc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1807301275 JHWTZESADDSAMB-UHFFFAOYSA-N 433.896 2.038 10 20 IECD CC(C)CCC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812603837 GTHNYRNAYSSOBN-JXFKEZNVSA-N 448.614 2.384 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccn3cn2)[nH]n1)c1cc(O)nc(O)c1 1817845571 PEJLQCRXVGMMBY-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(CCc1cn[nH]c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423736 FACQZHRWNYJMHO-GOSISDBHSA-N 427.505 2.082 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCCn2ccnc2)CC1 1832154260 OKQNESZUUNWBKY-IBGZPJMESA-N 441.532 2.403 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2csc3c2CCCC3)C1 1844044332 RFKXGBNMXVIPEM-UHFFFAOYSA-N 449.623 2.304 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(CN(C)C)ccc3OC)CC2)cc1 726726105 DUSRMOMBWDBHEX-UHFFFAOYSA-N 440.544 2.489 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 735392707 IDVNOPWBKFZJQA-MRXNPFEDSA-N 440.500 2.195 10 20 IECD CCN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 737131364 NPUUMKSARZSETG-UHFFFAOYSA-N 440.519 2.424 10 20 IECD CC(C)(C)OC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 746759107 OKXGCUSTEAHZRV-IBGZPJMESA-N 437.512 2.039 10 20 IECD Cc1ccc(OCC(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cc1 748807349 MRMXREZBNAEQLA-UHFFFAOYSA-N 438.572 2.243 10 20 IECD C[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)[C@@H]1C 752318195 IGHPWDGSVWFAGU-DTVMNVQKSA-N 447.582 2.463 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-n4cccn4)c(F)c3)CC2)cc1F 754213229 IJQNVFZQEQZQSH-UHFFFAOYSA-N 441.438 2.446 10 20 IECD C[C@H](OC(=O)c1cccc(=O)n1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 757736672 GLBBPKKKVLGEMN-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)nc12 758742398 ZSIALFZPAJGGQS-UHFFFAOYSA-N 439.384 2.287 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCCN3C3CC3)CC2)cc1 765798590 RKFJMGPNPMIRJI-RJRNSMGGSA-N 426.561 2.033 10 20 IECD COC(=O)CC1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCOCC1 768550511 AXAIKYYKLLWWJD-UHFFFAOYSA-N 436.464 2.102 10 20 IECD O=C(CCC(=O)c1ccc(Cl)cn1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769559675 PXBNQTNNBMCACV-UHFFFAOYSA-N 435.933 2.249 10 20 IECD CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769849138 IKMRXKUULWIDAW-GFCCVEGCSA-N 446.572 2.150 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccc(Br)cc2C1=O 773757379 SGZZRICSSBGTQK-SNVBAGLBSA-N 433.258 2.204 10 20 IECD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1OCC(F)(F)F 774363760 MCOAUEAIIKKACK-UHFFFAOYSA-N 428.363 2.345 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](c3ccccc3)C3CC3)cc2)C1 774388253 LWDFEJSNVZRGGG-UNMCSNQZSA-N 434.540 2.272 10 20 IECD CS(=O)(=O)[C@@H]1CCCC[C@H]1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775376369 QKRLOWABKLMYBC-TZIWHRDSSA-N 447.580 2.388 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)c1 775376682 XHNDWOPEOSVJSJ-WNSKOXEYSA-N 440.500 2.026 10 20 IECD O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)N(Cc1ccco1)Cc1ccccc1O 776072633 AIRYQNCDPDIJRV-UTKZUKDTSA-N 434.514 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3cc(OC)ccc3O)CC2)cc1 778389280 GALDYQVFFTWTSI-MQNTZWLQSA-N 439.512 2.492 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(CCO)C(C)(C)C1 781960431 JDRGGZRARZCGHN-MRXNPFEDSA-N 435.524 2.178 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 782776966 DOKNGSOAHXOTPC-UHFFFAOYSA-N 428.445 2.289 10 20 IECD Cn1cnn(-c2ccc(NC(=O)C(=O)N(c3ccc(N)cc3)C3CCCCC3)cc2)c1=O 784062667 QQEMTXILEMAQIG-UHFFFAOYSA-N 434.500 2.458 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3ccc(-n4cncn4)cc3)CC2)cc1 785400687 VFRLTFORABTQQQ-SFHVURJKSA-N 448.527 2.192 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1 788964385 NJDPMRUVHZWPKF-YADHBBJMSA-N 430.593 2.033 10 20 IECD C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789802358 XDTYXWOCWHIJMK-NTPMHYTDSA-N 447.551 2.067 10 20 IECD CN(CCOc1ccccc1Cl)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789802444 ZLHNDVQDDSIUOT-UHFFFAOYSA-N 449.910 2.469 10 20 IECD Cc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789811286 DSNOKYVGHKCFSO-UHFFFAOYSA-N 429.492 2.172 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(CCCO)CC(C)(C)C)cc2F)C[C@@H](C)O1 789818383 JOZVDSLQIOSJPB-CALCHBBNSA-N 437.556 2.313 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 790912060 MDOKZWXKIAGZHA-QGZVFWFLSA-N 443.573 2.122 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CNC(=O)NCc1ccco1 791245615 CAOHDDQENOEMCX-UHFFFAOYSA-N 430.505 2.467 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc2n(c1=O)CCS2 791250144 OEQWWOKQGIPELT-UHFFFAOYSA-N 430.530 2.351 10 20 IECD CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734553 UPBZEMGZRZDWDS-DFQSSKMNSA-N 446.617 2.137 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cnccn3)cc2F)C[C@H](C)O1 795920246 WUGAJSJXABBAPN-HOTGVXAUSA-N 430.480 2.022 10 20 IECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797389579 OQAPBDJABZMLJG-UHFFFAOYSA-N 426.878 2.103 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)cc2C)cc1 797432618 KNKXTDGKCKZURM-UHFFFAOYSA-N 434.337 2.434 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1 797636302 ZRFVGEXRIUFOLO-LBPRGKRZSA-N 448.907 2.322 10 20 IECD C[C@H]1C[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCN1C 803451189 GCPLZKSHJGBOGF-YJBOKZPZSA-N 438.519 2.314 10 20 IECD C[C@H](O)CN1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H](C)C1 806877605 AZMYZSBMUNUZHZ-IKGGRYGDSA-N 426.508 2.353 10 20 IECD C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288867 AVZKSKZHSYSMLF-MJGOQNOKSA-N 442.560 2.441 10 20 IECD CCN(CC)[C@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771228 TXMONZRJSICIIK-WMZOPIPTSA-N 438.519 2.316 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F 810364585 BPRQRXKOSFWCOR-UHFFFAOYSA-N 434.443 2.059 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 810368649 CTDSGGBTTHOHAT-UXHICEINSA-N 428.533 2.397 10 20 IECD CCCc1nnc(SCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1N 813429782 HCEVJZQIJCOEJR-GOSISDBHSA-N 432.594 2.310 10 20 IECD CCOC(=O)C1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 916975594 SZXXKDQDPOFFFT-IRXDYDNUSA-N 435.540 2.331 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)cc2)C1 917833864 UNAAECJBBXXGSX-MSOLQXFVSA-N 438.503 2.197 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCS(=O)(=O)NCc3ccccc3)CC2)cc1 918080397 RRYKFBGZYVELNB-UHFFFAOYSA-N 446.573 2.037 10 20 IECD O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918294619 IJSPOFSTWJICAU-NRFANRHFSA-N 439.512 2.375 10 20 IECD Cn1nc(O)c2c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc(C3CC3)nc21 918670837 AQTOZRJLHBTEEN-MRXNPFEDSA-N 448.527 2.183 10 20 IECD O=C(CSc1nnnn1C1CCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971470 ZQGCOSGAKSHGEJ-UHFFFAOYSA-N 434.541 2.297 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nnc(S)o2)cc1 1320384831 CDAMUHUHOVWBIZ-AWEZNQCLSA-N 429.454 2.341 10 20 IECD CN1CCN(c2ccc(CNCCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2F)CC1 1320429964 OVGLUWYXTDBLHP-UHFFFAOYSA-N 436.509 2.049 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc(F)cc(F)c1 1780484099 UAXLTTOGIGJLKY-VGOFRKELSA-N 447.438 2.212 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2 1782007354 QPQNEZXFCKETFH-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H]2C[C@@H](O)C2)cc1 1797150217 ORUKIUJGXQFAOE-UUFWWEFBSA-N 437.540 2.068 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(-c2ccccc2)n1)c1cc(O)nc(O)c1 1799426087 FQVRRAKVGGOLLY-VBUUOAMHSA-N 433.468 2.244 10 20 IECD CN(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806901919 RVRFCGWUIXXJTR-FOIQADDNSA-N 446.935 2.418 10 20 IECD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)n1cccc1 1813311404 MQDYTSZORRURQT-QLVMHMETSA-N 435.484 2.270 10 20 IECD Cc1noc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722400 ZMZBSWMCXUDDAI-LLVKDONJSA-N 429.458 2.094 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1cc(O)nc(O)c1 1817844764 KMQUOWRUNXSQBA-CQSZACIVSA-N 428.474 2.221 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(F)cn2)[nH]n1)c1cc(O)nc(O)c1 1817845021 UVDZDFLWZKALIP-MRXNPFEDSA-N 440.435 2.299 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCOC1)CC2)c1cc(O)c(O)c(Cl)c1 1823713708 QGUOFJHWXHOXRU-ONGXEEELSA-N 437.905 2.470 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)C3=COCC3)sc2C1 1827245166 QDSGZJLUQUOSCV-NHEDYWLLSA-N 443.481 2.190 10 20 IECD Cc1ncncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427958 FGCADPYGGFGNNB-SFHVURJKSA-N 425.489 2.138 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CC1)CC2 1828197641 FWLUUYAUZOZNQR-SZHMKSFOSA-N 433.461 2.387 10 20 IECD C[C@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841528354 NSVJIEMJDJVNBQ-AWEZNQCLSA-N 449.623 2.231 10 20 IECD Cc1nnc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)s1 1842055088 GRLQOHFYLMTAQE-UHFFFAOYSA-N 436.921 2.361 10 20 IECD O=C(c1cnoc1C1CC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442085 WQGXLICASSJKRK-UHFFFAOYSA-N 433.468 2.162 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(Cc4nc(COC)no4)CC3)ccc21 474270539 XSZLPMCZHVBDOJ-UHFFFAOYSA-N 441.532 2.392 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(F)ccc3N3CCOCC3)CC2)cc1 730775343 VKOHQNPPADERTR-UHFFFAOYSA-N 442.535 2.223 10 20 IECD CC(=O)NC[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751062875 GGCSILJMEWUFOS-CQSZACIVSA-N 437.543 2.243 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(c4ccccc4O)CC3)CC2)cc1F 753856685 JBRHEZFVYLKJHR-SFHVURJKSA-N 442.535 2.399 10 20 IECD C[C@@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 768242839 SRBIPLJAWBUHBE-PBHICJAKSA-N 431.455 2.223 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 770227108 FDYPKPXPHNEFGY-UHFFFAOYSA-N 426.441 2.067 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F)c1ccc(N2CCOCC2)cc1 772991833 XAQSAMBFTPAWDK-GFCCVEGCSA-N 425.411 2.091 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1 774361412 CCNPYLDXFWWGCI-UHFFFAOYSA-N 435.484 2.380 10 20 IECD CCOCCCN1CC[C@@H](NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 775926781 AGRUFHMIXPOFJX-NFBKMPQASA-N 432.609 2.070 10 20 IECD O=C(NCCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O)c1cccc(O)c1O 776614546 FYXNTXAYRGUWNV-SXGWCWSVSA-N 428.422 2.293 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(=O)n(-c2ccccc2)n1 777828646 NRFLMBIUYAFJNS-UHFFFAOYSA-N 427.844 2.407 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CSCc3cccc(C(N)=O)n3)cc2F)C[C@@H](C)O1 779837423 POKBFDQMTKPVFX-HUUCEWRRSA-N 446.548 2.483 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(OC[C@H]3CCOC3)CC2)c1 783999256 MSHPPJQWYXWJJD-IBGZPJMESA-N 432.561 2.445 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1CN1CCSCC1 785296671 HNCLQYYUWNAJDL-HNNXBMFYSA-N 429.542 2.333 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)cc2)CC1 786256295 CZTGQDAZDLTFMH-QFIPXVFZSA-N 434.540 2.020 10 20 IECD COC(=O)COc1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 788961219 UBAZGQVKGJRWSU-UHFFFAOYSA-N 433.436 2.412 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3nc(C4CCC4)cs3)cc2)C1 789382715 PAXHGOPCOGDUGM-INIZCTEOSA-N 441.557 2.367 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc4ccccc4c(=O)n3C)CC2)cc1 794821013 ARFOQLIQJNXMRZ-UHFFFAOYSA-N 434.540 2.489 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(C)c1Cl 799835507 VRNZJKITKPVIME-UHFFFAOYSA-N 449.960 2.447 10 20 IECD CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(S(C)(=O)=O)CC1 801909029 BQRMLIVRCMLWBO-UHFFFAOYSA-N 428.562 2.454 10 20 IECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 803618094 NPSBUOIGEMVYEM-JOCHJYFZSA-N 430.593 2.252 10 20 IECD CCc1noc(CC)c1CNC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007121 OBFONVXQCUBNTJ-UHFFFAOYSA-N 445.539 2.013 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCSC(C)(C)CC3)cc2F)CC1 805009393 JUYILIPNSXITHW-UHFFFAOYSA-N 436.597 2.328 10 20 IECD CCNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806494137 LPPZQONXQXKURV-UYAOXDASSA-N 445.564 2.199 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@H]3COC(=O)N(C)C)CC2)cc1 806620512 YKZJNLOIGARZBR-FQEVSTJZSA-N 447.580 2.080 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292606 UYCJQNQYTGEMHE-UHFFFAOYSA-N 438.503 2.176 10 20 IECD Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 916679926 BTWRHZHKVQICCC-UHFFFAOYSA-N 425.468 2.393 10 20 IECD O=C(Cc1ccccc1)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224957 XEQLBUVRVLGJOY-UHFFFAOYSA-N 440.519 2.259 10 20 IECD CN(C)C(=O)c1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294048 CAIVYLCCBBBNSM-QGZVFWFLSA-N 425.485 2.240 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(F)c3F)cc2)C1 918463001 GDNZEPVFVZTFEC-ZDUSSCGKSA-N 434.418 2.061 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)NC4CC4)C3)cc2F)CC1 1116004176 IJNHRKSJAPDMBO-SFHVURJKSA-N 431.556 2.168 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1318604446 HKOJRSMETCRXHT-AWEZNQCLSA-N 439.484 2.154 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCC(OC[C@H]2CCCO2)CC1 1330407884 DPKLJQOBNFRXGF-GMNCBBECSA-N 435.517 2.443 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(Br)c(C=O)n3C)CC2)cc1 1339771598 KXVMOCODZZQVCC-UHFFFAOYSA-N 449.349 2.161 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1341962092 COZCERHHWYHWBV-JOCHJYFZSA-N 426.517 2.145 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2 1785509829 GTOIDZJMDQDBDB-ISJXGEBLSA-N 428.485 2.003 10 20 IECD CC(C)(C)c1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cn1 1797265785 PMURSEIMBKORSG-QDMKHBRRSA-N 425.489 2.146 10 20 IECD CC(C)(C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805452551 ZPFOJDSFMGQRKG-PVHVJQTOSA-N 446.544 2.455 10 20 IECD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806934375 VLZGPZUQWHQLKW-JTSKRJEESA-N 440.500 2.024 10 20 IECD COc1ncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cc1F 1810543103 VNXQBWYUAQDTPF-UHFFFAOYSA-N 444.463 2.194 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)C3CCCC3)C2)C1 1839431784 MVLGRLBZNIAPJO-OAQYLSRUSA-N 438.908 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](C)(C4CCCCC4)C3=O)CC2)cc1 4265775 KAIMNHSVACTLHT-QHCPKHFHSA-N 428.533 2.235 10 20 IECD COc1cc(C(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)cc(OC)c1OC 106158775 DDMDXCWIXUVUMX-UHFFFAOYSA-N 427.501 2.359 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1 109701873 KUTJEGJKXWEQIY-GGAORHGYSA-N 449.555 2.380 10 20 IECD C[C@H](NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(=O)O 210686628 OFBBDBGYYAKVRD-KIFNTFBYSA-N 429.317 2.240 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 734406092 MMIMVUKSCUHQAN-NGHDKMLMSA-N 434.540 2.481 10 20 IECD Cc1nc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccn12 741352570 DTCPZJANEPNNTC-UHFFFAOYSA-N 426.448 2.092 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)c(F)c(F)c3)cc2)C1 741426390 IDFIMYXWVHCNEJ-CYBMUJFWSA-N 434.418 2.061 10 20 IECD CN(C)C(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 743553645 ORJFDGARTROJHS-UHFFFAOYSA-N 428.508 2.406 10 20 IECD C[C@H](CC(N)=O)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 748718260 HOQHCJCYNFAKQX-SZJBZFAYSA-N 442.360 2.030 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)CCn3cc(S(N)(=O)=O)cn3)c2C)c1 749324581 JYSZFVOOYBPODW-UHFFFAOYSA-N 444.513 2.063 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)CCC4)cc2)C1 750253291 LVPWODNWWGXHLT-SFHVURJKSA-N 448.523 2.162 10 20 IECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753732207 RMDRNIRTYDNZPM-MRXNPFEDSA-N 434.472 2.324 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(F)ccc3NS(C)(=O)=O)CC2)cc1F 753741245 FKPHJCDEPVBWLZ-UHFFFAOYSA-N 425.457 2.307 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)CS4)CC2)cc1F 754209634 BGWSCSIMKAQVBZ-UHFFFAOYSA-N 444.488 2.166 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc(OC)c1OC 759406723 WSLRHQOREMSOOA-UHFFFAOYSA-N 449.454 2.069 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(F)c(F)c3)CC2)cc(OC)c1OC 759408435 AZCJLJQPVKTJTK-UHFFFAOYSA-N 435.427 2.278 10 20 IECD COC(=O)C1=C(COC(=O)/C=C/c2ccc(O)c(O)c2)N(C)C(=O)N[C@@H]1c1ccccc1 759590993 YQNDVSKUSPRRPS-FKVRIVCVSA-N 438.436 2.478 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c(OC)c1 761253201 YDAKWIDNUFSVLD-UHFFFAOYSA-N 441.575 2.391 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c(C)n1-c1ccc(Br)cc1 764515948 VMUVCJGWLRJXEL-MRXNPFEDSA-N 431.290 2.233 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCC1(N2CCOCC2)CC1 764763368 KVWDSDOHFCNFKY-UHFFFAOYSA-N 442.482 2.206 10 20 IECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2cccc(Br)c2O)s1 765535214 OEEBDCCUEUZRRY-UHFFFAOYSA-N 448.364 2.302 10 20 IECD CCc1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1S(C)(=O)=O 765717279 PYCKGZJHQWLKED-UHFFFAOYSA-N 445.585 2.213 10 20 IECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771062503 ACBQHTVIMWRRNQ-KRWDZBQOSA-N 448.951 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ncc(Cl)s3)CC2)cc1 774717147 ZGAKUHYBCLBVBT-UHFFFAOYSA-N 429.951 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CCC(=O)N4C)CC2)cc1 778261201 BBYMLZZGOPUINS-BENRWUELSA-N 448.523 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@@H]3c3ccc(C)o3)CC2)cc1 778283296 FDUXQOJFROOMFF-VFCOFNOGSA-N 439.512 2.402 10 20 IECD COC(=O)[C@H]1[C@H](O)CCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 781959338 UTJBNEFWQYSINA-XMSQKQJNSA-N 428.485 2.046 10 20 IECD CCOc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c([N+](=O)[O-])cc1OCC 785292922 CNHQPEFUNWLRJA-GFCCVEGCSA-N 447.444 2.489 10 20 IECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295634 XWWYDLDBTOYNJT-LLVKDONJSA-N 440.905 2.231 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCSc3ccccc3)cc2F)CC1 785424685 LDNHPRDQFCNPLM-UHFFFAOYSA-N 444.576 2.492 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccnc1 789813365 UEDBHOJUJUIIDQ-LJQANCHMSA-N 428.508 2.230 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@]3(CO)CC(C)C)CC2)cc1 789873727 NFAXFXQCNUYJMH-OPSAWKISSA-N 429.561 2.300 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cnc4n3CCCC4)cc2F)C[C@@H](C)O1 792242434 KUTMATPDVPFEKD-IYBDPMFKSA-N 444.507 2.445 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)C1 793718834 KMQFUNSZVUWELE-NLFFAJNJSA-N 438.572 2.353 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccccc3)cc2)C1 793718925 KQMZFQHGQKKHBL-RBBKRZOGSA-N 434.540 2.368 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)C1 793729574 AHMAVFRTWKPHJU-FCHUYYIVSA-N 448.567 2.096 10 20 IECD CC(C)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793734211 RJOOYOVQRJZSIP-OAQYLSRUSA-N 436.556 2.444 10 20 IECD COc1ccc(O)c(CNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)c1 798410932 CQYUXUFRVUHBEX-UHFFFAOYSA-N 427.910 2.222 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](CO)CC3CCCC3)CC2)cc1 799052821 LAZFILLHBWPYPN-PISNEZEASA-N 429.561 2.205 10 20 IECD CN(C)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc1F 799563518 DEMXNKKSFCPXMZ-UHFFFAOYSA-N 446.907 2.462 10 20 IECD COc1ccc(N2CCN(C(=O)CN(CCNC(C)=O)Cc3ccc(C)s3)CC2)cc1 801561726 QNVZGWOVGOSRTP-UHFFFAOYSA-N 444.601 2.352 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H](CCCO)c1ccccc1)c1ccc(N2CCOCC2)cc1 803299936 OWDNNZRHUNEGED-GCJKJVERSA-N 425.529 2.330 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(CCCc4ccccc4)C3=O)ccc21 803685462 AVCOEYBWNHXBEG-JOCHJYFZSA-N 448.567 2.035 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803686307 HAGYZPBWDHKZKU-UHFFFAOYSA-N 448.567 2.415 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)c3c(C)noc3C)cc2F)CC1 805008088 ZPYDTHXSIAHTQI-OAHLLOKOSA-N 445.539 2.109 10 20 IECD CCN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCN(c2ccccc2)C1=O 806281656 FPQCNZDBYKAJPM-INIZCTEOSA-N 432.571 2.396 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NCc1ccc(N2CCSCC2)cc1 810161357 JQOAOLPHSGZYHT-HXUWFJFHSA-N 429.590 2.353 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc(OC)c1OCC(N)=O 917385570 ASMKUFPKXFABJZ-UHFFFAOYSA-N 445.541 2.051 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 918304310 VAVGCUBBIJVCDG-UHFFFAOYSA-N 444.557 2.134 10 20 IECD C[C@H](Cn1ccnc1)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919784225 MUKZYACXPRMODV-QGZVFWFLSA-N 438.511 2.027 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CC1 919815112 SFFSWTNSKYELRQ-UHFFFAOYSA-N 432.546 2.154 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cc2)C1 921283156 ZCLZTEDPDMMEOP-KRWDZBQOSA-N 448.483 2.412 10 20 IECD CC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C=C/c3ccc(O)c(O)c3O)C2)CC1 1783219964 KWYOBIJUFUPNBT-RYNBQMKOSA-N 430.501 2.131 10 20 IECD CCc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)co1 1790244727 AADULFCTKYHCHV-BNLOLNQZSA-N 449.891 2.209 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)C(C)C)cc1 1793078285 XPNKNWXZKMGTMK-IRMYBRCSSA-N 439.556 2.314 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1797258141 VWLREXMFLRZDQR-RZDUQXNZSA-N 443.544 2.303 10 20 IECD CC(C)CCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189985 NILLTWMZNBYNLA-OXQOHEQNSA-N 448.614 2.384 10 20 IECD CCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844209 TVCUAUZIAQBRAH-AWEZNQCLSA-N 425.449 2.052 10 20 IECD COC1(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CCC1 1817848684 XEFHZSVKXMPDFU-HNNXBMFYSA-N 429.477 2.481 10 20 IECD Cc1cc[nH]c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496662 OGPNSSHJTUDFHG-ZDUSSCGKSA-N 446.558 2.212 10 20 IECD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)ccn1 1829276308 PWFSZSCHXNUHCO-GOSISDBHSA-N 440.500 2.444 10 20 IECD CC(C)(C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccccn1 1843442221 HGCONALEYBFXHU-UHFFFAOYSA-N 445.523 2.356 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@]4(CCCC[C@H]4C)C3=O)CC2)cc1 108432218 OLZOLMUZWSQFEY-HXOBKFHXSA-N 428.533 2.235 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)sc2C)cc1OC 729666681 ZFFLTYWXRJGQCU-UHFFFAOYSA-N 434.517 2.326 10 20 IECD CCCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738897520 VZHHOIUMNDUHCV-UHFFFAOYSA-N 444.557 2.383 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3c(F)cccc3F)cc2)C1 741081120 LLYXIVGVVSFCTJ-DNVCBOLYSA-N 432.471 2.199 10 20 IECD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NCc1ccc(N2CCSCC2)cc1 743861448 SHUKEVBJBIPSJP-UHFFFAOYSA-N 448.548 2.493 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O 746340298 YEMZYXSQVHRFIU-QGZVFWFLSA-N 428.455 2.218 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 749106069 PYTQCOAPUSTNNM-CYBMUJFWSA-N 440.543 2.419 10 20 IECD CC(=O)NC[C@@H]1CCn2ncc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2C1 753213038 XMXHWXBJCJHIAV-IEBWSBKVSA-N 426.517 2.109 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753832884 RCWNOTLCWRCRHE-UHFFFAOYSA-N 430.480 2.451 10 20 IECD COC(=O)COc1cccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753919252 KHYZLJZUFJQQLU-UHFFFAOYSA-N 431.464 2.418 10 20 IECD CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 755576304 YPSPQSHQAGQBRO-UHFFFAOYSA-N 448.391 2.382 10 20 IECD CC(C)n1ncc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1N 757872491 BWMOXYWMLXMRPA-UHFFFAOYSA-N 438.511 2.232 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759877289 FWLCWXPTEAXCEZ-UHFFFAOYSA-N 430.461 2.381 10 20 IECD COc1cc(N2CCN(Cc3cc(=O)n4c(C)csc4n3)CC2)cc(OC)c1OC 759887126 UGGROUYRBPBOTC-UHFFFAOYSA-N 430.530 2.412 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)Nc1cc(-n2cnnn2)ccc1F 760839567 AMQAWSFZXVCEMN-QGZVFWFLSA-N 426.452 2.127 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 762929988 RWHSUJQLGOWZPI-NDEPHWFRSA-N 435.571 2.122 10 20 IECD CNS(=O)(=O)[C@@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 775697136 VGTVDADZWDSDEN-LLVKDONJSA-N 442.173 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)N3CCCC[C@@H]3C)CC2)cc1 778234204 NPCJILPUEUGXGN-ARZGSZHJSA-N 428.577 2.279 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCCN(C(=O)C4CCCC4)C3)CC2)cc1 781521958 SJNSZGOBLSNPPI-NRFANRHFSA-N 435.590 2.328 10 20 IECD COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 785499440 LVQQGEUXXWWGBW-HNNXBMFYSA-N 445.491 2.173 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1cc(F)ccc1F 787041522 QLNWUYOGMOOMMA-UHFFFAOYSA-N 442.510 2.429 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 788312276 GIQAKSGNTUXAED-FCHUYYIVSA-N 441.503 2.315 10 20 IECD CCc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CCO2)cc1 788312611 KXFHUGXPCNZPEJ-QHCPKHFHSA-N 437.540 2.302 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803297244 OFUCLDHGFLBFCN-HXUWFJFHSA-N 436.556 2.045 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccccc1-c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 803299065 YMCHHWXUFAGVLB-SFHVURJKSA-N 447.539 2.417 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@](C)(O)c3ccccc3)CC2)cc1 804319937 VUCIHKQDHICEJY-DEOSSOPVSA-N 425.529 2.194 10 20 IECD COc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc(OC)c1OC 807387407 JKYJJLCHSSHSHR-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCC1(CNC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCCC1 807913070 VBKFZPCMCWRFGT-UHFFFAOYSA-N 433.549 2.448 10 20 IECD COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)C(C)=O)c1 808486229 LJUXNOFSJWYDPI-UHFFFAOYSA-N 439.873 2.489 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC1CCN(CC(F)(F)F)CC1 808751843 MIFGFZIDWXKDND-UHFFFAOYSA-N 428.499 2.492 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CC[C@H](C(=O)OC)CC4)n3)CC2)cc1 809465086 RLPXPMXBWLPSGB-QAQDUYKDSA-N 442.516 2.416 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccccn4)CC3)cc2F)C[C@H](C)O1 916981685 LVVUYUKLFRUSEQ-OALUTQOASA-N 441.551 2.273 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(NC(=O)C4CC4)CC3)cc2F)C[C@@H](C)O1 917056060 NGDMQIGIOYDHDS-CALCHBBNSA-N 446.567 2.046 10 20 IECD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1[N+](=O)[O-] 1800137059 BBTNCDZFCZMXJM-BJWYYQGGSA-N 440.456 2.204 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)ccn1 1807996091 XSYMCLPHFWNVNO-UTKZUKDTSA-N 433.468 2.225 10 20 IECD CN1CC(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1813605580 CNHROUWWAKXXHS-AUUYWEPGSA-N 444.919 2.027 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817848416 IKTCVWMJAXUILT-XJKSGUPXSA-N 439.476 2.288 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cn[nH]c2)CC1 1825185177 HMOUMQGLRKWNCC-GOSISDBHSA-N 427.505 2.082 10 20 IECD O=C([C@H]1CC1(F)F)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902065 IRTKZEBBQJAOJA-ZIAGYGMSSA-N 445.557 2.122 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(F)F)CCO3)cc1 1834917299 DJZYZKFAMRNGDZ-QHCPKHFHSA-N 447.482 2.429 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccc3nc[nH]c23)C1 1843252373 ZUHZNNWPJIADDP-UHFFFAOYSA-N 442.479 2.173 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])CC2)cc1 56965680 QZSDTTHHRXGVMI-UHFFFAOYSA-N 444.488 2.173 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(c3nc(-c4ccccn4)no3)CC2)c1 726625535 JNOSOGNQPCJKBT-UHFFFAOYSA-N 443.485 2.229 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(C)c(OC)c3C)CC2)cc1 743433179 YFIHVHXOWWSPAF-UHFFFAOYSA-N 440.544 2.198 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCN([C@@H]2CCC[C@H]2O)CC1 745903151 DLEWEEGFHHSVOV-NSISKUIASA-N 438.519 2.497 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC3CCN(CCOC(C)C)CC3)CC2)cc1 747585635 QRZLRCKTRJTYMS-UHFFFAOYSA-N 447.624 2.006 10 20 IECD Cn1cc(N2CCN(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2=O)cn1 750650618 INPHOHHYQUVQOZ-HNNXBMFYSA-N 448.474 2.049 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1 760860296 FDCIIRSVXXQCOH-JOCHJYFZSA-N 435.528 2.458 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1cccc(S(=O)(=O)NC2CC2)c1 771831139 GCLXUTDGTLYQIK-UHFFFAOYSA-N 435.889 2.455 10 20 IECD COC(=O)[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccnc1 771897945 LGFJFBMSPIQZNR-OAQYLSRUSA-N 436.491 2.341 10 20 IECD CN1[C@H]2CC[C@H]1CN(C(=O)C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 774231460 RPDZBLFKMRUEGN-RYRKJORJSA-N 436.503 2.068 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)C(=O)C1 777397409 WUOJJUCRTBPDPJ-LKUPDRCFSA-N 445.516 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(c4cccs4)CC3)CC2)cc1 778325122 JRTDENPOOYZLGY-CMDGGOBGSA-N 440.569 2.310 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 779223384 KEYLYKDDSWLYKP-OAQYLSRUSA-N 448.608 2.121 10 20 IECD COc1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1[N+](=O)[O-] 780409245 VGUPQDRNINHTFG-UHFFFAOYSA-N 434.474 2.073 10 20 IECD CC(C)(C)OC(=O)N[C@H]1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 783833885 GHQBMLUVASHGLZ-STQMWFEESA-N 427.523 2.329 10 20 IECD Cc1nc(Cn2nnc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)no1 787451659 XODIJWPRCBKMGF-MRXNPFEDSA-N 445.911 2.080 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCC34CCN(C)CC4)cc2F)C[C@@H](C)O1 789825712 OBWBVICJXIHDAN-HDICACEKSA-N 446.567 2.142 10 20 IECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCN1C(=O)OC(C)(C)C 803664349 LDEHUZHXELKTLG-HOCLYGCPSA-N 436.528 2.412 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N(Cc1cccnc1)C1CC1 808851534 DZBUBTHKEQDUEQ-UHFFFAOYSA-N 447.583 2.421 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)CC2)cc1 809522550 GYJUJLFBDIKDNE-CEXWTWQISA-N 435.615 2.230 10 20 IECD COc1ccc(N2CCN(CCCNc3noc4ccc(S(N)(=O)=O)cc34)CC2)cc1 820609570 HXZUBXNDHNXZLY-UHFFFAOYSA-N 445.545 2.108 10 20 IECD CN(C)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 864049632 MCGSNWJTEXDFRL-UKTHLTGXSA-N 428.377 2.328 10 20 IECD O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 917708846 IHTLGMMFEIAZQJ-UHFFFAOYSA-N 440.475 2.044 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1n[nH]cc1I 1255040336 ATJQCDDTKRJLCT-UHFFFAOYSA-N 444.248 2.045 10 20 IECD O=C(C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccc1 1782005012 SQGFIKBMLKPJSP-QFIPXVFZSA-N 444.871 2.078 10 20 IECD COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1794869361 UOTALIMUNPFJGB-XFLCEESOSA-N 439.468 2.172 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)c1cccs1 1802860555 QQYDKVNEIDBKLY-FQUUOJAGSA-N 437.612 2.350 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CCCN(C(=O)C(O)O)C3)CC2)cc1 1805283417 YGWSLYOKDRRZDS-UHFFFAOYSA-N 425.529 2.250 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n(C)n1 1817846073 HWSOOGQEFPPDBY-HNNXBMFYSA-N 439.476 2.132 10 20 IECD Cc1n[nH]c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819663514 QKAHHRKQJKMJPQ-CQSZACIVSA-N 425.449 2.176 10 20 IECD O=C1CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1826537737 JZFOFLZDIHXTMP-DLBZAZTESA-N 449.935 2.263 10 20 IECD Cc1nnsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827816968 XNWWVKLRSGCISG-HNNXBMFYSA-N 431.518 2.200 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(Cl)c(F)c2)C1 1845309575 BAYAFOTYFVPXOT-UHFFFAOYSA-N 441.937 2.156 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c(Cl)c1 1846812566 YCOHKBJQWNRWFX-UHFFFAOYSA-N 437.974 2.326 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(OC)c(OC)cc3OC)CC2)cc1 23472113 BHTYIXHKNSFWOO-UHFFFAOYSA-N 444.484 2.227 10 20 IECD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c(O)c1O 110004311 FTSWZBWPUSHDGK-CYBMUJFWSA-N 436.486 2.277 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)c(C(=O)O)c2)cc1 327297534 PEKXMDHNZSZCNP-UHFFFAOYSA-N 449.304 2.320 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CCC(N)=O)C3)cc2F)C[C@@H](C)O1 727157459 IUMIKFCUBAADTB-FGTMMUONSA-N 434.556 2.033 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCCN(C(=O)C(C)C)CC3)CC2)cc1 727938267 JXSVCVCXUWAWNN-UHFFFAOYSA-N 445.608 2.107 10 20 IECD O=C(CNC(=O)OCC(F)(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732059190 VPWKHCJQLQPZRZ-UHFFFAOYSA-N 443.344 2.447 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1n[nH]cc1Br 738477004 DOSDUQUYGSRJJP-UHFFFAOYSA-N 426.290 2.272 10 20 IECD CC(C)CC(=O)NCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 741549512 OWQAKLUWCROBOW-UHFFFAOYSA-N 442.539 2.111 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc4c(c3)OCCO4)CC2)cc1 742947615 JGPHCEYCVLOTHJ-UHFFFAOYSA-N 440.544 2.430 10 20 IECD CCNC(=O)c1cccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743287504 JIWRWHQQDGNMOO-UHFFFAOYSA-N 425.533 2.389 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)OC)c(C(=O)OC)c1 743890267 WIGVPLAWEQRVNE-UHFFFAOYSA-N 441.484 2.313 10 20 IECD CCOC(=O)c1ccsc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 743893397 VFKGNBZWGIDNTP-UHFFFAOYSA-N 445.541 2.388 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)[C@H](C)c3ccc(C)cc3)CC2)cc1 745753405 CKCLVYOSTJHCPJ-WZONZLPQSA-N 426.513 2.360 10 20 IECD CCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 746354399 JKCOOFNDQHWRTL-UHFFFAOYSA-N 439.438 2.403 10 20 IECD COc1cc(OC)cc(N2C[C@@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)c1 752518591 ZKCLJBWHDAQZHO-SFHVURJKSA-N 439.512 2.210 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](c4nncn4C(C)C)C3)CC2)cc1 754072363 UISDCZHPNMTEJY-IFMALSPDSA-N 442.608 2.230 10 20 IECD COc1cc(N2CCN(C(=O)NCCCN(C)CC(F)(F)F)CC2)cc(OC)c1OC 759222096 XRGSMWOEJOFMIV-UHFFFAOYSA-N 448.486 2.428 10 20 IECD COCCCN(C(=O)/C=C\c1ccc(Cl)nc1)c1c(O)nc(=O)n(CC(C)C)c1N 759769328 SRROCBMPODGPPW-VURMDHGXSA-N 435.912 2.318 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc4c(c3=O)CCCC4)cc2F)C[C@@H](C)O1 760330004 VPXGHVRVHUTAKS-IYBDPMFKSA-N 428.508 2.191 10 20 IECD CN1[C@H]2CC[C@H]1CN(C(=O)C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 774181829 UNLQYTWVXMTTRG-WMZOPIPTSA-N 436.503 2.068 10 20 IECD O=C(OCCN1C[C@@H]2CC[C@H](C1)O2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407063 DDVLMJVVZWUESC-GASCZTMLSA-N 438.527 2.275 10 20 IECD CN(Cc1cc2c(cc1OC(F)F)OCO2)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422593 OLGLLLDAUROLFP-UHFFFAOYSA-N 435.427 2.358 10 20 IECD CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786261352 BECGJVCEILKUNL-UHFFFAOYSA-N 429.542 2.079 10 20 IECD O=C(NCCc1ccccc1Cl)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786684269 WRJAMQGFLXUSIN-UHFFFAOYSA-N 433.911 2.415 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1)C[C@H]1CCCO1 788319120 ARQSFXHHBWVHKK-HSZRJFAPSA-N 437.540 2.347 10 20 IECD O=C(NCCSCc1ccnc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 788331746 KOVIFEIMAVRKDP-UHFFFAOYSA-N 448.976 2.237 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H](C)[C@H]1OC 789800398 ONZGJZADBUFNNY-CWFSZBLJSA-N 435.540 2.234 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823750 FXFCVHZKKZIYTR-KURKYZTESA-N 434.556 2.046 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CC[C@H]3CCCCN3C)cc2F)C[C@@H](C)O1 789824313 IACKAEPPIAWFTH-WSTZPKSXSA-N 448.583 2.388 10 20 IECD C[C@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN(C(=O)OCc2ccccc2)C1 794228761 IHODQNBTOSONIS-NRFANRHFSA-N 447.513 2.295 10 20 IECD CCOc1cc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1OC 805744411 VEXODXZKGSAFLA-UHFFFAOYSA-N 441.528 2.458 10 20 IECD C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 806683711 BNPPBLGQZZPYKN-JKSUJKDBSA-N 426.508 2.353 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)Oc3cccc(OC)c3)CC2)cc1 807631120 FKJSXUBSLCZUNF-GOSISDBHSA-N 441.528 2.326 10 20 IECD Cc1cc(CN2CCN(S(=O)(=O)c3ccc4nc(O)[nH]c4c3)CC2)ccc1N(C)C 815014181 YPNYATJMBBMZRT-UHFFFAOYSA-N 429.546 2.149 10 20 IECD C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)CN(C)C 816833494 KITCUPDDPAEUBZ-ZDUSSCGKSA-N 436.490 2.029 10 20 IECD CCc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n[nH]1 914955976 DSKJIZWONHGYIZ-UHFFFAOYSA-N 430.486 2.067 10 20 IECD NC(=O)CCCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 915284824 LOCYNPLGDNQIAS-WQLSENKSSA-N 442.360 2.032 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 917207842 LTQJOLFDLDIJFO-UHFFFAOYSA-N 446.573 2.096 10 20 IECD CC(C)Oc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918440358 QLBIGSMROUUXBR-UHFFFAOYSA-N 430.480 2.224 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 918632665 ARBFRWWWECGTJS-NUJGCVRESA-N 441.569 2.117 10 20 IECD CC(C)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1783120667 FTTXRFTXRVTGDK-QHCPKHFHSA-N 426.517 2.045 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H]4C=CCN4)C[C@@H]32)cc1 1790126716 JLAVAQFQDOGRSQ-BIHRQFPBSA-N 448.567 2.215 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(Cl)cn1 1794884007 YATKAEUQCQWDOO-BPQKRJORSA-N 444.875 2.212 10 20 IECD Cc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334514 LCBKLERJYXDVNA-QDMKHBRRSA-N 435.546 2.246 10 20 IECD Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1805767242 VGYOFXYDMODGPT-HRAATJIYSA-N 433.468 2.225 10 20 IECD Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807989765 CMDBCPOSSHSOEH-IIBYNOLFSA-N 433.468 2.225 10 20 IECD Cc1occc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816438245 OZNVYKYMFJJHDM-CQSZACIVSA-N 447.542 2.477 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)ccc3F)sc2C1)c1cc(O)nc(O)c1 1823283465 AYGLOUMIXAJSGY-SNVBAGLBSA-N 444.444 2.334 10 20 IECD O=[N+]([O-])c1ccc2c(c1N1CCN(S(=O)(=O)c3cccc4nsnc34)CC1)CCN2 436260641 MTPNGLLPWLSTDZ-UHFFFAOYSA-N 446.514 2.078 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)ccc1[N+](=O)[O-] 462921232 DIMNBECDOCSCBW-UHFFFAOYSA-N 435.487 2.119 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726695795 YEOQBZVRSFYZPK-UHFFFAOYSA-N 440.500 2.389 10 20 IECD C[C@H]1CC[C@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 729596871 MMZJVUSTSIVUJJ-PMACEKPBSA-N 447.599 2.362 10 20 IECD CN1C(=O)CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 729785014 CTKNVXCNFIQKAM-LJQANCHMSA-N 437.496 2.448 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCOc1ccc(S(C)(=O)=O)cc1 730066390 JKVQKDYIGLGUIY-UHFFFAOYSA-N 447.557 2.147 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)CC1 730194897 XQPMXQXNROVDKI-IBGZPJMESA-N 439.535 2.028 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)cc1C 730569940 CGXFUTZZMXLGBV-IBGZPJMESA-N 432.590 2.399 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)S(=O)(=O)N=C2N=CNN23)cc1F 731830112 XBYRLGVJYPDSBZ-UHFFFAOYSA-N 444.492 2.013 10 20 IECD C[C@@H](NC(=O)N(C)[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732885119 PMPMEGKBPDEFFU-RHSMWYFYSA-N 428.455 2.389 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 733369889 XZXGFQBMUSQUPW-UHFFFAOYSA-N 432.521 2.257 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 734557595 IEHZEWROGLYNHY-HXUWFJFHSA-N 431.558 2.448 10 20 IECD O=C(Nc1ccn(CC(F)(F)F)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 746363239 OUSIXAQOYFSNBR-CQSZACIVSA-N 426.395 2.297 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)o1 748061867 WXJQUEDJQROVDP-UHFFFAOYSA-N 439.509 2.216 10 20 IECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)N3CCN(c4ccc(OC)cc4)CC3)ccc2O1 751966292 IKVVMUWHIBQBRL-OAQYLSRUSA-N 446.525 2.073 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](c4cccc(F)c4)C3)CC2)cc1 754028789 BTKFXDGSGCHIMQ-LADGPHEKSA-N 429.536 2.391 10 20 IECD COC(=O)c1cccc(CC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 758143693 ABFXRUZXIGHPBL-UHFFFAOYSA-N 425.529 2.353 10 20 IECD COc1cc(N2CCN(C(=O)NCCc3cn4ccccc4n3)CC2)cc(OC)c1OC 759217840 XLFWHYHOZXHVDJ-UHFFFAOYSA-N 439.516 2.434 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc2c(c1)COC2 759725265 BTJQFBKLAAVPMM-UHFFFAOYSA-N 431.558 2.498 10 20 IECD CN(C)c1ccc(CN(C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)C2CC2)cc1 760792488 ABLHQEPJXOFPGX-UHFFFAOYSA-N 432.546 2.155 10 20 IECD CN(C)c1ccc(CNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1F 760810407 TWCXAMFVONEEDP-GOSISDBHSA-N 436.528 2.414 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1 761652971 YUFSATUYNTZIFC-UHFFFAOYSA-N 433.408 2.303 10 20 IECD COc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 761919300 PHEHOLBOCULNKV-UHFFFAOYSA-N 425.464 2.400 10 20 IECD CC(C)C[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768513043 VJGYYFXTVMJHEF-LNPFQXMTSA-N 448.539 2.412 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@@H](C)CO1 769674868 SDQUCXDNRDJDGP-STQMWFEESA-N 435.458 2.351 10 20 IECD COc1ccc(S(=O)(=O)N2CCCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1 770355099 KZGCXDVNDUAMDW-UHFFFAOYSA-N 445.585 2.428 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773845463 HCEZFTVHPFQLTG-QGZVFWFLSA-N 438.528 2.349 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(OC)cccc2OC)cc1OC 775273625 NUMNGWWIDLSFLO-UHFFFAOYSA-N 430.504 2.275 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(S(=O)(=O)N(C)C)oc1C 777829512 ZHGNCLZALHWPTO-UHFFFAOYSA-N 444.893 2.013 10 20 IECD COc1c(C)cc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1C 786122316 RMJINJOINMNLAF-UHFFFAOYSA-N 431.558 2.459 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCSC(F)(F)F)cc2F)C[C@@H](C)O1 788539095 LAUJOJPAXIBYRQ-TXEJJXNPSA-N 437.459 2.425 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823075 YOZMBILDCGPZOH-HDICACEKSA-N 436.572 2.102 10 20 IECD CCCN(CCCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789835022 MXTXXJSLPNVQEV-HDICACEKSA-N 436.572 2.246 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@]4(CCO[C@@H]4C)C3)cc2F)CC1 790717834 DLVRVZVHZVIJLK-YZZKKUAISA-N 434.556 2.446 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(O)c1 797389726 WAVYNBMWTPWSOP-KBPBESRZSA-N 431.464 2.408 10 20 IECD Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 802018403 MLKNSBCJNJOGMI-UXHICEINSA-N 439.535 2.332 10 20 IECD COCC1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCC1 803734812 PHNASVAIOVZPQP-UHFFFAOYSA-N 435.458 2.400 10 20 IECD COc1c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(Cl)cc1C(=O)N(C)C 803801831 KSZDQALQLVSYCW-UHFFFAOYSA-N 441.893 2.380 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1 804389680 JMIHJPOZPHTEJI-INIZCTEOSA-N 447.557 2.259 10 20 IECD CC[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 805771844 BIDIGIIIXANYSH-ZBFHGGJFSA-N 440.521 2.298 10 20 IECD O=C(NCc1cccc(Br)c1O)NC[C@@H](N1CCOCC1)C(F)(F)F 805847852 FTZWOKDNCSHSIN-GFCCVEGCSA-N 426.233 2.217 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCCN1C1CCCCC1 806788941 YUKJGZUTGHOJSU-QHCPKHFHSA-N 442.604 2.395 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2c(F)cccc2OC(F)(F)F)ccc1O 808110258 DYSRIDAWJNKOBL-UHFFFAOYSA-N 444.384 2.139 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 810368650 CTDSGGBTTHOHAT-VQTJNVASSA-N 428.533 2.397 10 20 IECD CC(C)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1790838815 GMAXVYKMHLMAFA-FGBFPJKISA-N 432.517 2.233 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998805 GCMTUCCAJVWNDO-DSJQBLMGSA-N 438.509 2.083 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@]1(F)Cl 1813154150 XQINSIYZBHYSRH-FOTGTACZSA-N 434.855 2.132 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1cc(O)nc(O)c1 1817846290 PJWFFNCCKYEUTD-AWEZNQCLSA-N 426.408 2.370 10 20 IECD CNc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1842899864 DXMWLEIGOFUCJH-UHFFFAOYSA-N 431.496 2.338 10 20 IECD Cc1cc(C(=O)CN2CCC(NC(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 111173304 LEDYWAXNVHJXEZ-UHFFFAOYSA-N 432.590 2.387 10 20 IECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 525239010 OONMUSLSWCMCKC-LLVKDONJSA-N 434.499 2.174 10 20 IECD COC(=O)c1cc(N2CCOCC2)ccc1NS(=O)(=O)c1cccc2nsnc12 591711176 SINPOSQCKOSHTI-UHFFFAOYSA-N 434.499 2.115 10 20 IECD COc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1OC(F)F 727177805 OGUZZKRREJLLAS-WQLSENKSSA-N 438.499 2.047 10 20 IECD NC(=O)COc1ccccc1C(=O)Nc1cccc(N(CC(N)=O)Cc2ccccc2)c1 728835911 OSSCEYPJVIRMKY-UHFFFAOYSA-N 432.480 2.295 10 20 IECD CC(C)(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737245969 QKHIBLMAUIUMDD-UHFFFAOYSA-N 443.569 2.474 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](N3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 740878319 YYSWFSHQLKSFRI-FQEVSTJZSA-N 444.601 2.484 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 741806214 LZIOXPMZEOEJPQ-GOSISDBHSA-N 428.485 2.275 10 20 IECD COc1cccc(CNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c1O 743916187 UHVZMFWVIVCYKL-AWEZNQCLSA-N 445.903 2.279 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3CN3CCOCC3)cc2)C1 746147296 NZVFIFCHZSKXGS-OAQYLSRUSA-N 436.556 2.151 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2c(=O)n3c(nc2c1)CCC3 749405671 IPODEKVFQNKDMB-UHFFFAOYSA-N 436.487 2.373 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 749654350 MYCXDITYJKGLRJ-UHFFFAOYSA-N 436.512 2.418 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)OCC(=O)NCCCN(C)S(C)(=O)=O)c2C)c1 750414020 USDGADTVUZJMON-UHFFFAOYSA-N 449.573 2.265 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(OC)c(O)c(OC)c3)CC2)cc1 754395594 MPELKMVKWGYPFS-UHFFFAOYSA-N 429.517 2.360 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4ccc(Cl)cc4c3=O)CC2)cc1 758189432 AAUUKWYVCDCRQF-SFHVURJKSA-N 428.920 2.242 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 760972927 MDXAGTYJLVIATO-YLJYHZDGSA-N 434.581 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(N4C(=O)CCC4=O)c([N+](=O)[O-])c3)CC2)cc1 766343371 XHVVUXYYCLJTFP-UHFFFAOYSA-N 438.440 2.219 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c2ccncc2N1 769929467 WGKPUWMRABUOLP-UHFFFAOYSA-N 430.467 2.248 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc5c(c4)NC(=O)C5)n3)CC2)cc1 771055635 HNPXAAHAIGOOOX-UHFFFAOYSA-N 447.495 2.055 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCNC(=O)c4ccccc43)cc2F)C[C@H](C)O1 773611968 ULSAPKUPNFHBAK-IRXDYDNUSA-N 440.519 2.306 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 774953358 HJBTTWCADNAFAH-FQEVSTJZSA-N 442.585 2.154 10 20 IECD Cc1cc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1S(N)(=O)=O 775226740 VCUPPIZCOMHHGS-INIZCTEOSA-N 432.546 2.039 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(N4CCCCC4)CC3)CC2)cc1 778247197 VLJMXQAQWFEHRQ-KTKRTIGZSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3ccccc3Cl)CC2)cc1 778327852 HEHSZIYWFCZSFK-RQWLHQTBSA-N 443.931 2.403 10 20 IECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C(F)(F)F 782104973 OCUJKFXWAMLEGX-UHFFFAOYSA-N 427.452 2.247 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3nnc4ccc(C(F)(F)F)cn34)ccc21 785603185 RZEYSGBOCWVAEK-UHFFFAOYSA-N 446.433 2.063 10 20 IECD CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801873 VFKYWQCXSUITRO-RXVVDRJESA-N 435.540 2.379 10 20 IECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789861858 SMWIYCNNPRAFPW-LJQANCHMSA-N 446.617 2.011 10 20 IECD COC(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)nn1 798533039 XOUCEZYQOJNKDD-UHFFFAOYSA-N 432.348 2.199 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)cc2F)CC1 799770182 PXMIBJRRXKRERR-UHFFFAOYSA-N 448.564 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)CC(=O)N(C)[C@H](C)c3ccccc3)CC2)cc1 800500713 WGTGILQNZDLYJD-HXUWFJFHSA-N 438.572 2.495 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 801159978 XQWYEYMEJFCHEU-UHFFFAOYSA-N 449.548 2.215 10 20 IECD COCCO[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 801968270 XRHXQOOEPNFLKM-QFIPXVFZSA-N 434.581 2.044 10 20 IECD COC[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccco1 806774997 OFBOWCIWEPRFQV-RHSMWYFYSA-N 437.443 2.470 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@@H]1[C@@H]1CCCO1)c2[N+](=O)[O-] 808902499 MXKIAVPTBAGSDW-MSOLQXFVSA-N 436.420 2.390 10 20 IECD CS(=O)(=O)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 813586442 RMTQNHDXSQNDLQ-CQSZACIVSA-N 449.495 2.118 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1 914791977 ZSXGPJOONFHJHF-UHFFFAOYSA-N 448.545 2.402 10 20 IECD O=C(COC(=O)CC1CC1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 914952028 YZXQAOHMHOCNSV-PXNMLYILSA-N 448.522 2.076 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)CN(/C=C\c4ccccc4)C3=O)CC2)cc1 915672859 KDVONKDWVQMEIV-QXMHVHEDSA-N 434.496 2.279 10 20 IECD CS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918118135 WGXMHPNZTIBABN-MRXNPFEDSA-N 445.545 2.082 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc2)C1 918122895 NSRPOTKURASQQG-XLIONFOSSA-N 426.521 2.086 10 20 IECD C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C1 918443293 DLRMSVHBMXTVNR-INIZCTEOSA-N 445.541 2.410 10 20 IECD CS(=O)(=O)Nc1cccc2c1CCN(C(=O)NCc1ccc(N3CCOCC3)cc1)C2 919792349 YBZMJRHLVXRSMR-UHFFFAOYSA-N 444.557 2.163 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3ccc(C)c(S(=O)(=O)NC)c3)CC2)cc1 1116417559 KHFNLYXSJVATRF-UHFFFAOYSA-N 446.573 2.063 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 1338534409 BZQFTSOJUBLHJA-PBPSECFOSA-N 448.516 2.335 10 20 IECD C/C=C(/C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127336 JLFIGAPVEZRIHG-QUKSXRCGSA-N 438.528 2.259 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)c3cc(O)ncn3)C2)CC1 1806216373 SXCNEFDJXOXJKY-UHFFFAOYSA-N 446.891 2.405 10 20 IECD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1807994927 LRRJLTWYBWHKSI-VBKZILBWSA-N 437.456 2.072 10 20 IECD Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cc(O)n1 1810923733 CDHDXWJGKGMSGU-UHFFFAOYSA-N 426.473 2.060 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)CC1CCC1)CC2 1828248960 CDKYPPSMAPMQIO-NSHDSACASA-N 438.600 2.106 10 20 IECD Cc1cccc2cc(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)[nH]c12 1844032095 NXRXWTCEOMTBCO-UHFFFAOYSA-N 442.566 2.154 10 20 IECD Cn1nc2c(c1C(=O)N1CCCC13CN(C(=O)c1cc(O)c(O)c(Cl)c1)C3)CCC2 1845676230 CTKXWAWXQGPESZ-UHFFFAOYSA-N 430.892 2.104 10 20 IECD Cc1nc(F)ccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039024 YJIIJHUVPLJIAQ-XBXARRHUSA-N 427.432 2.176 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Br)c2)cc1C(=O)O 728015803 VWRSUJKFQVENGT-UHFFFAOYSA-N 449.304 2.320 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)c1O 746037865 OAZBTMAMZYWMIR-UHFFFAOYSA-N 442.863 2.162 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2=O 749405140 CKFYPUGFXAMIDW-HNNXBMFYSA-N 439.487 2.396 10 20 IECD Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 749721183 OWIWDIVSEHSBFL-UHFFFAOYSA-N 445.531 2.122 10 20 IECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762461370 QXFTVJYDPDPLDI-GFCCVEGCSA-N 443.401 2.473 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 762642123 YRMNDELASRZEIF-LJAQVGFWSA-N 431.583 2.373 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCN2C(=O)OC[C@H]2C1 764137607 XMSVNXMSXMZTPP-ZMTLZGASSA-N 437.568 2.393 10 20 IECD C[C@@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769761215 ZVHGRISPOULOGM-KRWDZBQOSA-N 447.557 2.127 10 20 IECD COc1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1N1CCNC1=O 781271522 ZIGJDWURIHLUES-UHFFFAOYSA-N 437.500 2.146 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnn(C)c3C(F)(F)F)CC2)cc1 782106642 LDTRILXPCTWYHF-UHFFFAOYSA-N 425.411 2.125 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCC(C)CC4)C3)cc2)CC1 786657212 VGLRFHPCOWCYGS-JRSYVHTFSA-N 440.588 2.399 10 20 IECD Cc1nnc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789818803 LCCTYOFVULLJTL-FRRDWIJNSA-N 435.525 2.093 10 20 IECD Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789821883 USQHLNIHTJLGGI-HUUCEWRRSA-N 446.523 2.409 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Cc1cccs1 789833241 FSYWEKJGGLGOBQ-HNNXBMFYSA-N 433.549 2.460 10 20 IECD CCSCC[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840713 MXICXLYVPJQMQU-HNNXBMFYSA-N 425.570 2.393 10 20 IECD CCCCn1cc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)n1 789844388 RTSFDLTVNHLBGJ-UHFFFAOYSA-N 445.539 2.024 10 20 IECD COC(=O)c1cc(Br)c(S(=O)(=O)NCc2ccc(OC)cc2O)s1 795357460 QGWGTKUPZCFRIP-UHFFFAOYSA-N 436.305 2.490 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 795850389 IEGLWZWSLCSSQN-LJQANCHMSA-N 448.541 2.138 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccc(N2CCOCC2)cc1 803303887 VTONDHHQWMGJRH-SQVLJLFZSA-N 440.588 2.033 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)CC2)cc1 804315289 JQDCCDWQZIERGW-XZOQPEGZSA-N 436.556 2.342 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCCCSc2nccs2)C1 806281292 SWMXLWREKSLXMF-GJZGRUSLSA-N 426.608 2.285 10 20 IECD COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 808030162 WYIKIJCAXLICSD-AEFFLSMTSA-N 430.549 2.227 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 808148943 BEWDKBALDFJYGJ-IBGZPJMESA-N 426.492 2.162 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(Cl)cc4c3OCC(=O)N4)CC2)cc1 809190935 LXEAARBBYBBGTQ-UHFFFAOYSA-N 430.892 2.440 10 20 IECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NCc2ccc3ccccc3c2O)C1 816574710 PUORRVACYZHFTI-UHFFFAOYSA-N 426.494 2.479 10 20 IECD CN(C)c1ccc(CNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 915926885 FJYKRBQDVQENRG-FQEVSTJZSA-N 446.573 2.209 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918297259 OMNNDQSFDIRBFG-IBGZPJMESA-N 425.485 2.288 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 920454917 OHIWCGBDAKPNJV-MAODMQOUSA-N 427.545 2.075 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(N2CCCC2)nc1 920938710 ABKLVBSSDYFNIA-UHFFFAOYSA-N 429.546 2.238 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(C[C@H]4CCCN4CC)C3)CC2)cc1 1341406049 CIBRNWIRDSENIZ-PZJWPPBQSA-N 428.577 2.067 10 20 IECD N[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccnc1 1796135574 YAHSHNRAAUQESH-DFGXFYAUSA-N 444.919 2.488 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2C[C@H](O)CN2)C3)cc1 1800514119 OXFMUBOGIDQCEY-UVVBHOOISA-N 436.556 2.069 10 20 IECD C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812584200 KNUNDRWOPJOEEG-VXGMRGKGSA-N 444.582 2.080 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1nccc2nc[nH]c12 1817929199 XRKVIIMPGDWDNO-AWEZNQCLSA-N 448.443 2.107 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cn[nH]c2cn1 1819233555 MPDMOXLLAAJGMY-MRXNPFEDSA-N 448.443 2.107 10 20 IECD O=C([C@@H](O)c1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424783 ODAHTAZPYJOLHD-UZLBHIALSA-N 429.473 2.053 10 20 IECD O=C(c1cn[nH]c1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827716749 VKPCOMJCSHBPLS-OAQYLSRUSA-N 448.527 2.436 10 20 IECD O=C(CC1CCC1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840848732 NAAULIUDVKKYAE-NRFANRHFSA-N 438.908 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCc4cc(OC)c(OC)cc4C3)CC2)cc1 7493212 XGFBQYGYZNJDGO-UHFFFAOYSA-N 425.529 2.419 10 20 IECD Cc1cccc(NC(=O)CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c1C 23297910 XQEPQDNOINPMLW-UHFFFAOYSA-N 437.588 2.242 10 20 IECD COCCNC(=O)CN1CCN(CC(=O)c2cc(C)n(-c3ccc(C)c(C)c3)c2C)CC1 302812763 NNYRZITZHXCGRI-UHFFFAOYSA-N 440.588 2.274 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 726975849 FPEDEBFDVQILIB-UHFFFAOYSA-N 428.963 2.362 10 20 IECD O=C(CN1CCC(N2CCCC2=O)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729483717 WYSFDERULJMLPD-UHFFFAOYSA-N 431.492 2.487 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 735192347 UPENBKVELJZFLH-UHFFFAOYSA-N 429.542 2.395 10 20 IECD CCOC(=O)c1ccnc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 737398199 NTXVIPKRPKRWDO-HNNXBMFYSA-N 427.461 2.480 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740609873 NVONTBZPWGDLAS-UHFFFAOYSA-N 435.477 2.115 10 20 IECD Cc1c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccccn1 742284668 VXPPKKWHHSUUIO-INIZCTEOSA-N 427.530 2.452 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccccc3Cn3cncn3)CC2)cc1 742492095 ULAPJFQNDRPGIH-UHFFFAOYSA-N 434.544 2.277 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 743954676 CYUKYVOHLKZTLP-UHFFFAOYSA-N 443.525 2.066 10 20 IECD C[C@H](O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752652454 FTJSVODVNKONTP-PKOBYXMFSA-N 442.539 2.387 10 20 IECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 752834843 JVSFKLQHHCFLHF-YADHBBJMSA-N 429.609 2.476 10 20 IECD CN(Cc1ccccc1O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 755047111 YXPPTWPZEOLAMA-UHFFFAOYSA-N 448.545 2.143 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)[C@H](C)N(c4ccccc4)C3=O)CC2)cc1 758192516 LPTYEPHYTWJAJQ-RXVVDRJESA-N 438.528 2.035 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C)[C@@H](n4ccnc4)C3)CC2)cc1 759576420 VHBVBYFKQLXDOJ-UGKGYDQZSA-N 426.565 2.306 10 20 IECD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1F 760354672 CAFCZFAOJHMWIV-UHFFFAOYSA-N 443.478 2.078 10 20 IECD CC(C)[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768516499 DTCOHJKPNBLJOX-LNPFQXMTSA-N 433.524 2.477 10 20 IECD CC[C@]1(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CCC(=O)NC1=O 769723440 YUZUNHQMPIMAFY-OAQYLSRUSA-N 445.497 2.100 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)C(=O)C1 776771598 IDRIZOSBBYBUMY-MRXNPFEDSA-N 433.505 2.165 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@@H]4CCC[C@H]43)CC2)cc1 785529118 LNKNNEKJNMGMJR-SIKLNZKXSA-N 428.577 2.115 10 20 IECD O=C(NCc1ccc(F)cn1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951602 WTBFGWYTLVSIPW-UHFFFAOYSA-N 440.397 2.009 10 20 IECD O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 794237967 GIEQYAULWSZGAW-UHFFFAOYSA-N 435.402 2.297 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(I)c2)c(O)c1 797390866 XCAZQTPOGZIUEC-UHFFFAOYSA-N 426.210 2.260 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 800916053 BKQPTVOXYXANTM-AWEZNQCLSA-N 442.559 2.471 10 20 IECD COCCn1c(CC(C)C)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802416310 AGCUBXWMDMYAKK-UHFFFAOYSA-N 433.553 2.475 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCC[C@H]1CCO 803451724 UNYUMMABIHYASY-KSSFIOAISA-N 425.476 2.040 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@@H]3CCCN(c4ccccc4)C3=O)ccc21 803687854 ILXWYJVLBSHBID-JOCHJYFZSA-N 434.540 2.339 10 20 IECD CCN(C)C(=O)OC[C@H]1CCCCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 805762102 NJNSWSXSOGQVNQ-YADHBBJMSA-N 448.608 2.121 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCCn1cc(Br)cn1 808351150 KAABQRGKFKNVEG-UHFFFAOYSA-N 436.354 2.267 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 918311882 WMGPULZWUAIKQD-UHFFFAOYSA-N 425.485 2.215 10 20 IECD N[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1ccccn1 1788040420 IFCOHEZKYXVQOW-FQEVSTJZSA-N 433.468 2.336 10 20 IECD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)nn1C 1790194267 DDAQLFSPTAQJFF-UHFFFAOYSA-N 437.456 2.296 10 20 IECD CCc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1805330206 CGJXAVGKQCVRND-ZHRRBRCNSA-N 447.495 2.479 10 20 IECD O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815471480 QYGPLZFGOPPOAI-CYBMUJFWSA-N 427.486 2.136 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(Cl)cnc2O)C1 1840986309 GJOTYJIEQHREHD-HWKANZROSA-N 445.859 2.088 10 20 IECD COc1ccccc1CN1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 564002570 HQCOAGSGEQPHDK-UHFFFAOYSA-N 434.540 2.456 10 20 IECD NS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 726565440 NRLNAKVGACEDLI-UHFFFAOYSA-N 431.486 2.396 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2c(F)c(F)c(F)c(F)c2F)SC1=S 727177034 AZOCWVLWUJQSAU-XQRVVYSFSA-N 432.417 2.133 10 20 IECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(Cc1ccc2c(c1)OCO2)c1ccccc1 729832361 ZEKRHVABTNTZTG-UHFFFAOYSA-N 437.477 2.446 10 20 IECD CC(=O)N1CCCCC[C@@H]1C1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 731833810 KFXGSUSBZNZFAH-LJQANCHMSA-N 437.562 2.407 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)c2)CC1 739767192 XNXOVKGDRQRAPT-UHFFFAOYSA-N 426.429 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)c3cn([C@H]4CCS(=O)(=O)C4)nc3C(C)C)CC2)cc1 742471074 NHLVMZBGEOHDFB-SFHVURJKSA-N 446.573 2.337 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCCNC(=O)C1CCC1)c2[N+](=O)[O-] 752400342 HJILKPSCNIJREK-UHFFFAOYSA-N 435.436 2.406 10 20 IECD CN1CCC[C@@H](N(C)C(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)C1 753924391 SUNJKNQPLFSNPT-MRXNPFEDSA-N 429.502 2.190 10 20 IECD Cc1nc(COc2cccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)c2)no1 758668051 PTXNODOZJMHPGU-UHFFFAOYSA-N 442.497 2.444 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)n(C)c1 766493317 ITJQVXQBCPAYCO-CQSZACIVSA-N 434.443 2.019 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1cc(F)cc(F)c1 769618291 ZOACUPIGBDWFTP-UHFFFAOYSA-N 426.803 2.255 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OC(F)(F)F)c(N)c3)nc12 770517382 MFOASXNJCDJQPG-UHFFFAOYSA-N 440.334 2.449 10 20 IECD CC(=O)c1ccc(N2CCN(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)CC2)c(F)c1 772773381 CHEFCWNKODDKQE-XVNBXDOJSA-N 442.443 2.345 10 20 IECD C[C@H](NCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 775837966 WDTZFCPABVAKFT-KRWDZBQOSA-N 446.573 2.063 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc(OC)c3OC)CC2)cc1 778238919 RSMVTTBBIOJCRW-QXMHVHEDSA-N 439.512 2.234 10 20 IECD CCc1noc(CC)c1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778317598 DFDANAPCJGTMLL-KHPPLWFESA-N 426.517 2.329 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@H](C)C3CCN(C)CC3)CC2)cc1 778411424 RSYRMUAOWWHRMK-ZBTAVZRMSA-N 428.577 2.089 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1 785296257 MXNOMAXMAIXTHL-XUQHIXODSA-N 430.404 2.411 10 20 IECD O=C(NCc1ccc(CN2CCCC2=O)cc1)C(=O)NCc1ccc(N2CC=CC2)cc1 787433553 PNRPXEVOWNRZIO-UHFFFAOYSA-N 432.524 2.118 10 20 IECD COCCN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789824898 LACYJKTZPQHEBL-CALCHBBNSA-N 447.507 2.324 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)ccc1O 790408155 UIQUWLZZIYDXGY-UHFFFAOYSA-N 428.385 2.259 10 20 IECD CN(C)c1ccc(CNC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c(C(F)(F)F)c1 792992100 KMYYVTDSTMIXSZ-UHFFFAOYSA-N 445.511 2.448 10 20 IECD COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 797612041 MIOBOBVKFRCBDK-GFCCVEGCSA-N 435.502 2.300 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3cnc(C(C)C)nc3)CC2)cc1 799742234 YJBWUCVCOIYAEB-KTKRTIGZSA-N 437.544 2.472 10 20 IECD O=C(NCCCOC(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 801525566 VZJFVGSEPOTSLF-UHFFFAOYSA-N 445.400 2.460 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1F 803662514 CJXYTICRXXDZTA-SFHVURJKSA-N 440.519 2.177 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCCN3C(=O)OC(C)(C)C)ccc21 803688997 HQHSFOCBXAXEDZ-GOSISDBHSA-N 430.549 2.201 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1nccs1 805007880 TVLGKDLDLFHWKI-KRWDZBQOSA-N 433.553 2.308 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(F)(F)F)[C@H](CO)C3)cc2)C1 806494459 QMVVUGTWSWRAGF-SOLBZPMBSA-N 442.482 2.091 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 807387537 MYNSIUOQSRHALR-UHFFFAOYSA-N 432.274 2.302 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 917930021 MTYDEAYSHDQRSS-SFHVURJKSA-N 431.558 2.492 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(S)n1-c1ccccc1 918333953 DBBIMDMBKANTRL-UHFFFAOYSA-N 442.566 2.326 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)CN3CCS(=O)(=O)CC3)c2C)c1 919135960 RPDIGVGCPZVGOZ-UHFFFAOYSA-N 432.542 2.167 10 20 IECD COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920195547 UYEJJZXWKZGPMS-UHFFFAOYSA-N 431.876 2.218 10 20 IECD C[C@@H](NC(=O)N1CCN(C(=O)c2cccn2C)CC1)c1ccc(N2CCOCC2)cc1 920870498 HFPKZHZWIYMDME-GOSISDBHSA-N 425.533 2.090 10 20 IECD Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)o1 1791722673 YWJIICQUTQHGHK-AXHNFQJDSA-N 448.903 2.489 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cccs1 1804340582 WDDQNZPXQFYFPV-FQUUOJAGSA-N 437.612 2.350 10 20 IECD Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807994149 QHVFYCMVLXCDQV-KKSFZXQISA-N 433.468 2.225 10 20 IECD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)n1cccc1 1816729236 YDJVFCCXYLRVHL-YPMHNXCESA-N 427.486 2.238 10 20 IECD O=C(Cc1cnc[nH]1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1817049772 MCPYRFIMFBHGGS-SNVBAGLBSA-N 447.904 2.399 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnco2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145652 BRGWWBYJHHTLMC-KRWDZBQOSA-N 447.455 2.497 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@H]1CCOC1 1822957583 PADWBCQFGDKIJU-YOFOWSBGSA-N 442.472 2.269 10 20 IECD CO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1838687792 BOHGTDHCIRSBRL-ZDUSSCGKSA-N 440.924 2.398 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCN(C(=O)N2CCCC2)CC1 302979468 JIQWQDZBVAPBDQ-UHFFFAOYSA-N 432.540 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nc(CCC(C)C)no3)CC2)cc1 729873951 XWTOOYIIMGLGDK-SSEXGKCCSA-N 434.562 2.264 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c1 734073827 WXXYSQRTCWTKBQ-UHFFFAOYSA-N 442.497 2.102 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 736630983 AHAUWBPEZDFXAT-UHFFFAOYSA-N 425.457 2.238 10 20 IECD CC(C)S(=O)(=O)CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742751776 WOFPQMKBVZULAL-QGZVFWFLSA-N 427.567 2.258 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 742802212 WOBHUTCYPWKWIG-INIZCTEOSA-N 445.532 2.435 10 20 IECD COCCOc1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 743396560 XNEZWUUHLJVVPC-UHFFFAOYSA-N 447.919 2.457 10 20 IECD Cc1noc(C2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)n1 747301072 OYIOIAIUJJGVOG-GOSISDBHSA-N 426.521 2.169 10 20 IECD CCc1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 747464733 XTRORVWJRPNPCC-UHFFFAOYSA-N 437.422 2.149 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CS[C@@H]2CCS(=O)(=O)C2)cc1 747481551 OAOOSZQKODHQRZ-RBUKOAKNSA-N 426.604 2.181 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(N(C)C)n1 750217059 ZVGCSJYQTICKHF-HZPDHXFCSA-N 443.523 2.464 10 20 IECD COc1cc(N2CCN(C(=O)Cn3ccc(C(F)(F)F)n3)CC2)cc(OC)c1OC 759220834 JKWYGGFZWSDMMY-UHFFFAOYSA-N 428.411 2.277 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccn4ccnc4c3)CC2)cc(OC)c1OC 760127021 BLJRBNLQAAFZQE-UHFFFAOYSA-N 425.489 2.392 10 20 IECD C[C@@H](NC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 777469818 NTBXSUJTCNQGSE-ZBFHGGJFSA-N 428.455 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(CCCN(C)C)CC3)CC2)cc1 778407477 KZALCOMCWSJXKK-KHPPLWFESA-N 442.604 2.480 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 779589460 HDFRTBUDSMMXQL-IQBZNYMQSA-N 428.510 2.495 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 781449729 OENNULIBUXRWFW-UHFFFAOYSA-N 439.512 2.245 10 20 IECD CCOc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c([N+](=O)[O-])cc1OCC 785292923 CNHQPEFUNWLRJA-LBPRGKRZSA-N 447.444 2.489 10 20 IECD CCO[C@@H]1C[C@@](O)(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 788690547 KHBAYRASDPGGIC-ZJSXRUAMSA-N 448.608 2.073 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccccc1F 789798273 DLSKUZGFNGITIF-OAHLLOKOSA-N 433.455 2.001 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cc2F)C[C@@H](C)O1 789820925 QWPKZCPPLJETIC-SOLBZPMBSA-N 443.523 2.185 10 20 IECD C[C@@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793728376 YHGBNUMMHOOHMK-YLJYHZDGSA-N 434.540 2.150 10 20 IECD CCS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734997 WNWGVTFDKQEABR-ICSRJNTNSA-N 446.617 2.139 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NCCOCCS(C)(=O)=O)cc2Cl)C1 799934394 XONAVZITRYLCBS-HNNXBMFYSA-N 431.986 2.437 10 20 IECD O=C(CC(F)(F)F)Nc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 802564084 PTUHOHNAENVRNO-UHFFFAOYSA-N 425.363 2.286 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@]2(CCc3ccccc32)C1)c1ccc(N2CCOCC2)cc1 803301164 NFBSZRWMTCMUSC-BCHFMIIMSA-N 449.551 2.401 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4c(F)cccc4F)C3)ccc21 803686127 WZKKXGBDTPDERO-KRWDZBQOSA-N 428.483 2.359 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)cc1F 804753322 WCTCJZGWOIPUPU-UHFFFAOYSA-N 436.528 2.271 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3COC4(CCC(C)CC4)O3)CC2)cc1 806702798 DREAROKAQHWTQY-VZQLXNMESA-N 445.560 2.172 10 20 IECD CN(C)C(=O)COc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512843 LMHBZXUOUJFWCX-UHFFFAOYSA-N 440.283 2.421 10 20 IECD O=C(NCCNS(=O)(=O)c1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916295895 YTUKUOUNSUXQDO-SFHVURJKSA-N 433.530 2.061 10 20 IECD O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1ccc(N2CCSCC2)cc1 916626453 ZEXUZEIZRPZILE-UHFFFAOYSA-N 448.614 2.159 10 20 IECD O=C(COC(=O)c1cc2ccccc2oc1=O)NCc1ccc(N2CCOCC2)c(F)c1 918875968 JIVDMLIJOPWMSX-UHFFFAOYSA-N 440.427 2.242 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 1346108931 GNHBLJQARJMFMM-AVRDEDQJSA-N 438.572 2.414 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1781687185 ALEDNQMTYZQCSA-FQEVSTJZSA-N 435.839 2.043 10 20 IECD CC[S@@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789420269 PGAGPDPXNNZDNA-SSEXGKCCSA-N 431.514 2.399 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H]1CCc2ccccc2[C@H]1O 1796601114 VPVXIJILJAWHLK-FWPOJJEQSA-N 437.496 2.041 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(Cl)c1 1799621363 NZDMAYRNXLXHRV-QDMKHBRRSA-N 437.974 2.452 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(F)cn1 1805985133 YGJHHRUXYWMSQK-JLTOFOAXSA-N 437.431 2.055 10 20 IECD CCc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992097 UXSPZHQKVWTCHI-KSFYIVLOSA-N 447.495 2.479 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C[C@@H]2CCCCO2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994101 RMZSIUIQLOECKA-ZJBJCVSYSA-N 440.500 2.167 10 20 IECD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1810999174 LEWICKQBCHFGGK-XOBRGWDASA-N 437.456 2.072 10 20 IECD CN(C)CC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811798607 SCMLMJVRNJTLLB-AUUYWEPGSA-N 432.908 2.027 10 20 IECD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c(C)o1 1834988048 MPKXICMGEPYMLB-UHFFFAOYSA-N 442.516 2.202 10 20 IECD COc1cc(F)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 730680810 XGMAQTAPAKCLBL-AWEZNQCLSA-N 431.464 2.495 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@H](C(F)(F)F)C3)CC2)cc1 740469928 YOOAFONUFZTQKZ-SFHVURJKSA-N 430.471 2.180 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](N2CCNC2=O)C1 744200960 RSSUWXZXGGLSPW-DOTOQJQBSA-N 446.507 2.279 10 20 IECD Cn1cc(N2CC[C@@H](NC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2=O)cn1 745832280 XMUBTFHONPAKRY-KBXCAEBGSA-N 448.474 2.095 10 20 IECD Cc1noc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)n1 747300642 JHPAPLQSUAFXTQ-ZWKOTPCHSA-N 426.521 2.169 10 20 IECD CC[C@@H](NC(=O)N(CC)Cc1cc(Br)ccc1O)C(=O)N1CCOCC1 753060854 XENIANGGRPVDHD-OAHLLOKOSA-N 428.327 2.324 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)cc(F)c1O 756704523 GWLXFNIXWDKQNH-DGCLKSJQSA-N 439.347 2.433 10 20 IECD CCn1cc(C(=O)C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 758862772 OEWXYZSMAREWDP-ZDUSSCGKSA-N 445.431 2.432 10 20 IECD COC(=O)c1cccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759877222 DIZBOSPQZFAQLC-UHFFFAOYSA-N 443.500 2.260 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCC(=O)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760557249 BKMZMNKPZJYXKH-YJYMSZOUSA-N 446.525 2.473 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CC(=O)N(Cc4ccccc4)C3)cc2F)CC1 764405068 VLLYNUDBBIKLDI-UHFFFAOYSA-N 439.535 2.479 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccccc2O)c(I)c1 765656354 MWQGYNTVEDIEII-UHFFFAOYSA-N 426.210 2.260 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1OC 766322041 ZTPMMZSUIBLIOA-UHFFFAOYSA-N 445.475 2.180 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](c4nccn4C)C3)cc2F)C[C@@H](C)O1 767114233 AEHJSPIDYDXZQF-ZHALLVOQSA-N 429.540 2.279 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](CO)Cc2ccccc2C(F)(F)F)c1 769384674 MTSXVJDDAHDHNI-GFCCVEGCSA-N 446.447 2.364 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCC(=O)Nc1ccccc1Br 772771767 YVSPUAQJEIADIE-VURMDHGXSA-N 449.257 2.172 10 20 IECD CN(C)C1CN(C(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)C1 775553626 WOBGXRPBFFOCSZ-VGOFMYFVSA-N 440.388 2.423 10 20 IECD Cc1cc(Br)cc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1O 775728143 PDIAPDHOYILBFG-UHFFFAOYSA-N 443.367 2.012 10 20 IECD CCC(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCOCC1 786594798 AVQQVRQFWOUHJB-JOCHJYFZSA-N 430.593 2.156 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3c(F)cccc3Cl)cc2)C1 786930247 DYIJLLNJIAZQAD-OAHLLOKOSA-N 446.910 2.113 10 20 IECD Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789560018 ZYMMVLQUARTPDT-UHFFFAOYSA-N 437.475 2.411 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(N(C)C)cc1 789797645 CEHNYFXOYMPMIY-INIZCTEOSA-N 428.508 2.222 10 20 IECD CCCN1CCC(N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789819501 NTUVOTHRDZTTRD-HDICACEKSA-N 448.583 2.388 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)sc1C 789826690 QIVKZFWHPPKGDX-OKILXGFUSA-N 448.564 2.488 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789845025 ILKUILZXTXKUKG-UHFFFAOYSA-N 443.569 2.450 10 20 IECD COc1ccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c(O)c1 794377049 FFVWZXJXIGCLBQ-HUUCEWRRSA-N 434.514 2.129 10 20 IECD COCCn1cc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 799887634 FMLYWQPZOQWNQG-UHFFFAOYSA-N 441.454 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@](C)(O)CCc3ccccc3)CC2)cc1 801491686 PMXPSVPKOCZRFT-XMMPIXPASA-N 426.513 2.271 10 20 IECD CCN(CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)OC(C)(C)C 803305776 PCFSIHLVBSFPGY-QGZVFWFLSA-N 448.564 2.074 10 20 IECD COc1ccccc1OCCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 804628896 VLPWDRCSSBYUCY-UHFFFAOYSA-N 441.528 2.076 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 807103016 YKRIOHVDEZLFCI-HDICACEKSA-N 430.549 2.003 10 20 IECD CCN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1)CC(F)(F)F 807291191 UMMCEUYYTYTJND-GOSISDBHSA-N 438.494 2.412 10 20 IECD CNC(=O)c1cccc(CCNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 807358984 QALHYPGPPZWNSJ-UHFFFAOYSA-N 435.480 2.233 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807678847 KRWSJZAGRZMRHD-AEFFLSMTSA-N 431.558 2.299 10 20 IECD O=C(N[C@H]1CCOC2(CCSCC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809459451 YBUWFAKUZZMTLI-RBUKOAKNSA-N 448.585 2.461 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](n3cccn3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 812876074 FLGBXLLZSPDYQX-SFHVURJKSA-N 427.530 2.068 10 20 IECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 813642457 NATOLXWOHHQJSL-UHFFFAOYSA-N 434.514 2.139 10 20 IECD CC(C)N1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 914492635 UVZOEOWZUODYST-UHFFFAOYSA-N 448.501 2.267 10 20 IECD COc1ccc(OC)c(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 916178144 OICNOCVMKHYQOQ-UHFFFAOYSA-N 446.506 2.039 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 918305517 JOZFGWKYWINRGZ-UHFFFAOYSA-N 446.573 2.427 10 20 IECD CC(=O)N1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)Oc2ccccc21 919969538 PIQZCNPESZOHRX-QFIPXVFZSA-N 427.476 2.217 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc2NC1=O 920927650 ZWYTVQRKKLTGEL-GJZGRUSLSA-N 438.484 2.059 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C1CCCC1)C2)c1cc(O)nc(O)c1 1777852072 AMJMUYIHCIQGKM-LJBSYDGDSA-N 429.517 2.367 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)cc1 1777852163 GQPXWRCNEYSXAR-WZONZLPQSA-N 425.485 2.243 10 20 IECD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1cccc1 1784332552 WPRBXASPEUOWCJ-QKKBWIMNSA-N 433.892 2.257 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)nc1 1786156608 JDXNAFIBESBYMZ-RFUYNDQBSA-N 445.903 2.362 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1CCCS1 1796935364 ATWHSCINXPWPJK-RUENVJTFSA-N 426.542 2.313 10 20 IECD O=C(CC[C@@H]1CCOC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935400 FSBYEBFFHVZJJF-IZBJGVDFSA-N 438.528 2.234 10 20 IECD CC[C@H](NC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620428 MEYPOIAOYMPOTG-MQFRRQCYSA-N 438.572 2.295 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)nc1 1804286593 WTQQJICSEPPBJJ-OVYMSRNUSA-N 439.468 2.172 10 20 IECD Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334122 AZGSOLFMFUNBNB-MUJYYYPQSA-N 448.614 2.063 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993254 TWSUEILZUFGKDA-ACJLOTCBSA-N 432.427 2.253 10 20 IECD C[C@H](Nc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810544085 XTBVHSWBZOQPCK-INIZCTEOSA-N 439.516 2.233 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1 726289121 UDICVLMQFOBRTB-UHFFFAOYSA-N 447.557 2.163 10 20 IECD CN(C)S(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3cncc(F)c3)n2)cc1 727248491 SKAUREWCDBJOTQ-UHFFFAOYSA-N 442.519 2.395 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)NC(C)C 731285108 BJNKNKVCPZBUIZ-UHFFFAOYSA-N 438.528 2.225 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)CC2)cc1 732924066 NETJUGGHOYVMFL-UHFFFAOYSA-N 443.460 2.372 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)c3cnn(-c4ccccc4)c3)CC2)cc1 733757082 JBNUCDUPXINKIB-UHFFFAOYSA-N 447.539 2.392 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C 737117094 INIBUIAWWGYAJC-UHFFFAOYSA-N 427.549 2.442 10 20 IECD O=C(CN1C(=O)NC2(CCCC2)C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800311 HWFVKUTZABRYMR-CQSZACIVSA-N 436.459 2.238 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)N(Cc1ccco1)Cc1ccccc1O 743430565 KPFLJCWMXJYLAS-OAHLLOKOSA-N 446.529 2.231 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743835002 CUMSTYBMCPIJQJ-CQSZACIVSA-N 425.457 2.334 10 20 IECD COC(=O)C[C@H]1CSCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 746464687 WLMWUVVOKCYIMO-AWEZNQCLSA-N 438.505 2.381 10 20 IECD CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 747558343 FZINVJJCVQFSAS-UHFFFAOYSA-N 443.523 2.269 10 20 IECD CN1CCC(N2CCC(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)CC1 747990509 QAAFMERRUUINOU-UHFFFAOYSA-N 447.599 2.145 10 20 IECD CC(C)C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCCC1=O 755211838 LPRDJCRXABXMKN-PZJWPPBQSA-N 428.577 2.432 10 20 IECD COc1cc(N2CCN(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 759100392 AFXWJUKQVWUVIJ-IYBDPMFKSA-N 427.567 2.057 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NCCCSc2nccs2)c1 759590893 MUPWBPQVPQLICP-UHFFFAOYSA-N 449.562 2.460 10 20 IECD O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NCCc1ccc(O)c(O)c1 762268767 TVDIQQLIPOLEGL-UHFFFAOYSA-N 433.313 2.432 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN(C)CC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)cc1C 764315400 WLBCCNVLVPDKOS-IBGZPJMESA-N 445.585 2.129 10 20 IECD CC[C@@H]1Oc2cc([C@@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2NC1=O 769932478 UPKSUOOQTDTCRP-DIFFPNOSSA-N 433.486 2.364 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl 772982169 UFKYIXVQSOEYCG-WMZOPIPTSA-N 446.013 2.316 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN([C@H]2CCOC2)CC1 773480355 CFTHDNGPSWMSTR-WMZOPIPTSA-N 433.508 2.196 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1)c1ccc(N(C)C)cc1 773855304 GEQMYNRSXMKWFE-MRXNPFEDSA-N 425.533 2.459 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(OC[C@H]4CCCCO4)CC3)CC2)cc1 779222235 JLXBZXDEMXBXNO-WIOPSUGQSA-N 447.620 2.228 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCOC[C@H]1c1noc(-c2cnn(C)c2)n1 780834117 UQJLMHSJRHMHSC-SFHVURJKSA-N 425.493 2.128 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1N1CCCCC1=O 785297581 QBVHNEMPADNSPP-CQSZACIVSA-N 441.484 2.309 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 789653540 ZDILGMULKGKZCU-SQEWALACSA-N 448.523 2.281 10 20 IECD COCn1nc(C)c(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1C 789728715 VRJRVTRMWMWCEZ-UHFFFAOYSA-N 446.518 2.004 10 20 IECD Cc1cnc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)s1 789798923 FYBXUXVPYGRDRR-SFHVURJKSA-N 432.521 2.311 10 20 IECD CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800124 LNABWIACFXWBGG-XLIONFOSSA-N 435.540 2.236 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)[C@H]1OC 789800397 ONZGJZADBUFNNY-CDHQVMDDSA-N 435.540 2.234 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N(Cc1ccco1)C[C@H]1CCCO1 789801827 VOGVQXBYJMQYMI-LJQANCHMSA-N 445.491 2.079 10 20 IECD CN(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Cc1ccc(F)cc1 789854622 CIPNABHAZJLCKC-UHFFFAOYSA-N 444.576 2.243 10 20 IECD CC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOCC1 789954328 JJHVOZCVFHUPLD-UHFFFAOYSA-N 443.466 2.091 10 20 IECD C[C@H]1OCC[C@]12CN(C(=O)c1ccc3c(c1[N+](=O)[O-])C(=O)c1ccccc1C3=O)CCO2 791887888 HWYOWRBQGLZUHQ-ZLOXQWCVSA-N 436.420 2.390 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccsc3)cc2)C1 793723952 OTWNHUHDVNFRCY-YLJYHZDGSA-N 440.569 2.430 10 20 IECD CCN(C)C[C@@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451831 XVHZTRHKZZYCAW-INIZCTEOSA-N 438.519 2.173 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 803661569 GLSNSLXCKFOREA-UHFFFAOYSA-N 428.508 2.302 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1F 804852016 WWEFMKGJXFEHOF-UHFFFAOYSA-N 442.535 2.349 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](CCNC(C)=O)C3)CC2)cc1 806333337 HMCMIJVQOFABJT-OAQYLSRUSA-N 445.608 2.155 10 20 IECD O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N1 806912805 LSYIQUKMMONEOS-UHFFFAOYSA-N 426.860 2.302 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)OC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 810022950 MGZVCOZHGCCKCJ-HUUCEWRRSA-N 433.480 2.347 10 20 IECD CCCCN(C(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 914903912 UPTSBZZUFOBDTG-GOSISDBHSA-N 447.557 2.462 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN1CCCN(c3ccc(OC)cc3)CC1)n2C 917210288 MAWXTGYRVHRENU-UHFFFAOYSA-N 440.548 2.357 10 20 IECD Cc1cc(NC(=O)[C@@H](C)SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 917707669 UHDUURKQBVHZJG-CQSZACIVSA-N 436.509 2.335 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)NC(=O)CO4)cc2F)C[C@@H](C)O1 917917796 HHILLGHNOSPISM-OKILXGFUSA-N 449.504 2.249 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918443082 RVOOYGYUCHMJCR-UHFFFAOYSA-N 441.528 2.175 10 20 IECD C[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(N2CCOCC2)cc1 920882153 UDZMKDKXLOPDQR-AWEZNQCLSA-N 426.429 2.217 10 20 IECD O=C(COc1ccccc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004732 LKFFIYXGFREPST-JOCHJYFZSA-N 446.887 2.274 10 20 IECD CN(C)CC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1787716007 DRMQUNACNRESOY-UHFFFAOYSA-N 433.512 2.475 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1n[nH]c2c(F)cccc12 1796600695 DIXRHEKFKBXUHI-CLLJXQQHSA-N 425.420 2.074 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H]2CNC(=O)C2)C3)cc1 1800515697 VWUZSUBFRBXBQH-KRXUUXHPSA-N 434.540 2.482 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812481264 ORXUOJBLVQGREL-DAONXPHYSA-N 441.459 2.276 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)[nH]n1)c1cc(O)nc(O)c1 1817848280 BUCYGNMYDZMDQI-XNRPHZJLSA-N 429.477 2.073 10 20 IECD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501857 KZMLFSNWSMMEHL-UHFFFAOYSA-N 447.831 2.496 10 20 IECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)C1 303346913 MRAVNHRGIBOUEU-UNMCSNQZSA-N 443.636 2.024 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](CN4CCOCC4)C3)cc2F)CC1 303462538 ONTIAFBCNNUTKM-NRFANRHFSA-N 447.599 2.221 10 20 IECD Cc1c(CNC(=O)CCC(=O)Nc2ccc3c(n2)n(C)c(=O)n3C)n(C)c2ccccc12 473275778 JLTRGCQKDFXRLW-UHFFFAOYSA-N 434.500 2.107 10 20 IECD COc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-] 725944776 BNFXEJSMRFJLDC-UHFFFAOYSA-N 447.419 2.052 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)CC2)cc1 726524523 YPEMSHMRJUCISY-UHFFFAOYSA-N 444.536 2.135 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)cc1F 731403922 AQKMKOPVERMTLD-UHFFFAOYSA-N 433.572 2.368 10 20 IECD O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NCc1ccc(N2CCCCC2)cc1 732064181 AGDVYZOJBDVSCO-QFIPXVFZSA-N 428.577 2.006 10 20 IECD CC(C)(C)C(=O)NC[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 732984138 WHDXHXXYVFFKCL-LJQANCHMSA-N 448.583 2.153 10 20 IECD CS(=O)(=O)N1CCCC[C@H]1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805185 IDNHRYKYJSCYFD-PBHICJAKSA-N 431.505 2.187 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1C 745937200 FSCAIXUTIUMAEL-ZIAGYGMSSA-N 439.509 2.043 10 20 IECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NCCCSc3nccs3)ccc2O1 751989746 LBGJQJFOHBBEKP-OAHLLOKOSA-N 428.557 2.470 10 20 IECD O=S(=O)(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn([C@@H]2CCOC2)c1 751999967 JVTJZAKEFGWVTQ-IAGOWNOFSA-N 440.953 2.146 10 20 IECD O=S(=O)(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn([C@H]2CCOC2)c1 751999968 JVTJZAKEFGWVTQ-IRXDYDNUSA-N 440.953 2.146 10 20 IECD COc1cc(N2CCN(C(=O)Cc3nnc(O)c4ccccc34)CC2)cc(OC)c1OC 759223627 RNTQQDFPFWIDKN-UHFFFAOYSA-N 438.484 2.253 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)c1 759592829 AKZOCXFMZKIPGC-LHXVZLOVSA-N 443.408 2.255 10 20 IECD Cc1nc([C@@H]2CCCN(CC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)C2)n[nH]1 760960126 NCAFWGCFNDTCQC-GPMSIDNRSA-N 444.555 2.362 10 20 IECD CCc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)N(C)C)cc1 774946429 IWFBBUWEJFHMOP-HSZRJFAPSA-N 438.572 2.121 10 20 IECD O=C(Nc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764649 JHYUUNKJWLCJAM-MRXNPFEDSA-N 431.876 2.494 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)CCc3cccs3)CC2)cc1 785526488 DVTOGENDWPYMNV-UHFFFAOYSA-N 444.601 2.086 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCc3cn(CCOC)nc32)cc1 788973980 BMZATSBHSAAEOP-HXUWFJFHSA-N 427.549 2.186 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3n[nH]c(CC)c3Br)nc12 789141587 YVGFBJQDNLOBKO-UHFFFAOYSA-N 438.238 2.017 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCO[C@@H](c4ccco4)C3)cc2F)C[C@@H](C)O1 789822951 BURXFHLVHVTORI-VWKPWSFCSA-N 445.491 2.249 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)cc2)C1 793734656 VDFZSFGOZLDJSK-IYWMVGAKSA-N 426.561 2.090 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c(O)c1 797390551 JFTRQSFYOMPUFX-IBGZPJMESA-N 449.511 2.299 10 20 IECD Cc1cc(OCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 797437286 IPPPPFNEVRSJRZ-QGZVFWFLSA-N 426.473 2.300 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)c1 799774319 UOLYQBGDYCIELX-SECBINFHSA-N 429.292 2.302 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(N2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803307244 ZDCOFRSBUIFBDC-LJQANCHMSA-N 428.577 2.177 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803308766 JRFOOFNANVJORP-MSOLQXFVSA-N 441.528 2.293 10 20 IECD CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665124 XGATZDCUSNENSB-UHFFFAOYSA-N 436.478 2.377 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(NC(=O)c4ccccc4)CC3)ccc21 803685138 AAUYWSSRHWPJPM-UHFFFAOYSA-N 434.540 2.106 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCCC[C@H]3CNC(=O)c3ccccc3)ccc21 803688755 AMOWGKPIXPLKHW-QFIPXVFZSA-N 448.567 2.496 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cc(C)no3)cc2F)CC1 805008736 APYJHSPUESUQKY-FQEVSTJZSA-N 443.523 2.244 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccncc1 805763134 IZMYGYKXLVWZFA-UHFFFAOYSA-N 449.599 2.324 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCCCSc3nccs3)C2)nc1 806280273 MFOOTTZFUKRXSU-HNNXBMFYSA-N 447.586 2.322 10 20 IECD CCNS(=O)(=O)[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)C1 809815352 WOTVAJSDWQTEIM-SFHVURJKSA-N 428.562 2.408 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1 919810336 PNIGDURFDHTRGY-UHFFFAOYSA-N 442.497 2.401 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1 920482458 PHBCECCWWFNQQP-UHFFFAOYSA-N 432.545 2.043 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1cccc(C(F)(F)F)c1=O 928993301 BTUDOESHSFRSGX-UHFFFAOYSA-N 425.407 2.135 10 20 IECD O=C(COC(=O)c1cnn2ccncc12)Nc1cccc2c1C(=O)c1ccccc1C2=O 1341988164 UFSUYVJPDQABCF-UHFFFAOYSA-N 426.388 2.300 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3)C[C@@H]21)c1cc(O)nc(O)c1 1787295289 CMZPRDCXDQCUPO-JQFCIGGWSA-N 431.876 2.053 10 20 IECD COc1ncc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796597682 PNDNCLZBMFOCNA-BTTYYORXSA-N 432.864 2.115 10 20 IECD COCc1c[nH]c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796934440 DFYLJDOZPPHILO-GGPHIMKMSA-N 449.511 2.206 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)C(C)C)C3)cc1 1799620472 XKSWDWMRVAMKHP-MQFRRQCYSA-N 439.556 2.314 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1C 1799659344 ZGDHNUKXTCAUPF-BJWYYQGGSA-N 431.583 2.416 10 20 IECD COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1 1815440848 HACZSTFMKZNFCG-OAHLLOKOSA-N 438.444 2.239 10 20 IECD C[C@](O)(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1827424465 XVTLNSPXBZWOAU-LIRRHRJNSA-N 445.438 2.039 10 20 IECD C[C@H](CN)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877626 VSSMJMSGQOOALV-OUEBKFTGSA-N 431.533 2.031 10 20 IECD Cc1cscc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834986855 BVTLWRXBMJTDMD-UHFFFAOYSA-N 444.557 2.362 10 20 IECD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502210 AJBQOYGGPGOZJX-CABCVRRESA-N 448.903 2.324 10 20 IECD COc1ccc(F)cc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846808470 SNJDGXFRCQQQMP-XBXARRHUSA-N 442.443 2.482 10 20 IECD Cc1ncc(/C=C/C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847036788 DYZLTULHXKMAEW-NSLJXJERSA-N 441.509 2.498 10 20 IECD CCN(CC)S(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 105469043 SMMOKTKUXRBIDN-UHFFFAOYSA-N 448.589 2.447 10 20 IECD O=C(CS[C@H]1CCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565111 AWQIOWOLNLEVAR-INIZCTEOSA-N 434.530 2.293 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 726566447 OCFNQNQOJMLQQD-UHFFFAOYSA-N 438.475 2.484 10 20 IECD CC(=O)N1CCN(C(=O)CCNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 730783371 LGPACJJJRZTNCU-UHFFFAOYSA-N 444.963 2.487 10 20 IECD CC(C)(C)NC(=O)CN1CCN(C(=O)CN(Cc2ccccc2O)C2CCCC2)CC1 731848353 XJHRCTXZHATQBO-UHFFFAOYSA-N 430.593 2.196 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C2CCS(=O)(=O)CC2)NC(=O)OC(C)(C)C)cc1 742749653 JHMKMYAQJCPXRL-GOSISDBHSA-N 439.578 2.259 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(N)=O)cn2)NC(=O)OC(C)(C)C)cc1 742754900 RNKHKFHBDKHELT-GOSISDBHSA-N 427.505 2.242 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 742952265 JFHLOHCHFHVTCI-JOCHJYFZSA-N 426.448 2.084 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1cccc(Br)c1 744372697 GBGUFPCSPYEOQZ-UHFFFAOYSA-N 440.363 2.452 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NCc2ccccc2O)c([N+](=O)[O-])c1 748354917 PHMCPIMOYILTDL-UHFFFAOYSA-N 437.474 2.026 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)/C=C\c3ccccc3)CC2)cc1F 754028197 OJVGFWTVLJFQEL-YBEGLDIGSA-N 447.532 2.463 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(F)ccc3F)CC2)cc(OC)c1OC 759410163 QCRFGRTWBLYITD-UHFFFAOYSA-N 435.427 2.278 10 20 IECD C[C@H](CN1CCN(c2ccccn2)CC1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761315579 RTNQRLNXLYZJDR-MRXNPFEDSA-N 443.935 2.416 10 20 IECD COc1ncc(N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C(N)=O 761837098 WYEFOKDHKWMNQQ-GFCCVEGCSA-N 444.447 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(Cc4nc5ccccc5[nH]4)CC3)CC2)cc1 762312887 MEWAGDAITOIEJO-UHFFFAOYSA-N 448.571 2.038 10 20 IECD COc1ccc([C@@H](CCO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764353314 WRVCMLDUOUSINN-DENIHFKCSA-N 440.544 2.320 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cnn(C4CCOCC4)c3C)CC2)cc1 766410199 PXPDDDINILROKF-UHFFFAOYSA-N 427.549 2.104 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1 768169499 DIXVPTLQOVVTMC-UHFFFAOYSA-N 429.484 2.171 10 20 IECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3ccc(N4CCCCC4)cc3)CC2)C[C@@H](C)O1 768778411 OVFVNCWLPNDEMG-BGYRXZFFSA-N 436.622 2.149 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 774953359 HJBTTWCADNAFAH-HXUWFJFHSA-N 442.585 2.154 10 20 IECD Cn1cc(-c2ncccc2NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 786278657 YTZUYRIIMHOVTH-SFHVURJKSA-N 435.484 2.334 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnc(Cl)cn1 787873752 ODQUOXMYCSOTMJ-UHFFFAOYSA-N 427.871 2.316 10 20 IECD C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 787904452 SMIICAQINUJAPK-PMACEKPBSA-N 430.593 2.471 10 20 IECD C[C@@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 787907679 DAQKYRADMCKUJW-LJQANCHMSA-N 432.634 2.484 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@](C)(C4(C)CC4)C3=O)cc2F)C[C@@H](C)O1 789655416 YSRZUIUXCVSOJD-AQKDONEWSA-N 446.523 2.166 10 20 IECD Cc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800774 PSDCEEYHZQYKLA-UHFFFAOYSA-N 429.492 2.172 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855880 ZFDSRJLBSYVJMM-SFHVURJKSA-N 431.558 2.213 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc4c(cc3C)OCO4)cc2F)CC1 795100130 HCANFENBNLNNPG-UHFFFAOYSA-N 435.521 2.483 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)C(=O)N3CCCC3)cc2F)C[C@H](C)O1 796591208 BVIICIJKSKVBRU-IRXDYDNUSA-N 434.556 2.046 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(N2CCOCC2)cc1 803302165 INGLLDKOHPLTRF-SFHVURJKSA-N 440.519 2.188 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@]4(C3)OCc3ccccc34)CC2)cc1 804317340 ACYQJYMPKKNOLY-VWLOTQADSA-N 435.524 2.438 10 20 IECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804852303 GITNRCUULIGELQ-GOSISDBHSA-N 434.556 2.443 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccnc(OC2CCOCC2)c1)c1ccc(N(C)C)cc1 805541384 FKRKIMMFNKMZOT-INIZCTEOSA-N 426.517 2.199 10 20 IECD C[S@](=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 805865783 KQNLEJMVGVZIOG-GEFUHLBYSA-N 442.585 2.266 10 20 IECD CN1CCC[C@H](CN(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771965 ZOLZKJHMCIKRBZ-IRXDYDNUSA-N 438.519 2.173 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CC(N)=O)C3)cc2Cl)C1 807955667 ABFKEIFNXKVFGW-RDJZCZTQSA-N 434.968 2.307 10 20 IECD CC(C)OCCONC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812807295 IVQBCSGCTIKLCE-UHFFFAOYSA-N 439.446 2.188 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(C3=O)[C@@H](C)CCC[C@H]4C)CC2)cc1 884905205 JUKJKDZUENAAJJ-DTVZVWBHSA-N 428.533 2.091 10 20 IECD COc1ccccc1OCCN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917086618 GCPFKNVNZJMWCN-UHFFFAOYSA-N 431.508 2.298 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccc(F)cc3)cc2)C1 918118118 VYJOKIGAMDXZRD-VQTJNVASSA-N 442.535 2.178 10 20 IECD O=C(Nc1ccc(C(=O)NC2CC2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918297333 QTTXKIQDIBRXJP-HXUWFJFHSA-N 437.496 2.431 10 20 IECD C[S@](=O)Cc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918923694 JFGWGFWNBZXLAX-HKBQPEDESA-N 448.516 2.014 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1 920482139 KLTYZDSDEFFREF-UHFFFAOYSA-N 446.572 2.351 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993171 FGAVWODDBGSDAE-MGPUTAFESA-N 437.431 2.055 10 20 IECD CN(C)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817143903 ADXHBNWDYYPZHU-DYLHUKMJSA-N 443.504 2.184 10 20 IECD Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1825699280 CIXJNGJVTVNYJD-GOSISDBHSA-N 425.489 2.138 10 20 IECD CC[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876822 ZLOSGAFCWXKMJA-XJMNNFRSSA-N 432.517 2.207 10 20 IECD CCC(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1842634877 UGXUZDDNCONZIM-GOSISDBHSA-N 430.549 2.318 10 20 IECD O=C(c1csc(-c2cccnc2)n1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249869 JVGCHPWZIGBJIU-UHFFFAOYSA-N 437.481 2.142 10 20 IECD COc1ccc(C2(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)CCC2)cc1 1845161253 FPEJZMYSOIXGNE-UHFFFAOYSA-N 437.496 2.440 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(F)cc1F 1847930944 FNNVJLAQZGZVFJ-MMTUSNEMSA-N 431.395 2.005 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)s1 727248404 DXINJCMQRFCKJT-UHFFFAOYSA-N 448.511 2.435 10 20 IECD C[C@@H](Oc1cccnc1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 735431444 FKWMVVKIEFRTIX-QGZVFWFLSA-N 436.491 2.421 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCN(C(=O)c4ccc5c(c4)OCO5)CC3)ccc21 746981050 JEELECJGCMATSU-UHFFFAOYSA-N 436.512 2.465 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(C)=O)C4(CCCCC4)C3)CC2)cc1 754081022 JNWWRORRCLFIJT-HSZRJFAPSA-N 444.620 2.045 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)[C@@]12CCCO2 759325617 ZVCMFPBGSPOEKQ-ZDXQCDESSA-N 446.592 2.233 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(C(N)=O)c(C)c3)CC2)cc(OC)c1OC 759977202 DJXZXGGVTRNWDO-UHFFFAOYSA-N 428.489 2.474 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(S(C)(=O)=O)c(F)c3)CC2)cc1 760540374 OOWGTYBFAZJRDC-UHFFFAOYSA-N 442.534 2.139 10 20 IECD C[C@H](CCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769518280 VFKVBUNTGKQOTF-QGZVFWFLSA-N 441.553 2.086 10 20 IECD COC(=O)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(OC)c(Cl)c1 771663820 SQMJRSKBQWOUAL-MRXNPFEDSA-N 442.877 2.070 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@H]3CCO[C@]4(CCS(=O)(=O)C4)C3)cc2)CC1 776041070 JCRONBHWQJNYKA-SIKLNZKXSA-N 435.590 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC)cc3F)CC2)cc1 778323703 JTNLTHYDDZUIOY-KTKRTIGZSA-N 427.476 2.364 10 20 IECD CN1CCC(N(C)[C@@H]2CCCC[C@H]2N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785445886 ZYGCMONUYVQSFO-DHIUTWEWSA-N 443.636 2.164 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1OC(F)F 785501884 BNZCEDQCVLURDT-UHFFFAOYSA-N 425.407 2.434 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(N(C)C)cc1 787736517 KPEHZZBMKCJOFP-AUSIDOKSSA-N 437.588 2.035 10 20 IECD CCCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824249 HMAHDLHACAAJCR-NSHGMRRFSA-N 448.583 2.246 10 20 IECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)o1 789828141 WPNDVNKTCCRORZ-JTDSTZFVSA-N 447.507 2.461 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1 792035081 JZIJHDUXXNMFNJ-UHFFFAOYSA-N 446.592 2.424 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)NC3CCN(c4ccc(OC)cc4)CC3)ccc2[nH]1 792344920 VCVZWSILOFVMDP-UHFFFAOYSA-N 449.511 2.260 10 20 IECD CC(C)CC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793717226 DQTWDUZGBMBZMV-CTNGQTDRSA-N 428.577 2.432 10 20 IECD O=C(NCc1ccccc1-n1ccnc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793718498 MRRTVHQYRNEOAU-HXUWFJFHSA-N 434.496 2.402 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2C)cc1 797432838 VCVDZQJXYHZKPK-UHFFFAOYSA-N 433.895 2.024 10 20 IECD CC(=O)N[C@](C)(C(=O)NCc1ccc(N(C)C)cc1C)c1ccc(S(C)(=O)=O)cc1 797453050 LYYHYOWBGXYMNV-QFIPXVFZSA-N 431.558 2.132 10 20 IECD C[S@@](=O)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 798104010 QFTTYOZRWHEWMY-AREMUKBSSA-N 428.557 2.286 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c4cccc(F)c34)cc2)C1 799763485 PBJRDIZPTWGLDM-HNNXBMFYSA-N 430.505 2.487 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N(C[C@@H]1CCOC1)C1CC1 803448108 HRHDXMWKBMWXNP-HNNXBMFYSA-N 437.487 2.401 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807450462 JODZACRZALQBAM-WOJBJXKFSA-N 437.588 2.257 10 20 IECD C[C@@H]1CN(CCCNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CCCO1 807931921 ZBQXKADPYAXFMK-GOSISDBHSA-N 429.517 2.131 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2ccc(Cl)cc2C)c1O 809713257 FNICMVVBDQRKQP-UHFFFAOYSA-N 429.882 2.339 10 20 IECD CS(=O)(=O)c1ccc(N(CCN)Cc2cccc(Br)c2O)c([N+](=O)[O-])c1 809728387 VMXBYKSUNKJKLG-UHFFFAOYSA-N 444.307 2.432 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc(C4CC4)n(C)n3)cc2F)C[C@H](C)O1 810349421 DUKCYSILMWKHRX-KBPBESRZSA-N 429.496 2.305 10 20 IECD Cc1cc(C(=O)OCCN2C(=O)c3ccccc3S2(=O)=O)c(C)n1-c1ccccn1 914906581 NMZCJIMAHOBKKU-UHFFFAOYSA-N 425.466 2.491 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(O)c(C(=O)O)c3)cc2F)C[C@@H](C)O1 917918649 RNLNANHOFSODKW-CHWSQXEVSA-N 438.477 2.322 10 20 IECD Cc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1-n1cnnn1 918293937 JRUMHGGEYRVAEF-UHFFFAOYSA-N 432.440 2.437 10 20 IECD Cc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1-c1ccc(O)nn1 918632941 FMHMXHBRFPREGP-KBPBESRZSA-N 440.479 2.359 10 20 IECD C[C@@H](NC(=O)c1ccoc1)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919480242 AIASVNARWYKITN-CYBMUJFWSA-N 446.415 2.355 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 919860355 WAWPUWGFKUJQAI-UHFFFAOYSA-N 437.949 2.357 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 920923380 POYNLKZDDVVKOY-AWEZNQCLSA-N 440.475 2.363 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(N2CCOC2=O)c1 920940185 YNQAZTLAQVIZMU-UHFFFAOYSA-N 444.513 2.200 10 20 IECD O=C(COC(=O)[C@H]1COc2ccc(F)cc2C1)NCc1ccc(N2CCOCC2)c(F)c1 1116405252 PTMGNHIGDLZQIE-QGZVFWFLSA-N 446.450 2.212 10 20 IECD CCCN(C(=O)[C@@H](C)N1CCN(c2ccc(OCC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 1319847910 QMALKMDYXQTMDP-QUCCMNQESA-N 437.606 2.022 10 20 IECD Cn1nnnc1-c1ccc(NC(=O)C2=S=C(Cn3cc(Br)cn3)C=C2)cc1 1586336640 ZZDOPSNBLQDUOD-UHFFFAOYSA-N 444.318 2.123 10 20 IECD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)ccn1 1779518433 ARTLBGGPBMRZFE-NRFANRHFSA-N 431.876 2.212 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)Cn4cccn4)CCO3)C2)cc1 1781754218 UNFSWZGVORRQAO-RUZDIDTESA-N 447.539 2.434 10 20 IECD Cc1noc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005134 UZOPGFBAAIZANM-HXUWFJFHSA-N 435.864 2.113 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)nn1C 1799008183 BEIHVGLSWPTKOD-BGYGVLGPSA-N 440.500 2.065 10 20 IECD O=C(CC12CCCN1CCC2)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547151 RBPQGOKHZVSMDE-UHFFFAOYSA-N 442.560 2.356 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(O)O)n[nH]2)cc1 1814710946 UJPUSZYWHHFDCL-LJQANCHMSA-N 437.500 2.434 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1 1829722808 BULYTCQDZXRNOV-KRWDZBQOSA-N 426.473 2.141 10 20 IECD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1832235954 JUBIYMUWKFRAAO-QAPCUYQASA-N 427.505 2.184 10 20 IECD CC(C)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839850436 IMIQWHFJXMFUGR-OAQYLSRUSA-N 440.924 2.257 10 20 IECD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248757 KUAYMZGIQXDTLG-UHFFFAOYSA-N 446.847 2.114 10 20 IECD O=C(COc1ccc(F)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038968 GZQHQRWHHFMNOX-YCRREMRBSA-N 442.443 2.238 10 20 IECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 109430791 DDHNRHQJTYSXGH-UHFFFAOYSA-N 440.587 2.387 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2 740031974 OSANYLWFSSGUSX-IBGZPJMESA-N 447.919 2.481 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(N2CCOC2=O)ccc1F 741546028 FAUZSGAWZQJVQZ-UHFFFAOYSA-N 433.461 2.269 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1F 742071122 GNXBZFRLTIUPAD-AWEZNQCLSA-N 439.557 2.005 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)NC(=O)OC(C)(C)C)cc1 742755026 UNNHCAGOSTUMHL-VQIMIIECSA-N 430.549 2.446 10 20 IECD COC(=O)NC(C)(C)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744961423 LUFNGZSABLLGJZ-GFCCVEGCSA-N 438.436 2.467 10 20 IECD CCn1nc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1Cl 745360526 DMWJQRXRQHPJLF-UHFFFAOYSA-N 438.887 2.314 10 20 IECD CCN(CC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1 748305850 PPOYFNGADVWDEQ-INIZCTEOSA-N 436.534 2.033 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(NC(N)=O)cc1 749343745 HDFIAVKJBHTGPU-MAUKXSAKSA-N 438.532 2.439 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN([C@@H](C)C(F)(F)F)CC3)CC2)cc1 749561823 IRIUEMXCCJQGQX-KRWDZBQOSA-N 443.514 2.095 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3noc4ccccc34)cc2)C1 760540081 YVLDAEZSOINZPK-INIZCTEOSA-N 428.514 2.149 10 20 IECD Cc1noc(C)c1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 774176099 BUTQFBLULWJETG-OKILXGFUSA-N 432.496 2.319 10 20 IECD Cc1noc(C)c1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 774176103 BUTQFBLULWJETG-ZIAGYGMSSA-N 432.496 2.319 10 20 IECD CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2cc(OC)ccc2O)sc(C(N)=O)c1C 775371389 WYWUOEOQNRJCSY-NSHDSACASA-N 435.502 2.336 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc4nc(N5CCOCC5)oc4c3)ccc21 781476740 CVNHONVCNSCEIO-UHFFFAOYSA-N 449.511 2.302 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)C2)cc1 783111936 MADZWYVEHXXGTD-INIZCTEOSA-N 433.482 2.233 10 20 IECD CC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC[C@H]1O 783753576 JZXONVBIPWKGRH-GOSISDBHSA-N 449.485 2.334 10 20 IECD C[C@H](OC(=O)CCCCNC(N)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785566182 LTCZZYQIUUSCKA-ZDUSSCGKSA-N 437.452 2.171 10 20 IECD O=C(NCCc1cnn(-c2ccccc2)c1)C(=O)NCc1ccc(N2CCSCC2)cc1 786116339 FMCPUEQRRHRJFM-UHFFFAOYSA-N 449.580 2.401 10 20 IECD C[C@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 787327747 MVUPNYYDCLSTOG-KSSFIOAISA-N 429.492 2.436 10 20 IECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1OC 787923640 FFOZWVOACGDJFJ-UHFFFAOYSA-N 443.569 2.232 10 20 IECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)ncn1 788932402 NDEJLBCVPUWBLE-HXUWFJFHSA-N 436.560 2.041 10 20 IECD CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 790045186 BCAPGLDUTUVJOS-HXUWFJFHSA-N 437.606 2.212 10 20 IECD Cc1cc(C(=O)CN2C[C@H](C)O[C@@H](C3CC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791561497 YQSXPENMJJVSHG-OYHNWAKOSA-N 431.558 2.424 10 20 IECD COc1ccc(CNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c(O)c1 792956567 OPEQNISALMRZTL-UHFFFAOYSA-N 432.908 2.202 10 20 IECD CCN(CC)C[C@@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793789306 GAGJYIOCDHKXEC-OAHLLOKOSA-N 426.508 2.220 10 20 IECD CC[C@H]1Oc2cc([C@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc2NC1=O 803662833 HKEWMNMJQKFETC-ORAYPTAESA-N 442.491 2.495 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)NCCN3CCOCC3)c2C)cc1 805967121 GEBDPRWOYMTRDO-GOSISDBHSA-N 429.517 2.096 10 20 IECD Cc1cc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)nc(C(C)C)n1 806276808 WNYIOHTXNARZFR-UHFFFAOYSA-N 448.618 2.312 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1nc2c(s1)CSCC2 806841942 BOGYXTITKQFILF-UHFFFAOYSA-N 436.534 2.163 10 20 IECD CCCN1CC[C@@H](CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770376 LFQMGRFAVJJROH-IRXDYDNUSA-N 438.519 2.221 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 808613523 PEJDVPJIZVDFAD-SFHVURJKSA-N 432.883 2.083 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cn(C2CCOCC2)nn1 810159983 PLRAOSNHYPJHFP-UHFFFAOYSA-N 439.438 2.415 10 20 IECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 813656309 WYTDCLIMCYOXQO-UHFFFAOYSA-N 448.541 2.325 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 917999635 BQHBVVKUKQJBCG-UHFFFAOYSA-N 446.573 2.166 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1)c1ccc(N2CCOCC2)cc1 920925754 LMEYNYHQZRKSHM-GOSISDBHSA-N 438.528 2.176 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CC(C)(C)CN(C)C)C2=O)cc1OCC(N)=O 1321450826 AJELGLYEYQVBIB-CXUHLZMHSA-N 437.587 2.348 10 20 IECD Cc1ncc(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)[nH]1 1792314769 VBACSOGYJFPROX-UHFFFAOYSA-N 443.554 2.326 10 20 IECD Cc1nc[nH]c1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792315099 CQNCVSTXKQQJJO-UHFFFAOYSA-N 443.554 2.326 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1 1814162378 RVYFWEOHGZGWOZ-MQBPBFNCSA-N 441.459 2.276 10 20 IECD Cn1ncnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816303631 YVUDZCDEFRTLNG-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817846057 HHAIXVULQWANSY-OAHLLOKOSA-N 426.433 2.386 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)[nH]n1)c1cc(O)nc(O)c1 1817848278 BUCYGNMYDZMDQI-NOLJZWGESA-N 429.477 2.073 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N(C)C)cc2C)cc1OCC 734468076 JAJWLCHFDGVEPN-UHFFFAOYSA-N 449.573 2.453 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N(C)C)cc3C)CC2)cs1 734687252 QBIGGHSGADRREU-UHFFFAOYSA-N 437.591 2.042 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN(C)c1cc(OC)c(OC)c(OC)c1)n2C 741795316 JNSMLKJKJYSPSK-UHFFFAOYSA-N 431.493 2.298 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(Cc4ccccn4)n3)cc2)C1 743167377 MODPEHOYXYMPMC-GOSISDBHSA-N 433.516 2.350 10 20 IECD NC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)s1 748964683 HJSCCPOWHIXPEN-UHFFFAOYSA-N 434.429 2.418 10 20 IECD CN(C)C[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 752484679 WJWSPAQCLCRYLK-RXEWJAMOSA-N 427.617 2.158 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)co1 756793870 QIIBBBAIQUMWBI-INIZCTEOSA-N 441.937 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 756864649 VPBLBSLKBWAORA-IAGOWNOFSA-N 428.533 2.091 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4sc(C)c(C)c4c3=O)CC2)cc1 758196436 ZJFYKCYROFELFD-SFHVURJKSA-N 428.558 2.267 10 20 IECD COC(=O)c1cn(C2CCN(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)CC2)nn1 760109357 MROLZYOZNZRSQV-UHFFFAOYSA-N 442.520 2.089 10 20 IECD C[C@H](CC(=O)NCc1ccc2c(c1)CCCN2C)NS(=O)(=O)c1cccnc1Cl 760474740 QYSCNLWBQXSDEB-CQSZACIVSA-N 436.965 2.491 10 20 IECD NC(=O)c1ccccc1N1CC[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761272337 BPOJCNMYJRFOIW-HNNXBMFYSA-N 428.876 2.188 10 20 IECD CN1CCN(CC2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)CC1 764219729 WCIAHLYSGUQSGV-UHFFFAOYSA-N 431.650 2.409 10 20 IECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 764247284 KBAMGJQWJVGHJU-HNNXBMFYSA-N 432.546 2.084 10 20 IECD CCOC(=O)Cc1csc(NC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 764999999 FHNXFWGDZSNFQD-HNNXBMFYSA-N 432.546 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccnc3OCC(F)F)CC2)cc1F 765873961 KHQWQTBQUQXSPG-UHFFFAOYSA-N 438.406 2.161 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(NS(C)(=O)=O)c1 765981562 WTBRIKSFSDGZMI-INIZCTEOSA-N 437.587 2.144 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCNC(=O)c4ccccc43)cc2F)C[C@@H](C)O1 773611957 ULSAPKUPNFHBAK-CALCHBBNSA-N 440.519 2.306 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775647661 XLJDWYIEDKZARY-FGZHOGPDSA-N 427.637 2.061 10 20 IECD COc1cc(O)c(CNCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1OC 776082073 FBJZYUXOYFNRRP-KRWDZBQOSA-N 436.530 2.157 10 20 IECD COC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1O 778403070 FJXMWRMSYJCJRZ-KHPPLWFESA-N 439.468 2.031 10 20 IECD COc1ncc(C)cc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766139 YXBCXKQQAVHELJ-MRXNPFEDSA-N 432.908 2.477 10 20 IECD C[C@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCN(c2ccccc2)CC1 788015159 MNHUSASLEDHRDO-QGZVFWFLSA-N 447.630 2.068 10 20 IECD O=C(NC1CCN(c2ccccn2)CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788643709 QISOAWXINSXVOS-FQEVSTJZSA-N 438.528 2.080 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC4(CCCC4)C3)cc2F)C[C@H](C)O1 789821956 VCCFUJPSGIXQRT-IRXDYDNUSA-N 433.524 2.227 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 789827124 RKFNWJMMFUJASY-HZPDHXFCSA-N 431.512 2.149 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)CC1 797623825 ODRSJVRUPMTXCH-MRXNPFEDSA-N 442.516 2.146 10 20 IECD CN1CCCc2cc(CNC(=O)NCCNS(=O)(=O)c3ccc(F)cc3F)ccc21 799563905 PHJJQVQDILYJLN-UHFFFAOYSA-N 438.500 2.125 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC[C@@H]1NC(=O)OC(C)(C)C 803662544 CXJDHIAVZRRMFA-PBHICJAKSA-N 436.528 2.270 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(C(=O)CCC4CCCC4)CC3)ccc21 803688399 QDCVLDCUQAPILQ-UHFFFAOYSA-N 440.588 2.326 10 20 IECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2=O)cc1 803688676 YOWRXIQKAAKEHF-OAQYLSRUSA-N 434.540 2.305 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688805 BMXMZPDMAVFGHG-QFBILLFUSA-N 430.549 2.058 10 20 IECD C[C@@H](OC(=O)[C@H](O)c1cccnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954876 ZWWAFVJDHJTFFS-ZUOKHONESA-N 430.416 2.461 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@@H](O)c3ccc(C)cc3)CC2)cc1 804467191 ATCCYYLQIDRZSV-QLPRGREVSA-N 437.540 2.447 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CSCCS1 806477770 LLXNPFDQDDHAQZ-CYBMUJFWSA-N 433.393 2.468 10 20 IECD CN(C)C(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806495601 IKWGCBVMCRTEQL-AZUAARDMSA-N 445.564 2.151 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807450441 JJQLGDZMBFFVFX-FQEVSTJZSA-N 437.588 2.038 10 20 IECD CC(C)C[C@H](CO)N(C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769509 GPGPBMGLKJYRCD-DOTOQJQBSA-N 427.492 2.238 10 20 IECD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917710474 MQRFQJDRJPEOEG-NRFANRHFSA-N 442.470 2.197 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918437630 LBNQAGKIGFSDNV-UHFFFAOYSA-N 442.585 2.435 10 20 IECD CCNC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 918457448 SXBGNSVBNBXMIH-UHFFFAOYSA-N 438.528 2.397 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCC(F)(F)F)nc1 920195397 RCOQHEXTZSAOKA-UHFFFAOYSA-N 438.406 2.114 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1Cl 920926551 RBMJESCFNCQCQV-CQSZACIVSA-N 444.919 2.352 10 20 IECD O=C(CN1CCn2c(nnc2C2CCCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 1116313207 OMAZPKHBBJFUKT-UHFFFAOYSA-N 442.539 2.043 10 20 IECD CNC(=O)Cc1ccccc1NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1323864911 ZCJXHWMYVIIVAI-UHFFFAOYSA-N 442.516 2.355 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2 1782008602 FQRCAZKZDMIBHP-QFZSKUSHSA-N 436.917 2.070 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1[nH]nc2ncccc12 1817913760 LTKVDXCOAZVSFP-CQSZACIVSA-N 448.443 2.107 10 20 IECD O=C(c1c[nH]c2nccc-2c1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249868 JTJUSWVPYKYNIJ-UHFFFAOYSA-N 427.848 2.105 10 20 IECD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251327 ULRHCDNDQJZFKV-OAHLLOKOSA-N 448.520 2.003 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)c3cc[nH]n3)c2C)c1 46669068 WUYRMZMVNCRLPN-UHFFFAOYSA-N 439.424 2.430 10 20 IECD Cc1cc(S(=O)(=O)CCO)ccc1NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 428301391 CLFPPWASOKWULO-UHFFFAOYSA-N 444.534 2.229 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NCc2ccc(N3CCCC3)cc2)C1 728949164 OBYMXHXRXHTKMG-IBGZPJMESA-N 430.549 2.230 10 20 IECD CC(C)(C)c1nsc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 737132308 YUUSLQOTLGMTSM-UHFFFAOYSA-N 431.562 2.299 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3CN3CCOCC3)cc2F)C[C@@H](C)O1 745648348 JXOWDEJBSYXNHO-WSTZPKSXSA-N 434.556 2.446 10 20 IECD COC(=O)C[C@@H]1CSCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 746464688 WLMWUVVOKCYIMO-CQSZACIVSA-N 438.505 2.381 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(C)c(C(=O)O)c3)CC2)cc1 748969317 MRXLZOBWHOBJON-UHFFFAOYSA-N 447.557 2.192 10 20 IECD CCn1nc(C)c(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 759100834 FVXQVPQDIMJFEX-UHFFFAOYSA-N 438.550 2.057 10 20 IECD Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 760098408 YKSDNDKNTNZYLO-UGKGYDQZSA-N 449.555 2.079 10 20 IECD COCCO[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 760965380 JVNGPRPRQOFARX-NSHGMRRFSA-N 437.556 2.183 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)CCNS(=O)(=O)c2ccccc2)cc1F 763326910 UCSVJLRYNIMAAQ-UHFFFAOYSA-N 443.566 2.070 10 20 IECD COc1ccc2c(c1)OC[C@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 768049707 WCUJZZKNJYXVRK-RBUKOAKNSA-N 438.528 2.200 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 768898998 DOPXBDYXHWZUEE-UHFFFAOYSA-N 440.468 2.136 10 20 IECD C[C@@H]1CO[C@@H](CO)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 769001132 XTHDXXLBHWZDCA-VPHXBNOSSA-N 426.585 2.338 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1nccn2c(Br)cnc12 769880490 XGGVCQWVYORMPR-UHFFFAOYSA-N 446.305 2.373 10 20 IECD CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)n1 770281492 JIHBOQCRQSQLLT-KRWDZBQOSA-N 433.528 2.461 10 20 IECD C[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)c(F)c1 773090893 HLGKNAZXDWBAOJ-GDBMZVCRSA-N 428.551 2.209 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)OCO4)cc2F)C[C@H](C)O1 774407220 CLGWOYNSUHPDKH-GJZGRUSLSA-N 443.475 2.101 10 20 IECD CC(C)OCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774767977 OQLCOUWJWOQCPA-UHFFFAOYSA-N 431.455 2.090 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOc3ccccc3)cc2F)C[C@H](C)O1 774855945 BFTNGLPXBJTOQI-IRXDYDNUSA-N 429.492 2.251 10 20 IECD COc1ncc(/C=C/C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 775136974 ZPGMTJWEVOKCIH-MDZDMXLPSA-N 443.415 2.456 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C3CCOCC3)C[C@H]2C)c1 782912098 AJPYTRCZFBLIGR-GOSISDBHSA-N 431.577 2.112 10 20 IECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2C1 784665102 ILIGOZYUZVSPIJ-HXUWFJFHSA-N 441.503 2.155 10 20 IECD CCn1c(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nc2ccccc21 785472552 HYTBNVFQYRZHHU-QGZVFWFLSA-N 435.528 2.386 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)CC2)cc1 785802056 GJBJEMVYILLENK-ZAWLATJESA-N 442.434 2.243 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](Oc4ncccc4F)C3)CC2)cc1 785839222 SGFJKHRGFXXVHO-FQEVSTJZSA-N 428.508 2.421 10 20 IECD CC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)=NN1c1ccccc1 786656723 QJOKESMHYLZTNU-XMMPIXPASA-N 447.539 2.195 10 20 IECD Fc1cc(CN[C@H](c2cccnc2)c2nc[nH]n2)ccc1N1CCN(c2ncccn2)CC1 788564571 WSFHYXQYESNPIM-OAQYLSRUSA-N 445.506 2.335 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCn4cccc4[C@@H]3C)cc2F)C[C@@H](C)O1 789822322 ABBYHFLCNQLCLS-BBWFWOEESA-N 428.508 2.460 10 20 IECD O=C(NCCc1ccn(-c2ccccc2)n1)C(=O)NCc1ccc(N2CCSCC2)cc1 789854517 IMXPXPDPCIPCOR-UHFFFAOYSA-N 449.580 2.401 10 20 IECD Cn1cc([C@H]2CSCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 790237014 IXFKHSDOUAMPNP-FXAWDEMLSA-N 442.589 2.122 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccnc2-n2ccnc2C)cc1F 793805305 NIFSBRNOTOEMGW-UHFFFAOYSA-N 438.507 2.494 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 802550046 IPEVXCZNPPHJDD-UHFFFAOYSA-N 447.438 2.185 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cs1 807291455 KULFXMGIBVEVJB-UHFFFAOYSA-N 439.585 2.042 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1ccc(F)cc1 807632380 DMBAWZGVIRIUKP-QGZVFWFLSA-N 429.492 2.204 10 20 IECD CCOc1cc(NC2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)ncn1 807670106 BCMLCDLIVGDUNN-INIZCTEOSA-N 440.548 2.222 10 20 IECD Cc1nc2n(n1)CCN(C(=O)C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 807955343 ULDLNWWDRRPNLL-CQSZACIVSA-N 430.940 2.135 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809243040 FZZGCBNMVZSGDV-VQIMIIECSA-N 432.565 2.473 10 20 IECD NC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCSCC3)cc2)=NN1c1ccc(F)cc1 917386653 RGNAQDFUWCIGDM-HXUWFJFHSA-N 441.532 2.115 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920924458 BRXLGHGUUCAEIT-MRXNPFEDSA-N 425.485 2.055 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1)c1ccc(N2CCOCC2)cc1 920926479 PVIVKWGOJQFEJC-MRXNPFEDSA-N 438.484 2.296 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C 1321512419 XBLLWDAZJNPHOX-YOEHRIQHSA-N 436.505 2.334 10 20 IECD CCOC(=O)c1ccc(N2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)nc1 1336944050 UXGZGSLILKWRRN-UHFFFAOYSA-N 441.551 2.471 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(F)c1)C2)c1cc(O)nc(O)c1 1777852830 XHEVDWIHZKOBLN-VGOFRKELSA-N 429.448 2.073 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H]4[C@H]5COC[C@H]54)C3)C2)cc1 1784852818 HSUCSNCEKWRMFV-QTZVNIFKSA-N 449.551 2.430 10 20 IECD O=C(C[C@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796930877 HKUKOHHZVCZGRN-GSEOLPGOSA-N 438.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1CCCS1 1796935363 ATWHSCINXPWPJK-NOCIGQNYSA-N 426.542 2.313 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1[N+](=O)[O-])c1cc(O)nc(O)c1 1804313710 BVWPQCHUYGJCDL-MUJYYYPQSA-N 444.419 2.035 10 20 IECD O=C(CCN1CCCCC1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809318054 AWONYOYNUGZSNP-UHFFFAOYSA-N 430.549 2.214 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1 1823496360 LQLBMDSOSISDRZ-SNVBAGLBSA-N 449.480 2.215 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 22278324 UDGGTQPXPPYKGQ-UHFFFAOYSA-N 437.587 2.358 10 20 IECD CN1CCN([C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2)CC1 728469163 NLHLNYBGDUHFBU-HSZRJFAPSA-N 426.536 2.267 10 20 IECD CN(C)c1ccc(CNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1F 729231990 AWDJNOBHJNWDEL-UHFFFAOYSA-N 429.544 2.083 10 20 IECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 732833781 HLGKDVBCFFDMAM-UHFFFAOYSA-N 426.516 2.339 10 20 IECD COC(=O)[C@@H](C)[C@@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 751034244 YWEYERUHEQZKNA-FDDCHVKYSA-N 425.529 2.484 10 20 IECD Cn1c(=O)nc(O)c2cc(S(=O)(=O)N(Cc3ccccc3O)C3CCCCC3)cnc21 751138066 YHQIPLXSWSLZMI-UHFFFAOYSA-N 444.513 2.263 10 20 IECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753740565 RRBPIMNSKWJFRV-SFHVURJKSA-N 427.542 2.077 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnnn3C3CCCCC3)CC2)cc1 758196162 BTNPNXGVYHGHMN-LJQANCHMSA-N 432.594 2.462 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759984328 UINVHILMCUISEH-UHFFFAOYSA-N 432.477 2.490 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765926329 LPYITTXZAONKQA-UHFFFAOYSA-N 437.246 2.205 10 20 IECD Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 770350530 NFMCWSCTMKVGHC-UTKZUKDTSA-N 445.539 2.176 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](c3ccccc3)C3CC3)cc2)C1 774388251 LWDFEJSNVZRGGG-IRLDBZIGSA-N 434.540 2.272 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCc2ccccc2C1 775122979 SCHMLLABQJNTFX-LJQANCHMSA-N 425.504 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3NC(C)=O)CC2)cc1 778290341 VEPRIQHDDNAVBR-VAWYXSNFSA-N 436.512 2.175 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccnc(OC(C)C)c3)CC2)cc1 778393518 GHYNJZOXHFZFRK-HJWRWDBZSA-N 438.528 2.399 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1F 782984313 TWILLNQZTDOHKB-INIZCTEOSA-N 435.521 2.323 10 20 IECD COc1ccc(F)cc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789061383 KKXZLHVUSLTHLM-CQSZACIVSA-N 433.455 2.304 10 20 IECD CC(C)NC(=O)NC1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCCC1 792074146 IBHRAPKLPDOFJM-LJQANCHMSA-N 443.592 2.415 10 20 IECD CN(C)S(=O)(=O)c1cccc2c1CCN(Cc1ccc(N3CCOCC3)c(F)c1)C2 793609826 CKMJALZTVOJFCA-UHFFFAOYSA-N 433.549 2.471 10 20 IECD COC(=O)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 797290158 GCFZISGXUDEAEW-LBPRGKRZSA-N 443.319 2.478 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H](CO)[C@@H]1CCOC1 797762244 JVKMVSCNVNFGOM-SHLZMMBASA-N 440.612 2.491 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nccn3-c3ccccc3)CC2)cc1 801970972 YRRYBHIYEYKSIN-QXMHVHEDSA-N 445.523 2.402 10 20 IECD COc1ccc(COCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 803301343 ZQBZXDUUVYYHDG-GOSISDBHSA-N 441.528 2.042 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCOc4c(OC)cccc43)CC2)cc1 804318242 DUZMKDGWWOWYBM-FQEVSTJZSA-N 439.512 2.429 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc(Cl)c(F)c3)cc2)C1 804961490 YFIWCUQQEYLZQM-ZDUSSCGKSA-N 426.901 2.054 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](c4ccco4)C3)cc2F)CC1 805006841 HXSFHXHNIHZUTH-SFHVURJKSA-N 428.508 2.193 10 20 IECD COc1cc(N2CCN(C(=O)C3CCN(CC(F)F)CC3)CC2)cc(OC)c1OC 807246809 PWORGMOOPSXKQC-UHFFFAOYSA-N 427.492 2.338 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ncnn1C(C)(C)C 809927557 GAFARQAXJBEYEN-UHFFFAOYSA-N 438.326 2.166 10 20 IECD Cc1cc(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c(O)c(C(C)(C)C)c1 917444291 SJFSHJHKJHUNDM-UHFFFAOYSA-N 435.546 2.197 10 20 IECD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)cc1 920434914 CJSRHYKIVDGKFF-UHFFFAOYSA-N 432.502 2.180 10 20 IECD Cc1ccc([C@@H](NC(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C2CC2)cc1 920636754 IJDYMXOHUCYMFF-HXUWFJFHSA-N 432.498 2.496 10 20 IECD CC[C@@H](C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314809 YSUAPNQBDDLASJ-FZKQIMNGSA-N 449.598 2.388 10 20 IECD COc1cc(C)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340553 VIVUQDUYCAEIGT-QDMKHBRRSA-N 447.582 2.116 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)c1ncon1 1820018848 XHCRSVGXKPLSID-LBPRGKRZSA-N 432.824 2.477 10 20 IECD O=C([C@@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832883156 YRFYQGRFQGSKCE-VRKMBTERSA-N 444.528 2.473 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3nccnc3c2)C1 1843781123 DPPPYIYGDMYCES-QPJJXVBHSA-N 446.463 2.277 10 20 IECD CC(=O)N1CCN(CCOc2ccc(CCNCc3cc([N+](=O)[O-])ccc3O)cc2)CC1 728063534 RLCCERMKJXSMJW-UHFFFAOYSA-N 442.516 2.176 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1 729062485 BYSSRGMUOVEBFW-ZDUSSCGKSA-N 449.529 2.294 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](O)COc3ccccc3)cc2F)CC1 730134365 ZXNNKQKQFASEOL-LJQANCHMSA-N 430.524 2.207 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1 740811186 UKVXCUBNQMDUAS-UHFFFAOYSA-N 425.488 2.206 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN(C(=O)C(C)(C)C)C3)CC2)cc1 742917500 YIRBZAXJKPAEQQ-LJQANCHMSA-N 430.593 2.218 10 20 IECD COc1cc(CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc(OC)c1 747844304 RTZCQFMQFFZUQQ-UHFFFAOYSA-N 426.561 2.204 10 20 IECD O=C(NCC[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 753231135 CNDCDKUDBBHIGV-ZDUSSCGKSA-N 435.458 2.258 10 20 IECD CCc1ccccc1NC(=O)CN(C)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 753998397 BTVDIGMRWPGAMD-JOCHJYFZSA-N 440.588 2.311 10 20 IECD COc1cc(OC)c2c(c1)N(CN1CCN(c3ccc(OC)c(F)c3)CC1)C(=O)C2=O 754014295 SLLGHCUODOHYBH-UHFFFAOYSA-N 429.448 2.161 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)c(F)cc1O 756706438 QWTCVQJOYIHRFB-NEPJUHHUSA-N 439.347 2.433 10 20 IECD C[C@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS1(=O)=O 758890328 ZKPWOHNVZWQOCV-GJZGRUSLSA-N 431.505 2.475 10 20 IECD O=C1CN(C(=O)/C=C/c2cncc(F)c2)c2ccc(S(=O)(=O)N3CCCCC3)cc2N1 759763423 LPONKOFSKGJDSQ-QPJJXVBHSA-N 444.488 2.394 10 20 IECD O=C(CCc1nnc(C2CCCC2)o1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 760407740 LYWILEQRPSZPAT-UHFFFAOYSA-N 432.546 2.211 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)Cc3nc(O)c4sccc4n3)CC2)cc1 767954566 GQJVGFSYFQKSAQ-UHFFFAOYSA-N 427.530 2.186 10 20 IECD CS(=O)(=O)Nc1ccc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1 770395552 SMKAHKTWGFNAKP-UHFFFAOYSA-N 430.574 2.217 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 771203035 CACXSNYPLQIQBZ-FQEVSTJZSA-N 448.523 2.493 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 772398219 HAQUPNXGKYQHGI-UHFFFAOYSA-N 432.546 2.404 10 20 IECD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)c1 773017152 UKFOZCHSDKPKIH-LJQANCHMSA-N 444.601 2.390 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(N4CCCCC4)CC3)CC2)cc1 778247200 VLJMXQAQWFEHRQ-MDZDMXLPSA-N 440.588 2.377 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](O)[C@H](O)c1nc2ccccc2s1 779489528 RTBLXCMNIWAKPU-PMACEKPBSA-N 445.516 2.107 10 20 IECD COc1cccc([C@@H]2[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)CCN2C2CC2)c1 785443557 NIIAGQGIROGLGA-XZOQPEGZSA-N 436.556 2.472 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C(=O)c3ccncc3)cc2)cc1 785443620 NQLBGTAKRFXZFA-UHFFFAOYSA-N 445.523 2.357 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1 785648169 NYBIQRMRRGHABP-OAQYLSRUSA-N 442.560 2.192 10 20 IECD COCCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 787994517 NVIXTGDMBABELO-UHFFFAOYSA-N 443.569 2.198 10 20 IECD Cc1cnccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789818725 KNWQCHUFNDXJCR-IAGOWNOFSA-N 428.508 2.118 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccsc3)cc2)C1 793723949 OTWNHUHDVNFRCY-FXAWDEMLSA-N 440.569 2.430 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)C1 793729581 AHMAVFRTWKPHJU-YADHBBJMSA-N 448.567 2.096 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@](CO)(c4ccccc4)C3)CC2)cc1 794734774 NYBZPFMSKNGLSW-ZQJVVAQZSA-N 449.551 2.063 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)c(O)c1 797389547 MVKFNHKHDKXFRJ-UHFFFAOYSA-N 442.863 2.162 10 20 IECD Cc1cc(C(=O)COC(=O)C(C)C)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 797586780 MPOTVZHITYGPFM-UHFFFAOYSA-N 448.541 2.497 10 20 IECD NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(S(N)(=O)=O)cc2)c1 798324003 JYGJJWFAYGNCPF-UHFFFAOYSA-N 438.509 2.078 10 20 IECD COc1cc(N2CCN(C(=O)[C@]3(O)CCc4ccccc4C3)CC2)cc(OC)c1OC 803105439 NRVFQZJCQJIZLK-DEOSSOPVSA-N 426.513 2.281 10 20 IECD O=C(NC[C@@H]1CSCCS1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450612 MDFMRGMUTVOTNI-MRXNPFEDSA-N 445.557 2.338 10 20 IECD CC1(C)CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC[C@H]1O 806507075 HALRHRIRWZRJQQ-HXUWFJFHSA-N 442.539 2.245 10 20 IECD CS(=O)(=O)C[C@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 813662558 YPRJVFGNHIBZNO-GJZGRUSLSA-N 431.505 2.333 10 20 IECD O=C(CN1CCN(C(=O)N2CCCC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 818364083 NUDNUOVVCNYYQT-UHFFFAOYSA-N 446.507 2.234 10 20 IECD C[C@H](C(=O)NC[C@@H]1COc2ccccc2O1)N(C)Cc1ccc(N2CCOCC2)cc1 857758950 VLAMYBDNXOGIIL-WIYYLYMNSA-N 425.529 2.300 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)Cc3ccccc3)CC2)cc1 916197442 ZRNDQWABHVUBBD-OAQYLSRUSA-N 426.561 2.110 10 20 IECD O=C(c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c[nH]1)N1CCCC1 917912306 OKMAJOVGZFNMTQ-UHFFFAOYSA-N 434.587 2.282 10 20 IECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 918306240 XIVMXRCTEUULJP-IAGOWNOFSA-N 425.533 2.358 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncn3-c3ccc(F)cc3)nc12 919000580 KLNSNMOLOOCGKF-UHFFFAOYSA-N 425.376 2.293 10 20 IECD CC(=O)Nc1ccc2c(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc(=O)oc2c1 920636605 DHFWWPUAFRCAKK-UHFFFAOYSA-N 446.437 2.186 10 20 IECD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CC[C@@H](NC(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)C2)cc1 981600937 KXQCECUMYAZKIS-QOTCRHDVSA-N 425.489 2.287 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c[nH]nc1-c1ccc(OC)cc1 1320437490 YKHFUJOZCUDCMP-KRWDZBQOSA-N 425.441 2.401 10 20 IECD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1)c1cccs1 1777850948 MLFVEMFPCLSYJY-UZSYQUHHSA-N 445.541 2.486 10 20 IECD CN1CCC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1792685567 XWYJONNQONXUMF-AHAITQMDSA-N 443.544 2.187 10 20 IECD Cc1nc2ccc(F)cn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1800961942 MIDHYERBRDXMKV-MUJYYYPQSA-N 439.447 2.154 10 20 IECD O=C1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1814087592 AXFFAPSJNJOZHY-ORAYPTAESA-N 443.887 2.445 10 20 IECD Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1 1817844112 QDRKAQLSAGJUBN-QGZVFWFLSA-N 436.472 2.468 10 20 IECD Cc1nccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427953 VOPKTQVJSUJUKA-GOSISDBHSA-N 425.489 2.138 10 20 IECD O=C(c1cncc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429878 VKKHWMAJZNYDKZ-GOSISDBHSA-N 426.473 2.141 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1829011770 JUYCVZZPFAPLKY-GOSISDBHSA-N 427.505 2.000 10 20 IECD CC(C)c1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1844951365 MCJGLZMDICDVDU-UHFFFAOYSA-N 431.583 2.487 10 20 IECD CC(C)(C)OC(=O)NCC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502376 QTQHOBCDLDADPI-UHFFFAOYSA-N 439.896 2.093 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 727602867 VOOWTSAEFIURFW-QGZVFWFLSA-N 446.573 2.334 10 20 IECD COc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c1 734015721 ZHBHSFKSGSJYMA-UHFFFAOYSA-N 440.905 2.005 10 20 IECD Cc1cc(N(C)C)ccc1CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-] 734483456 PCYFUAFZPWSWCF-UHFFFAOYSA-N 435.550 2.421 10 20 IECD COCCOC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 735078069 VZUNHNHHQZWVJE-HDICACEKSA-N 437.556 2.183 10 20 IECD Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743957952 FPJCIEDZTXDBHG-UHFFFAOYSA-N 432.480 2.490 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@@H]4C[C@H]5CC[C@H]4C5)CC3)cc2)C1 748617249 JUJYYEZHLYYRTO-VVSUKSJXSA-N 439.604 2.404 10 20 IECD COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751236463 KGTYPZPPQXZUJH-UHFFFAOYSA-N 432.542 2.469 10 20 IECD C[C@@H]1OCC[C@@]1(C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 753123553 VXTLVXYTWUMLFG-KSFYIVLOSA-N 428.512 2.309 10 20 IECD CCS(=O)(=O)N1CCC(CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 754158322 DFBDBVPMTBAEBO-UHFFFAOYSA-N 440.635 2.101 10 20 IECD O=C(OCC(=O)N1CCN(c2ncc(Cl)cc2Cl)CC1)c1cccc(O)c1O 758572609 LNLJKMFOUFTSAU-UHFFFAOYSA-N 426.256 2.305 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1C 759164588 VQEAFFVMZAXJIY-UHFFFAOYSA-N 429.476 2.474 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)[C@@]12CCCO2 759323093 RUOLGIRPHVJDSK-XPNTWCBSSA-N 434.556 2.493 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(N3CCCCC3=O)CC2)c1 763225784 QCJBHCQUDBQSNY-UHFFFAOYSA-N 429.561 2.404 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3c(C)noc3C3CC3)CC2)cc(OC)c1OC 768220128 KRRGOLKSCYJQDO-UHFFFAOYSA-N 444.488 2.174 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)S(=O)(=O)C1CCOCC1 769665303 SNWLQSHZYHAWDS-ZDUSSCGKSA-N 427.478 2.383 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnn(-c5ccccc5)n4)n3)CC2)cc1 771057361 NMXONDPPPNJLOS-UHFFFAOYSA-N 445.483 2.217 10 20 IECD CCN(C)c1ccc(CN2CCN(S(=O)(=O)c3ccc4nc(O)[nH]c4c3)CC2)cc1 773731907 OVTIXNJZUPNEET-UHFFFAOYSA-N 429.546 2.231 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)NC(C)(C)C)CC2)c1 774558283 LMOHDSOSYYKFLK-UHFFFAOYSA-N 432.565 2.053 10 20 IECD CN1CCN(C(=O)NCCCSc2nccs2)[C@@H](CNC(=O)OC(C)(C)C)C1 775442407 CLPQIFZNIZWKNA-AWEZNQCLSA-N 429.612 2.476 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)Cc3c(C)noc3C)CC2)cc1 778286709 CRCKVJVRGIXCSZ-ZNFPLGDCSA-N 426.517 2.252 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccc(F)cc4)CC3)CC2)cc1 779219211 RSRVQVDSJUNNJW-HSZRJFAPSA-N 428.552 2.139 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1 784029060 XAEHLDCKVJEZBI-UHFFFAOYSA-N 439.512 2.171 10 20 IECD CC(C)N1CCN(c2cccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)CC1 785297086 LDSWDKHDHCWQTR-QGZVFWFLSA-N 440.544 2.314 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1 785298028 UHPGNSOBFUEWKO-INIZCTEOSA-N 443.569 2.375 10 20 IECD CCN(CCCN(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 786725432 UXPBUDFQZXXILN-UHFFFAOYSA-N 443.571 2.426 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H](c1ccccc1)N1CCOCC1 787977053 VMAJWXFUAXEQTE-HSZRJFAPSA-N 436.556 2.093 10 20 IECD CC[C@@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716664 DSRSZTJJLLHTMH-FCHUYYIVSA-N 448.567 2.368 10 20 IECD Cc1[nH]c(C=O)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 801409373 GAJJHHQZCSCBOL-ZIAGYGMSSA-N 431.464 2.362 10 20 IECD CO[C@@H](C)c1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 803305735 OKEZMCDFCZVQPF-GJZGRUSLSA-N 432.546 2.181 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)[C@@H]3CCCc4c3cnn4C)CC2)cc1 804316397 CWYDCUOERYADKN-HXUWFJFHSA-N 425.533 2.050 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(CCN(C)C)cc3)CC2)cc1 804317600 JDFYGDIRQZOVTA-UHFFFAOYSA-N 438.572 2.201 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC[C@@H]3N3CCOCC3)cc2)CC1 805025413 PACGTKXVRROPED-GOTSBHOMSA-N 442.604 2.299 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 806887103 XQJOKADVTJFXGE-OAHLLOKOSA-N 442.516 2.497 10 20 IECD CCc1ccnc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 807539209 YGMLMWRFCSZMAP-UHFFFAOYSA-N 435.572 2.109 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(N(C)C)cc1 807673847 AGOWAABXBJDURJ-XXBNENTESA-N 438.572 2.337 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1 809678888 SJEUNQAJPUPVJE-UHFFFAOYSA-N 426.565 2.308 10 20 IECD COCCOCc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 812476592 IERDNXFCHJANIJ-UHFFFAOYSA-N 432.542 2.014 10 20 IECD COc1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 918442437 HMNKVFHEWMQTFQ-UHFFFAOYSA-N 433.455 2.437 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4c(c(OC)c3)O[C@@H](C)C4)nc12 918919773 QMZFGLIVFNDIFQ-NSHDSACASA-N 427.413 2.301 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 1117669351 IKSANROHHIOAIJ-OAQYLSRUSA-N 427.549 2.231 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSCCN3CCOCC3)cc2F)C[C@H](C)O1 1319579576 UMMAKLRKTKDIHD-IRXDYDNUSA-N 425.570 2.121 10 20 IECD CCS(=O)(=O)c1cccc(NC(=O)C2=S=C(NC(=O)c3ccc(OC)cc3)C=C2)c1 1323773432 VCJGWCNLDZAZKH-UHFFFAOYSA-N 444.534 2.463 10 20 IECD CCO/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781122913 AZFAVAGVAIRLNI-RLPYETMNSA-N 438.908 2.429 10 20 IECD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccn1 1782008326 ZSINLZATJIWMMA-FPTDNZKUSA-N 445.903 2.393 10 20 IECD CC(=O)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1794901808 WIPPETDOBDSLLQ-CLLJXQQHSA-N 432.864 2.243 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cncn2C)C3)cc1 1799620438 NBURGEMMKZZIRJ-JHDGKUDLSA-N 447.539 2.345 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(F)n1)CC2)c1cc(O)nc(O)c1 1816726467 WRLHEHYFPSKQNL-SNVBAGLBSA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCC(CO)CC2)[nH]n1)c1cc(O)nc(O)c1 1817843671 WJMPFSGOEGZKSA-KVULBXGLSA-N 443.504 2.321 10 20 IECD CC(=O)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294827 SKEAZVCSHJEQSQ-OAHLLOKOSA-N 449.895 2.306 10 20 IECD CC(C)n1nccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844488020 PTQAQWGKLJDFQD-UHFFFAOYSA-N 434.500 2.074 10 20 IECD O=C(c1ccc(F)nc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034227 AEFPAVWDBVESFM-XVNBXDOJSA-N 431.395 2.007 10 20 IECD O=c1n(-c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)c(O)c(O)n1C1CC1 59000146 RBYPEUCAUSTQCV-UHFFFAOYSA-N 445.482 2.191 10 20 IECD CCc1c(-c2ccncc2)n[nH]c1NC(=O)C1=S=c2nc3n(c(=O)c2=C1C)CCCCC3 590475545 NIJROLIGCCOSMY-UHFFFAOYSA-N 448.552 2.297 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@H](C(F)(F)F)NC3=O)cc2F)CC1 730235623 IYEGEOFHFMVCKW-WMLDXEAASA-N 430.446 2.041 10 20 IECD COc1ccc(O)c(CNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1 735582079 VTPNYLLLIXOJEN-UHFFFAOYSA-N 433.530 2.194 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(N2CCCC2=O)c1 738887624 JUUPGAQIFSTWNA-UHFFFAOYSA-N 442.541 2.370 10 20 IECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742799358 JRLLXORVRDVXSY-ZDUSSCGKSA-N 442.488 2.265 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N(CC)[C@@H]1CCS(=O)(=O)C1 743870901 GKWLZYZBMVCWFD-XJKSGUPXSA-N 447.395 2.401 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743974709 FRINTBCMOSETSM-HNNXBMFYSA-N 446.454 2.419 10 20 IECD COc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(OC)c1 746232870 HQHFVYKGEVVQAU-LJQANCHMSA-N 440.544 2.447 10 20 IECD CN(C)C(=O)Cn1cnc(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 747545089 SPRYIAFVFLTEGS-UHFFFAOYSA-N 425.493 2.260 10 20 IECD COCCOCC(=O)NC1CCC(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 748715595 VFNFNBDYBSCTPL-UHFFFAOYSA-N 449.617 2.194 10 20 IECD COc1cc(OC)c(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)c1 753858582 XDFAHLHRJMVRJF-UHFFFAOYSA-N 447.507 2.299 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccc(F)c4)nn3)cc2)C1 759157637 OZKJAFQJYHQMDZ-GOSISDBHSA-N 436.491 2.097 10 20 IECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)c1 760841594 YFSONYWKLBUDRM-GOSISDBHSA-N 440.479 2.435 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4ccc5c(c4)CCO5)C3=O)cc2)C1 761123855 PLNZTVAKVNDBPU-GHTZIAJQSA-N 434.496 2.116 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1F 764259621 KFDZNPMMRSDLKV-UHFFFAOYSA-N 433.505 2.257 10 20 IECD CNc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1[N+](=O)[O-] 765513190 AEOSKIDYJJBUOK-UHFFFAOYSA-N 446.435 2.085 10 20 IECD NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1c(O)ccc2c1CCCC2 769562490 CUILSNXWUICYNI-IBGZPJMESA-N 425.485 2.058 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3ccc(F)cc3)CC2)cc1 770103594 PGAXZWVGGIMETD-QFIPXVFZSA-N 430.524 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3CCCCCC3)CC2)cc1 778221435 MPCGFXKYKVBUHE-QXMHVHEDSA-N 428.577 2.282 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc(OC)cc3OC)CC2)cc1 779217368 FYJJUODAYSZRQM-OAQYLSRUSA-N 429.561 2.327 10 20 IECD COc1ccc(C[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 781299211 XDCDHAUUYFNLAJ-KRWDZBQOSA-N 446.569 2.434 10 20 IECD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)n1 781979135 JOXZBOTVBIMMGT-UHFFFAOYSA-N 449.559 2.495 10 20 IECD Cc1ccnn1-c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 784637313 DRKCVBBMUYFTPI-UHFFFAOYSA-N 437.475 2.411 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1 785296254 MXNOMAXMAIXTHL-UIHBWLLHSA-N 430.404 2.411 10 20 IECD COC(=O)c1nc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)cc2)sc1C 785444639 SNVGVGQGRZCSLU-MRXNPFEDSA-N 430.530 2.284 10 20 IECD COc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)cc1 789798329 FQQSJOMSHJDJAE-UHFFFAOYSA-N 441.503 2.478 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789867515 HAYNWELDYJICAW-FQEVSTJZSA-N 427.570 2.230 10 20 IECD CN1CCN(c2ccc(CNc3cccc(S(=O)(=O)N4CCOCC4)c3)cc2)CC1 796384645 PDPGUPFZZYVTFY-UHFFFAOYSA-N 430.574 2.071 10 20 IECD CS(=O)(=O)N1CCc2c(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cccc21 804254534 LTXPHEUECNXTSV-UHFFFAOYSA-N 435.889 2.337 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cc(Cl)cn3C)cc2F)CC1 805008776 BPELSRKMROTNMQ-UHFFFAOYSA-N 449.958 2.234 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(F)c(N4CCOCC4)cc3F)ccc21 806878911 OXJMXNADUSSLCJ-UHFFFAOYSA-N 444.482 2.439 10 20 IECD CC(C)(CCCO)CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807505429 LBBZECQVOFNSNJ-OAHLLOKOSA-N 427.492 2.288 10 20 IECD COCCCN(CCO)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807954875 HAIXJXCKSHTMLN-MRXNPFEDSA-N 425.957 2.050 10 20 IECD CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 808035407 WBQIHYYAFKYQAA-IBGZPJMESA-N 447.919 2.268 10 20 IECD CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)[C@H]2C1 808357529 JNUFNTHOLYAOEK-CUWPLCDZSA-N 432.540 2.233 10 20 IECD Cc1ncsc1CN(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854693 HYAVVZKRAVRCLC-UHFFFAOYSA-N 441.601 2.258 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCS(=O)(=O)c3ccc(F)cc3)cc2)C1 917832325 SUNCAJNVIDRKDD-QGZVFWFLSA-N 447.532 2.008 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@@H](CC)N=c3nn[nH]n3-c3ccccc3)CC2)cc1 1319624733 WQDVIKUGHDESRF-OAQYLSRUSA-N 435.532 2.022 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1C[C@@H]1C1CC1 1783946165 YFXHLQKXLULPAC-NRLVLPFVSA-N 434.920 2.391 10 20 IECD CC(C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992896 DIGIRXDNDWAPRB-YWZLYKJASA-N 428.489 2.023 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362579 ZYHZAQNNVICLLS-UBHSHLNASA-N 441.488 2.206 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cn2cnc3ccccc32)C1 1846289814 GLPIXPBRCLLNSU-VQHVLOKHSA-N 448.479 2.070 10 20 IECD CCN1C(=O)c2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2S1(=O)=O 735520392 ZOPHMMFQWZTXKC-KRWDZBQOSA-N 444.509 2.378 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(N4CCOC4=O)ccc3F)cc2)C1 741544520 RYWINFSRZJONRW-MRXNPFEDSA-N 440.475 2.414 10 20 IECD C[C@@H](c1cccnc1)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 741789340 ZOORJBHXSGLTCL-IBGZPJMESA-N 441.551 2.052 10 20 IECD Cc1ccc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n2)s1 743248614 KGKBZJZFJDEVEW-UHFFFAOYSA-N 435.512 2.328 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(OC)nc3OC)CC2)cc1 743311020 XMUHATSAUJOMFP-UHFFFAOYSA-N 429.521 2.441 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 752095766 FPAULFBPSKIPFJ-UHFFFAOYSA-N 425.485 2.134 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)(C)[C@@H]3[C@@H]3CCCO3)CC2)cc1 752974231 BZHDNTZAZKFQPG-SJPJZVFQSA-N 427.545 2.316 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 753644888 PCJKGWVLCABOTB-HNNXBMFYSA-N 448.541 2.255 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2CN2CCNC2=O)cc1F 755238525 ADTTUHQGOHJKPH-UHFFFAOYSA-N 441.507 2.452 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2cnc3c(c2)nnn3C)NC(=O)OC(C)(C)C)cc1 755421705 HNFYKXBOMVACQH-SFHVURJKSA-N 439.520 2.425 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(C)c3F)CC2)cc(OC)c1OC 759410696 SYJDBDTWUNILLZ-UHFFFAOYSA-N 431.464 2.447 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(CC(F)(F)F)[C@H](C)C3)CC2)cc1 762563187 ZOXUXQXLGCLLDY-QGZVFWFLSA-N 443.514 2.095 10 20 IECD C[C@H](CO)N(C)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 765216271 GJTCEXGTRSXSSC-SRMXYGTFSA-N 429.361 2.490 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 767788035 OYCPLTCCUMKFCA-UHFFFAOYSA-N 449.504 2.193 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C 770254538 KJKVHBGUJXHEMZ-UHFFFAOYSA-N 425.533 2.280 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc([S@](C)=O)c(F)c3)CC2)cc1 774152764 JVAORJJWHVYOHA-PMERELPUSA-N 433.505 2.249 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 774561061 LRAVOSYQRSYYQE-IYBDPMFKSA-N 429.492 2.381 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 778235373 PZQYIZSJYHKFMR-DENIHFKCSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(CC(F)(F)F)c3)CC2)cc1 778284748 BTDJUILLTOABQV-SREVYHEPSA-N 437.422 2.298 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 779589475 HDFRTBUDSMMXQL-XSFOEPMVSA-N 428.510 2.495 10 20 IECD CN1CCN(c2ccc(CNc3cccc(S(=O)(=O)N4CCC(O)CC4)c3)cc2)CC1 785555947 RPLRRDBGQULVHT-UHFFFAOYSA-N 444.601 2.196 10 20 IECD CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786657256 WEGWKSARXBAHHW-HXUWFJFHSA-N 432.590 2.063 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1c(F)cccc1OC(F)F 788311760 ZFTADJJADLVICU-UHFFFAOYSA-N 437.418 2.196 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 789823023 XUGFMLJFLXBBCJ-IRXDYDNUSA-N 428.508 2.118 10 20 IECD C[C@]1(O)CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 792588844 RDELQIZWWSTWST-FQEVSTJZSA-N 449.485 2.478 10 20 IECD CNS(=O)(=O)c1ccccc1S(=O)(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 799764064 TXTJFWPBRPHDGM-UHFFFAOYSA-N 425.576 2.260 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 804008568 MNUAZIJJPAMNIJ-JOCHJYFZSA-N 436.556 2.409 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccsc3)CC2)cc(OC)c1OC 804078465 JHVQKHIOOGCZRV-AWEZNQCLSA-N 433.530 2.300 10 20 IECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)NCc1ccc(N2CCOCC2)cc1 806637739 RXDBVWRGXIDSCJ-UHFFFAOYSA-N 433.530 2.398 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 806930303 POMQGAJKNPTRLV-UHFFFAOYSA-N 442.513 2.495 10 20 IECD COC1(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCOCC1 807060555 XTUBFFBVOOLUKR-UHFFFAOYSA-N 429.517 2.186 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]12 807768441 JRAKZYDLDMPDHN-ZWQIFLOQSA-N 437.487 2.447 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C3=O)[C@H](C)CCC[C@H]4C)CC2)cc1 884905206 JUKJKDZUENAAJJ-IAGOWNOFSA-N 428.533 2.091 10 20 IECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 916277154 ZYIRLWPAZUXVPC-UHFFFAOYSA-N 448.614 2.326 10 20 IECD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(O)n1 917834327 IRCAQLXBPMRWDG-MRXNPFEDSA-N 443.573 2.163 10 20 IECD O=C(Cn1cc(Br)ccc1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969292 SYLWYKMXLSVGCW-UHFFFAOYSA-N 434.334 2.136 10 20 IECD COCCN1C(=O)/C(=C\Nc2ccc(-c3cn4ccsc4n3)cc2)C(=O)NC1=S 920978644 NKDIWRKXBZEUNV-UVTDQMKNSA-N 427.511 2.248 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1255563631 AQHLKYVLKVZLBT-AWEZNQCLSA-N 449.485 2.258 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CC(C)(C)CN(C)C)C2=O)cc1OCC(N)=O 1321450827 AJELGLYEYQVBIB-SXGWCWSVSA-N 437.587 2.348 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1778469920 MSGVQRVOYFOOPU-JOCHJYFZSA-N 443.525 2.190 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cscn1 1786089339 HYQCSCGIZULOBD-PKWAYOAASA-N 437.905 2.115 10 20 IECD CCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)CCC1 1788231085 ALRZXODGVRZGDZ-ONQJJZRUSA-N 444.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Cl)ccc2c1OCO2)c1cc(O)nc(O)c1 1797455078 YNBKEUUEKSIRJX-CLLJXQQHSA-N 445.859 2.441 10 20 IECD COc1nn(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715622 JCCYWIRRFBSUOY-CLLJXQQHSA-N 434.880 2.059 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(F)cc1F 1804335952 NMZRRLYVIOYJDL-CLLJXQQHSA-N 439.509 2.077 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)Cc3ccccc3)C2)CC1 1809212642 YUMIQFYEHHWUJB-UHFFFAOYSA-N 445.610 2.321 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1 1814162236 HOZPJANXSYCKOC-PRIUCCMZSA-N 433.411 2.183 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3nccc23)[nH]n1)c1cc(O)nc(O)c1 1817847352 WTTAAUATJOHNLA-QGZVFWFLSA-N 447.455 2.483 10 20 IECD COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1824738815 PKCTXRCXKTXMRH-GOSISDBHSA-N 440.500 2.444 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726602625 YVJBTBJDTCGKCX-UHFFFAOYSA-N 434.514 2.194 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1OC 727356246 CJNQTAJCFWQZRZ-UHFFFAOYSA-N 446.478 2.183 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)ccc3F)cc2F)C[C@@H](C)O1 733369984 YFPJOPNCZGGTFD-CHWSQXEVSA-N 439.484 2.156 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1 744382800 PUEDQDHEAKNOQK-UHFFFAOYSA-N 431.436 2.246 10 20 IECD O=C(NCCNS(=O)(=O)c1cccs1)NCc1ccc(N2CCSCC2)cc1 746714948 QORAJJZAGMOTGU-UHFFFAOYSA-N 440.616 2.079 10 20 IECD CN(C)c1ccc(CNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)cc1F 746804994 CPGBAMNQZMMWMR-UHFFFAOYSA-N 444.532 2.369 10 20 IECD COc1cc(NC(=O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1 752005912 YBEKHNKFONVFCS-UHFFFAOYSA-N 446.479 2.117 10 20 IECD CCCNC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754214525 MOIWTXVAUCASOS-UHFFFAOYSA-N 442.491 2.261 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)CN3CCN([C@@H]4CCS(=O)(=O)C4)CC3)c2C)c1 754641226 AVJQZQLYBQOSAS-OAQYLSRUSA-N 429.586 2.390 10 20 IECD COc1cc(N2CCN(Cn3nc(-c4cccs4)oc3=O)CC2)cc(OC)c1OC 758965645 SODNTWLSAKLXNJ-UHFFFAOYSA-N 432.502 2.370 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 770278117 JABDJPQIVWSNDC-UHFFFAOYSA-N 436.505 2.300 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 775710006 VLIJBCGOWIOYNM-IBGZPJMESA-N 439.541 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H]3CN3CCCCC3)CC2)cc1 778257420 SAMWBEOKDJPWBP-GJCOWUBNSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@H]4CCC[C@H]43)CC2)cc1 785529110 LNKNNEKJNMGMJR-DENIHFKCSA-N 428.577 2.115 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@H]4C3)CC2)cc1 785610498 XSFATDZVXSETOZ-PCCBWWKXSA-N 442.604 2.409 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cnn(-c4ccccc4)c3)CC2)cc1 785972457 RICBPGKFXNMTGU-UHFFFAOYSA-N 433.512 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc([C@@H]4CCCOC4)[nH]n3)CC2)cc1 792537449 FJSNBUPYNQWBKD-XZVRFQMRSA-N 439.516 2.156 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccccc3)cc2)C1 793718933 KQMZFQHGQKKHBL-UNMCSNQZSA-N 434.540 2.368 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](c4ccccc4)C3)cc2)C1 793734202 RIVANFZODIPDDO-LEWJYISDSA-N 434.540 2.021 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)NC)c(C)c2)cc1 795074021 OYHWAQMYJRXACN-UHFFFAOYSA-N 425.576 2.228 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]4[C@@H](CCN4C(=O)OC(C)(C)C)C3)nc12 795104011 QYOYENFDLNNQFZ-WMLDXEAASA-N 445.520 2.443 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(OC)c(C)c1OC 796722740 MDFWVABYDWKLQA-UHFFFAOYSA-N 443.500 2.112 10 20 IECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306729 WXZJCHZFYADTPQ-UGKGYDQZSA-N 430.593 2.471 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1F 803662090 RCCJIEMPBSNHLC-OAHLLOKOSA-N 436.528 2.271 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](CC4CCC4)NC(C)=O)n3)CC2)cc1 809464420 FWISXTMCKRFEFX-HXUWFJFHSA-N 441.532 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C4CCN(C5CC5)CC4)n3)CC2)cc1 809465016 OYGIGNMXNAWJDS-UHFFFAOYSA-N 425.533 2.311 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)c1 810161820 UNFTVOIFYIFUIU-UHFFFAOYSA-N 447.582 2.037 10 20 IECD Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 917443552 FAUDBTVOUPEOSN-UHFFFAOYSA-N 445.478 2.238 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1OC 917758285 NOYNGCXNGGSXGN-UHFFFAOYSA-N 445.475 2.174 10 20 IECD C[C@@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(N2CCOCC2)cc1 920872513 SXILZSNLQXKPAQ-QGZVFWFLSA-N 440.504 2.419 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)N3CCC[C@H](C)C3)cc2F)CC1 1122007797 QKDZUMHXLJYZST-SFHVURJKSA-N 433.572 2.415 10 20 IECD O=C(Cn1nc2n(c1=O)CCCCC2)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1319206312 GOBZEULNUXDAIN-OAHLLOKOSA-N 435.475 2.158 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1c(F)cc(F)c(F)c1F 1323346917 DVLJAPYOKAGYIL-UHFFFAOYSA-N 439.409 2.354 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)C(=O)C1CC1 1803060651 GJLLJEXPHLSLKB-KDOFPFPSSA-N 443.887 2.445 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cccnn3c2)[nH]n1)c1cc(O)nc(O)c1 1817847148 MNIOOGJYOQKPJY-KRWDZBQOSA-N 447.455 2.483 10 20 IECD COc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1825670750 CEEBRZUZQRZVIA-SFHVURJKSA-N 440.500 2.444 10 20 IECD Cc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837429197 GZOPBBRYTKHHFX-UHFFFAOYSA-N 440.500 2.122 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2c(F)ccc(O)c2F)C1 1845471829 LXCWZBJNEXRWOA-XVNBXDOJSA-N 446.406 2.318 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 508120164 OSEHVYBESOSBCT-INIZCTEOSA-N 441.553 2.390 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2cc(F)ccc2N2CCOCC2)n(C)c2ccccc12 508709989 KOTCRQWALJDNPG-UHFFFAOYSA-N 438.503 2.395 10 20 IECD CCN(CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 726709555 UHEDIRJWEGPDKO-UHFFFAOYSA-N 443.571 2.472 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(OC)ccc3Cl)CC2)cc1 732923295 UMESPMIUHKGUNG-UHFFFAOYSA-N 439.965 2.458 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N 744576172 OFSDZWPYALVVJA-UHFFFAOYSA-N 431.474 2.201 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 756337339 UHRJHOLKBAXJOG-FCHUYYIVSA-N 438.524 2.500 10 20 IECD COCCN(C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 757321823 FBLLKWGKKFTCKZ-UHFFFAOYSA-N 444.351 2.409 10 20 IECD COc1cc(N2CCN([C@H]3CC(=O)N(c4ccccc4)C3=O)CC2)cc(OC)c1OC 758820197 NCQXMZYPAAJATC-SFHVURJKSA-N 425.485 2.167 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(C(N)=O)c(F)c3)CC2)cc(OC)c1OC 759969517 LHTVVQMZQTWXKW-UHFFFAOYSA-N 432.452 2.305 10 20 IECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NCc2cccc(Br)c2O)nn1 765929213 BLNKRXQQCYVNJN-UHFFFAOYSA-N 445.277 2.002 10 20 IECD CN1CCC2(CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)CC2)C1=O 772933555 HDTBJSUHIFOOHT-UHFFFAOYSA-N 449.554 2.339 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 773922765 MWYHQPBFDJOYGJ-ZJSXRUAMSA-N 433.593 2.089 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 787196925 IIJBQVSRIFETAU-FGTMMUONSA-N 439.560 2.255 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cs1 788913239 WAPXNLSKYBKJMO-UHFFFAOYSA-N 441.601 2.266 10 20 IECD COc1cc(O)c(CNC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)cc1OC 789774064 KXCDYYDNEJLJDO-GOSISDBHSA-N 432.492 2.356 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822937 BRHJPUNGUFSREK-IRXDYDNUSA-N 445.539 2.157 10 20 IECD C[C@@H](OC(=O)[C@@H]1CCCN(C(N)=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792273180 QBUUXPSQDKETPW-ZIAGYGMSSA-N 449.463 2.123 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1nc(C)cs1 793721175 QHVVADPRBDQGBZ-FUHWJXTLSA-N 443.573 2.037 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN3CCc4sccc4C3)CC2)cc1 793861398 HUCDYXDGGYXPPS-UHFFFAOYSA-N 442.585 2.016 10 20 IECD CCCN(CCS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C)Cc1ccccc1O 799304326 VCUJPRCNTMEBKG-UHFFFAOYSA-N 440.587 2.328 10 20 IECD CNS(=O)(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 799995483 LQYNGRJCGYBWEV-GDBMZVCRSA-N 428.986 2.409 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 800456977 FLJWDPUSMUAKCX-OAHLLOKOSA-N 440.521 2.300 10 20 IECD C[C@@H]1CN(Cc2cccc(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2)CCO1 803132139 WJTLDFVZSJGYNZ-RTBURBONSA-N 438.572 2.467 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCOc2ccc(F)cc21)c1ccc(N2CCOCC2)cc1 803300253 RICFDCKRTNFSKV-YWZLYKJASA-N 427.476 2.480 10 20 IECD C[C@@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803689697 XCRHLASVWIMWGL-INIZCTEOSA-N 427.574 2.047 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3nc4cc(C)ccc4n3C)CC2)cc1 804315899 UXMVDYHGNMVLLT-UHFFFAOYSA-N 435.528 2.292 10 20 IECD COC(=O)Nc1cccc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 805014043 NYFWHUHXHWMLOE-UHFFFAOYSA-N 441.532 2.495 10 20 IECD CCOC(=O)C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)=O 805540348 PBUVXCYXUOQMKD-HNNXBMFYSA-N 441.483 2.322 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](N3CCCC3)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 805768420 IWJOREDMLGKIOG-PGRDOPGGSA-N 444.601 2.483 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 807100385 LZCOMECVVRHAEY-LJQANCHMSA-N 428.920 2.252 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)CS(C)(=O)=O)cc2Cl)C1 807952538 NKQIQGHEIIVUGL-HUUCEWRRSA-N 443.997 2.084 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(CO)C[C@@H]3c3ccccc3)CC2)cc1 812016711 NWNWOCCIUQPMMO-NOZRDPDXSA-N 438.572 2.283 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCCc4c3cnn4C)CC2)cc1 916197174 WPMCBCCNGJSAHC-NRFANRHFSA-N 426.565 2.318 10 20 IECD COc1c(C)cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 917929302 CONQVKQOHWTZDR-SFHVURJKSA-N 431.558 2.492 10 20 IECD CN(C)c1ccc(CNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 918000154 ROXXDVKWJZISBE-UHFFFAOYSA-N 439.560 2.413 10 20 IECD COc1ccc(OC(F)F)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920195624 WXPCTWJTDJWWQR-UHFFFAOYSA-N 435.427 2.388 10 20 IECD CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1319929071 TWLJMJSAURQSQW-SFHVURJKSA-N 426.521 2.294 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3(C(=O)O)Cc4ccccc4C3)cc2F)CC1 1334950044 ZEHBGSHTVRBEQE-UHFFFAOYSA-N 440.519 2.389 10 20 IECD COc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795086575 DILULQPUNLZSNB-VBUUOAMHSA-N 447.495 2.135 10 20 IECD O=C(CCc1ccoc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801486461 PXJYLHNXVFXJAP-CCWDJLKJSA-N 434.876 2.180 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806258919 PVRDJTVJIVDRIG-UHFFFAOYSA-N 427.505 2.002 10 20 IECD NC[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)c1ccccc1 1810543829 OMGIAWWBQIVNBD-IBGZPJMESA-N 438.528 2.080 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ncon2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806338 KNDJVKHRMLNKFM-MLGOLLRUSA-N 443.847 2.163 10 20 IECD O=C(CC1CCC1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814122985 FHBROOPUIWMFSM-OXQOHEQNSA-N 446.598 2.138 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817843544 QUXCOOABYSMZFS-HOCLYGCPSA-N 429.477 2.481 10 20 IECD O=C(CCc1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424165 RLAXDGMFYNFKBY-SFHVURJKSA-N 427.505 2.082 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428350 OWSCPNZORAUHAA-KRWDZBQOSA-N 427.505 2.380 10 20 IECD Cn1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)n1 1830735582 QWVWHMIIRKMQFA-MRXNPFEDSA-N 447.923 2.427 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccn(C(F)F)n2)C1 1844494028 HCTKOULNYGOMGM-UHFFFAOYSA-N 426.807 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@@]4(CCCC[C@H]4C)C3=O)CC2)cc1 108432224 OLZOLMUZWSQFEY-UZUQRXQVSA-N 428.533 2.235 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](NS(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 110179674 HOHZBCLNONIAJM-QGZVFWFLSA-N 447.557 2.062 10 20 IECD CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 116113122 VXVKRFZQZNMVBA-SFHVURJKSA-N 429.542 2.112 10 20 IECD CC[C@@H](OC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(N)=O 726996199 FWXHROYWOSKWDZ-LAPSENCUSA-N 443.344 2.457 10 20 IECD CC(C)n1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1N(C)C 728788467 HUMAHBDRJTXPRF-UHFFFAOYSA-N 436.557 2.309 10 20 IECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 729524294 XUGCBRIYRUGFSH-NRFANRHFSA-N 435.532 2.022 10 20 IECD COC(=O)c1ccc2c(c1)CN(C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 730121644 WHSVMDQMNNMDHN-LJQANCHMSA-N 436.512 2.400 10 20 IECD COC(=O)c1ccc(CCC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 731748785 PUBDVUCWSYCNSX-UHFFFAOYSA-N 440.496 2.306 10 20 IECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3cc(C)cc(OC)c3O)CC2)c1 732475913 OVJZWZRAMDXAGI-UHFFFAOYSA-N 436.530 2.233 10 20 IECD Cn1c(=O)nc(O)c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 742801721 SEQYOXMLOWHSOL-CYBMUJFWSA-N 445.426 2.034 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC[C@]2(CCOC2)C1 757423528 DYNYHTPTPSZUPA-FQEVSTJZSA-N 447.469 2.354 10 20 IECD Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1S(C)(=O)=O 758965217 JFTPADRIEPBFPW-GOSISDBHSA-N 446.525 2.250 10 20 IECD C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)S(=O)(=O)C1CCOCC1 765344562 PSGDPKYQSJYOPR-XLIONFOSSA-N 438.590 2.243 10 20 IECD C[C@]1(O)CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 767154568 GQBYMSFHELJWPX-IBGZPJMESA-N 435.458 2.088 10 20 IECD O=C(CCCCc1cnn[nH]1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 768710378 SURBHJQZBHGZRM-UHFFFAOYSA-N 438.511 2.090 10 20 IECD CS(=O)(=O)[C@H]1CCCC[C@H]1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775376362 QKRLOWABKLMYBC-CTNGQTDRSA-N 447.580 2.388 10 20 IECD CCOC(=O)C[C@@](C)(NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 776003671 XYGDZBGZFYJTGC-UWHSVAFCSA-N 445.560 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CC[C@@H]3CCCCN3C)CC2)cc1 778287687 CNIGKYRYSXFIDC-DUQGCJEPSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCN(CC(C)C)C3)CC2)cc1 778390360 ARKKKNVGGOYSSN-RQWLHQTBSA-N 442.604 2.384 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(O)(C(F)F)CC1 779305745 PNTVPKNYCZXJKX-UHFFFAOYSA-N 432.470 2.487 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc4c(cc3Cl)NC(=O)C4)c2)CC1 780406902 AHBRNIKFYQTGNS-UHFFFAOYSA-N 448.932 2.304 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(CCO)C(C)(C)C1 781960412 ICMTUJLZFBPHQY-MRXNPFEDSA-N 435.524 2.178 10 20 IECD C[C@@H](OC(=O)C(C)(C)S(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785983906 KJSKLTPQDRVCAH-GFCCVEGCSA-N 443.477 2.155 10 20 IECD COCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C)o1 789811391 GHVZVNOPJYNYQZ-GOSISDBHSA-N 433.480 2.074 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCN(c2nccs2)CC1 789854455 ANBOJQGWBUDDAD-UHFFFAOYSA-N 445.614 2.051 10 20 IECD CO[C@@H]1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949545 JQWDDMRKECUZAL-CRAIPNDOSA-N 443.466 2.090 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCCO1 789953890 GMWHTWFRCVXRGM-ZWKOTPCHSA-N 443.466 2.232 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790551501 LQZSKLDTQPJRTM-ZWKOTPCHSA-N 440.548 2.338 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N2CCOCC2)cc1 793738296 SWUKIQRXESHADB-DEOSSOPVSA-N 448.567 2.177 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCCN2CCc3sccc3C2)C2CC2)cc1 793863345 VHPSNKIIEFSAKU-UHFFFAOYSA-N 426.586 2.480 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)Oc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 803306472 RASQQIIDNVPWTQ-SJORKVTESA-N 429.492 2.423 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803450661 NTMRSSFUGIWOJA-KRWDZBQOSA-N 425.476 2.401 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCC2(N3CCOCC3)CC2)cc1)C1CCCCC1 803677157 HEHSRNHWPJKXDX-UHFFFAOYSA-N 428.577 2.053 10 20 IECD CCCCNC(=O)OC[C@H]1CCCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 804233252 YADSSAKHOMCQHY-OAHLLOKOSA-N 427.523 2.285 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@]3(C)Cc4ccccc4C(=O)O3)CC2)cc1 843443864 YTUVKEVPHHTPFX-VWLOTQADSA-N 437.540 2.495 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1 918310581 PKEPWAKWWYDMOZ-UHFFFAOYSA-N 446.573 2.380 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1 1319698965 URUNJHZUJXYMCV-UHFFFAOYSA-N 442.534 2.139 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cccc(F)c1 1780352948 IVHXWFMFNBNAAL-VGOFRKELSA-N 429.448 2.073 10 20 IECD CC(C)c1nc(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)no1 1806926873 CLIVXGORSPEVAK-UHFFFAOYSA-N 443.504 2.087 10 20 IECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cc(O)n1 1827427277 KBRPRWSTEXFAJO-SFHVURJKSA-N 440.500 2.449 10 20 IECD COc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccc1F 1846799896 XIXIHTSKEVKOHU-VMPITWQZSA-N 442.443 2.482 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)nc1 1848205140 GNZKEUDUYSWWQI-VXKWHMMOSA-N 445.523 2.317 10 20 IECD O=C(CN1C(=O)NC2(CCCC2)C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566090 OWGZHLSQULDQEF-UHFFFAOYSA-N 436.459 2.238 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 729049023 BGIROJDERWUQDQ-FQEVSTJZSA-N 437.544 2.389 10 20 IECD CNC(=O)C1(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCC1 730047068 YIZUGIOVMKFZNU-CYBMUJFWSA-N 434.448 2.249 10 20 IECD COCCOC1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 735183207 RUFUHWZQJIWVRU-UHFFFAOYSA-N 434.581 2.044 10 20 IECD Cc1cc(C(=O)CN2CCN(CC[S@@](C)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 746468547 OWECSONQVSWVJM-WJOKGBTCSA-N 445.585 2.044 10 20 IECD CCN1CCO[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1 748462896 ZLXHTNFCTUAENC-NRFANRHFSA-N 428.485 2.327 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c(C(=O)OC)s1 751318199 LBDBLGYEIVAHNN-SECBINFHSA-N 429.472 2.075 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](C)Oc4ccc(OC)cc43)CC2)cc1 754047139 BGPZINQMCZGIMI-UYAOXDASSA-N 427.545 2.474 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc4[nH]ccc4c3)CC2)cc(OC)c1OC 759408383 AEWGWKXHJRBDHO-UHFFFAOYSA-N 438.484 2.481 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCCN1C(=O)NC2(CCCCC2)C1=O 760990120 XBQFEXAONGNMQF-UHFFFAOYSA-N 448.907 2.455 10 20 IECD CNC(=O)Cn1nc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C 767965104 HRKOGFWKUQQBDU-GJZGRUSLSA-N 432.500 2.012 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C(F)F)c3)cc2F)C[C@H](C)O1 767999357 OOSXXKBUSDDLCZ-RYUDHWBXSA-N 425.411 2.286 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4ccccc4[C@H]3CO)CC2)cc1 773511370 VMKHYQDKHILKEW-BREAQWACSA-N 435.524 2.018 10 20 IECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)c1 775079076 HQJRVOUAPDZCSX-JOCHJYFZSA-N 442.535 2.470 10 20 IECD CCN(CC)c1ccc(CNC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1 776061498 JTDQCPHYYCAOMT-UHFFFAOYSA-N 447.561 2.270 10 20 IECD COc1cccc2[nH]cc(CC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c12 778626216 GCJJXLPMIDQZNU-UHFFFAOYSA-N 427.526 2.270 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)Nc3ccc(C)cc3)CC2)cc1 779220193 SBCNOWHPGZZMJX-JOCHJYFZSA-N 426.561 2.057 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cc(N4CCOCC4)ccn3)cc2F)CC1 784397684 LIPMMTXYCOGYFD-UHFFFAOYSA-N 427.524 2.129 10 20 IECD Cc1ccc(Cn2cccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2=O)cc1 785297384 NVUNMWAMHTYUEB-INIZCTEOSA-N 435.480 2.302 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@H](SC)C3)CC2)cc1 785527032 IVHWEXYMPYIWOB-NQIIRXRSSA-N 448.633 2.114 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)c3cccc(Cl)c3)cc2)CC1 786258379 DGIFARSQOGMORG-UHFFFAOYSA-N 428.920 2.055 10 20 IECD CCn1ccnc1[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788333298 RJKDPZAXEQZTCQ-FQEVSTJZSA-N 425.533 2.110 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(CN(C)C)CCCC3)cc2F)C[C@@H](C)O1 789817788 IPYWAFFVAVCBPR-HDICACEKSA-N 448.583 2.294 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](OC(F)F)C3)cc2F)C[C@@H](C)O1 789824609 JVHFTQHYOLLHTM-IJEWVQPXSA-N 443.466 2.286 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 790906268 WGVYMRYBPHPKAH-NVXWUHKLSA-N 447.532 2.466 10 20 IECD Cc1oc2ccccc2c1CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793731465 DULPXLDXNAKUAS-SFHVURJKSA-N 448.523 2.376 10 20 IECD COc1ccc(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(O)c1 794371123 WTQABTOVWFTZOY-FQEVSTJZSA-N 446.525 2.463 10 20 IECD CN1CCCN(S(=O)(=O)c2cccc(NCc3ccc(N4CCOCC4)cc3)c2)CC1 796426546 CJOIGUXMGNPGHM-UHFFFAOYSA-N 444.601 2.462 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1 799180675 FSPPBRMAFIJNLC-JZKQVHKSSA-N 433.464 2.219 10 20 IECD COc1cccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)c1 803661578 GUIYDYUTSBJOJQ-QGZVFWFLSA-N 428.508 2.302 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(Cc4cscn4)CC3)cc2)CC1 805023617 XZBZJEPSQYOZBA-UHFFFAOYSA-N 441.601 2.340 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 806934806 JSHWXFSXBVOUFE-UHFFFAOYSA-N 442.491 2.214 10 20 IECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C[C@@H](C)O1 807954407 QYVUZNNYYSQIQJ-JZXOWHBKSA-N 437.968 2.455 10 20 IECD O=C(CN[C@H](C1CC1)[C@]1(CO)CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 815289691 JEHXCPYQPLVZJS-JWQCQUIFSA-N 434.492 2.310 10 20 IECD C[C@H](OC(=O)CN1CCCCC1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 915455250 MWHLIPVVPHUXIU-AWEZNQCLSA-N 434.448 2.345 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)c3nnc4ccccn34)CC2)cc1 916196463 HVFQOPVFTGRYBJ-SFHVURJKSA-N 437.548 2.310 10 20 IECD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2=O 919969942 JTARIWUAFWXPHL-OSPHWJPCSA-N 442.560 2.012 10 20 IECD Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)c1 1780672834 LZYRKIYBSBSFBS-RUZDIDTESA-N 446.507 2.231 10 20 IECD O=C(NC1(c2ccc(NC(=O)c3nc[nH]n3)cc2)CCC1)C1=NN(c2ccccc2)C(=O)C1 1788370539 ANLHTGWXJJJOHE-UHFFFAOYSA-N 443.467 2.345 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(F)c(F)c1 1804336104 WCFLXHLYXOSSRB-CLLJXQQHSA-N 439.509 2.077 10 20 IECD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cs1 1807990194 GFRLYKDFWRWNIP-KUHUBIRLSA-N 439.497 2.286 10 20 IECD Cc1cc[nH]c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816174013 KNHRTUOFHBIFCF-ZDUSSCGKSA-N 446.558 2.212 10 20 IECD CC(C)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n[nH]1 1816727282 LFLMHYBCMFRBAR-NSHDSACASA-N 442.501 2.335 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729170 RRXDKMZXJAPXJV-TZMCWYRMSA-N 447.561 2.153 10 20 IECD Cn1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1Cl 1817845996 FXEKURDOVHLILN-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@@H]1CCCO1 1822162326 SNYPQYGHWJYXCP-FUZMGVLZSA-N 442.472 2.411 10 20 IECD COCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1826611032 JUFCJUKQENRZGZ-NRFANRHFSA-N 440.544 2.436 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1F)CC2 1828195014 HJHKAYAOSSJVFX-PSAXRQPBSA-N 433.461 2.243 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)cnc1O 1847190834 IXEVAXUZYVIHJQ-MMTUSNEMSA-N 445.859 2.086 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 14318726 VFPNJPKNUVCTFM-UHFFFAOYSA-N 433.486 2.107 10 20 IECD CCC(CC)[C@@H](CNC(=O)C(=O)NCc1c(C)c2ccccc2n1C)N1CCOCC1 550346590 IRSFXVNAUJRXEG-JOCHJYFZSA-N 428.577 2.356 10 20 IECD COCCNS(=O)(=O)c1ccc(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 725848722 DVCHATVJDUUWSJ-UHFFFAOYSA-N 429.882 2.168 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCN1C(=O)OCC(F)(F)F 727789080 WFDBCVJXGKUQMM-INIZCTEOSA-N 433.402 2.442 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)c3ccc(C)cc3O)cc2F)CC1 730286903 BSDVKTROKPEGTG-UHFFFAOYSA-N 442.535 2.418 10 20 IECD CC(=O)NC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCCC1 731255922 JTUUXEDSHLPUMQ-HZPDHXFCSA-N 449.523 2.048 10 20 IECD CN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCN(CC(F)(F)F)C1=O 732888334 MGXAIKPNZZOSHH-QGZVFWFLSA-N 446.445 2.091 10 20 IECD CN(CC(=O)NCc1cccc(C(=O)NC2CC2)c1)Cc1ccc(N2CCOCC2)cc1 738300358 UJMAHDOEOFXSSA-UHFFFAOYSA-N 436.556 2.164 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](N2CCNC2=O)C1 744200963 RSSUWXZXGGLSPW-RDJZCZTQSA-N 446.507 2.279 10 20 IECD CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 747561067 DVKAYTHHKHHWJH-UHFFFAOYSA-N 429.496 2.145 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]3C)nc12 749490632 UZUSWNWIDZLYSB-ZIAGYGMSSA-N 433.509 2.489 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 751359921 XOBBGHCEBXYHRY-UHFFFAOYSA-N 432.406 2.448 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](Oc4cccc(F)c4)C3)CC2)cc1 754268464 COZLARDDYZMLSE-XUZZJYLKSA-N 429.536 2.471 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(OC(F)F)n(C)n3)CC2)cc(OC)c1OC 767118863 WQEQHECSKAOABS-UHFFFAOYSA-N 426.420 2.010 10 20 IECD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NCCc1ccc(O)c(O)c1 768903852 NEJPKAOCWGPCJT-UHFFFAOYSA-N 433.530 2.189 10 20 IECD CC(C)OC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 770707264 SHTSIDPMRKUFME-NSHGMRRFSA-N 437.556 2.181 10 20 IECD CCNS(=O)(=O)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1 771465670 CFNURQBSMAOVQV-LJQANCHMSA-N 447.557 2.077 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 772401755 IXVIXHIAWQONQM-UHFFFAOYSA-N 436.509 2.201 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cn4cc(C)ccc4n3)CC2)cc1 778246909 SFOUYHIJQJIWRP-MDZDMXLPSA-N 433.512 2.173 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCNc3ccc(C)cn3)CC2)cc1 778305926 LHKFQPVCPDNKKC-KHPPLWFESA-N 437.544 2.222 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@H](c4ccco4)C3)CC2)cc1 778319416 WTMMMXCMAUAMNH-SHBDEGQCSA-N 425.485 2.093 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-n4cnnc4C)c3)CC2)cc1 778401734 HRYVUSFVSBASSG-ZHACJKMWSA-N 446.511 2.428 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(ncn4-c4ccc(F)cc4)C3)nc12 781351979 RTUSPNFGFHKQEU-UHFFFAOYSA-N 436.447 2.495 10 20 IECD C[C@@H](c1ccccc1)N(C(=O)C(=O)Nc1cnn(CC(=O)N(C)C)c1)c1ccc(N)cc1 783485647 JYRHPRCYZWEQMC-INIZCTEOSA-N 434.500 2.286 10 20 IECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766927 LJLHBBVKIHLSFJ-CQSZACIVSA-N 441.866 2.227 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2F)C[C@H](C)O1 785439022 KBTUPLFNYVHZOF-IRXDYDNUSA-N 442.535 2.438 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@@H]3CCCC[C@H]3C)CC2)cc1 785528230 OTXNSFRUHRRGRS-UXHICEINSA-N 430.593 2.266 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 786710436 GHLHXBFJKVGJNA-UHFFFAOYSA-N 437.587 2.360 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCSC[C@H]1c1ccccc1 788333212 QEFYHADEYRVMNK-NRFANRHFSA-N 425.554 2.456 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 788773555 BEMHBNOUQYIJNU-KRWDZBQOSA-N 428.499 2.490 10 20 IECD O=C(c1cccc(O)c1O)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1 790643243 KKUJBEKYHOMSOO-UHFFFAOYSA-N 427.482 2.183 10 20 IECD COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 792934041 KDCIZSBHMDINDW-XXBNENTESA-N 439.556 2.354 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(C)c(C(=O)OC)c2)cc1 793382000 RTNHFTHURJTVAA-UHFFFAOYSA-N 427.504 2.129 10 20 IECD CCC1CCC(N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793727915 WGBGHJINUIHZAY-SYYJFZTOSA-N 428.577 2.432 10 20 IECD CCC[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793730939 DMPWGRUMCDVJNR-DVECYGJZSA-N 428.577 2.433 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1C 794581172 FQASRQRFWPVYBG-UHFFFAOYSA-N 430.479 2.483 10 20 IECD CC(C)c1ncc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 803303676 SHOMWVNIFSHMJW-KRWDZBQOSA-N 425.533 2.272 10 20 IECD COCC1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 807770385 LILQRIISLUSLKV-OAHLLOKOSA-N 425.476 2.306 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O 808148944 BEWDKBALDFJYGJ-LJQANCHMSA-N 426.492 2.162 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)NCCc3ccc4c(c3)OCCO4)CC2)cc1 856903854 VKKSRQVOOFJXAX-GOSISDBHSA-N 425.529 2.336 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916392461 XIEYSOQWEBQGDT-UHFFFAOYSA-N 437.544 2.056 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C[C@H]1COc2ccccc2O1 917022348 JDCSNFQZSPLZAR-SFHVURJKSA-N 429.492 2.050 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 918297323 QQCXOEOLVZNLCB-LJQANCHMSA-N 435.484 2.428 10 20 IECD CS(=O)(=O)CCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 919887744 QKYJNQXCZUJWHV-ACCUITESSA-N 432.614 2.280 10 20 IECD C[C@H](Sc1cccs1)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1778809255 LFCBFLHARQCZQO-RBZFPXEDSA-N 449.554 2.179 10 20 IECD Cc1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1780578600 ZZOGZUOOXFLHQT-VWLOTQADSA-N 446.507 2.231 10 20 IECD CCc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1796043984 YUYDIXFTEZEYFF-CCWDJLKJSA-N 445.903 2.226 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cccc(F)n1 1810754417 QWGQZRGFWTXDRF-VLIAUNLRSA-N 437.431 2.055 10 20 IECD CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)n[nH]1 1821546417 JPKYNTRWZHVHHU-LLVKDONJSA-N 442.501 2.335 10 20 IECD CN(C)C(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1826745003 YGGIXYOSDCMKGS-INIZCTEOSA-N 437.924 2.073 10 20 IECD O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)c1ccco1 1827424459 XTVQWCXCQRXTEI-INIZCTEOSA-N 427.457 2.202 10 20 IECD C[C@@]1(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1(F)F 1838032375 PREWGQLYALOQTG-FQEVSTJZSA-N 439.459 2.150 10 20 IECD O=C(c1cccnc1Cl)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035564 WQDLPVFYOPPJFV-FNORWQNLSA-N 429.860 2.382 10 20 IECD COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)c(Cl)c1OC 1847376908 USHVIPNNLPMLDV-KBPBESRZSA-N 447.875 2.293 10 20 IECD Cc1cc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)ccn1 1848118042 HBNLOVIVOSCNIF-WYTIROKMSA-N 437.496 2.355 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 109991318 VREJDDWVYZIWQC-UHFFFAOYSA-N 432.542 2.216 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2c(c1)C(=O)NC2=O 729522793 SMASVKHCMDELLK-UHFFFAOYSA-N 433.386 2.356 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCC(C(=O)N2CCCC2)CC1 731845013 UBWNYRSVUBGGOT-NRFANRHFSA-N 429.561 2.234 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(OC(F)F)c1 734176901 FIMVKPNEZYYJFS-GHXNOFRVSA-N 438.499 2.047 10 20 IECD CC(=O)N(c1nc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cs1)C1CC1 734192121 TUGPJVNBTYOBCD-UHFFFAOYSA-N 425.488 2.093 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(CCN4CCOCC4)C3)c2C)cc1 734467272 HIGLVEIEYBEDLM-HXUWFJFHSA-N 426.561 2.239 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)c1O 739088239 NOYPEOLXKBBKRC-IYBDPMFKSA-N 427.501 2.265 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1 741203796 FKLJENMZWVYRCN-UHFFFAOYSA-N 441.557 2.411 10 20 IECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744402392 HIXMVHBPWVHGSX-ZIAGYGMSSA-N 428.510 2.154 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)COc2ccccc2)cc1 750874601 MZRHWFXHMFCVSQ-JOCHJYFZSA-N 425.529 2.455 10 20 IECD O=C(O)c1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1Cl 751213609 SFZSBHUDERZMRF-UHFFFAOYSA-N 444.918 2.074 10 20 IECD COC(=O)CC1(CS(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 752236397 VALJXBNHTDFVLA-GJZGRUSLSA-N 428.526 2.202 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(-c4ncco4)c3)CC2)cc1 754489014 MQZBXYCJRQXELC-UHFFFAOYSA-N 449.511 2.227 10 20 IECD COC(=O)c1cn([C@H]2CCN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)nn1 760668014 FLUYDMVLGLMTIQ-IBGZPJMESA-N 426.521 2.458 10 20 IECD CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)N(C)Cc3ccccc3O)ccc21 761175446 LZRJEFPHVLSDFS-UHFFFAOYSA-N 425.489 2.321 10 20 IECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1 762000227 JWVPYZLYBYILCX-UHFFFAOYSA-N 426.516 2.421 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@@H]1N1CCN(C)CC1 764352241 SOYIDWWEKMLZFB-KNQAVFIVSA-N 431.650 2.407 10 20 IECD O=C1CSc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2N1 765926325 LKYIGTZYYVIYDA-UHFFFAOYSA-N 436.287 2.454 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)cc1F 769650832 FEMJXYKKGGZLAP-LLVKDONJSA-N 432.495 2.341 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCO[C@@H](CN4C(=O)c5ccccc5C4=O)C3)ccc21 771545174 IQCXGMPDPQIVKH-LJQANCHMSA-N 448.523 2.276 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc1 772775709 OCEMRJOVXRSHBV-JAYGETEZSA-N 448.497 2.368 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 775254117 HCMYPDJOLBLCKA-IBGZPJMESA-N 430.593 2.279 10 20 IECD CCCN(C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@@H]1CCS(=O)(=O)C1 776042904 VNESZMFDECJGOO-GOSISDBHSA-N 440.585 2.076 10 20 IECD COC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 778302418 QJPXAOWDFGVELT-CTDFXDFQSA-N 427.501 2.305 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)C[C@H](O)c3ccco3)CC2)cc1 778326352 NZVMMCQYGUUIIE-ODBONLNUSA-N 427.501 2.121 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)NCC(F)(F)F)cc1 779459628 DVBPKMBRBDUHDV-UHFFFAOYSA-N 432.376 2.272 10 20 IECD CS(=O)(=O)NCc1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1 784110814 GQCCMEKQBMRMKR-UHFFFAOYSA-N 444.557 2.480 10 20 IECD CCN(C[C@@H]1COc2ccccc2O1)C(=O)CN(C)c1ccc(OCC(=O)OC)cc1 784563286 DPGSOMVEELTDJZ-LJQANCHMSA-N 428.485 2.363 10 20 IECD COc1ccc(C)cc1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 785521418 ADHJKJFPDIPLGU-UHFFFAOYSA-N 425.529 2.158 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)cc2)CC1 786659788 PKXZTDVOHFVTIP-UHFFFAOYSA-N 441.444 2.410 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc(F)cc1F 786978753 FDIBEDWGEMWOKS-UHFFFAOYSA-N 442.510 2.429 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 787191205 PZCGGFXRHUKOQZ-GOSISDBHSA-N 439.560 2.258 10 20 IECD C[C@H](CN1CCCCC1)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787752930 WPRYNOPFAWUGCZ-SJORKVTESA-N 438.519 2.364 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cc1 788979210 UIMYFKWPMXMPSJ-UHFFFAOYSA-N 438.576 2.411 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(O[C@@H]4CCOC4)cc3)nc12 789205663 NXMDGDUATJKHDK-MRXNPFEDSA-N 427.413 2.136 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cn[nH]c4)CC3)cc2F)C[C@H](C)O1 789816096 BULWVACZZAAPAV-HOTGVXAUSA-N 443.523 2.185 10 20 IECD CCN(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822463 AVOAKIIPVZGRLG-IRXDYDNUSA-N 428.508 2.499 10 20 IECD CC(C)O[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789833112 CVHMZSURKKBALS-VQTJNVASSA-N 435.540 2.111 10 20 IECD Cn1nc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c2ccccc21 789866883 ABZRKBBCKBOPEQ-UHFFFAOYSA-N 437.569 2.102 10 20 IECD Cc1nn(C(C)C)c(C)c1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795893413 JXMPTCLZTUFHML-UHFFFAOYSA-N 446.523 2.459 10 20 IECD C[C@@H]1C[C@@H](N2CCOCC2)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796378458 QQQQQEKESKELMZ-SJLPKXTDSA-N 433.508 2.196 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1 806929588 KHYDZEUKRKLUQG-UHFFFAOYSA-N 436.490 2.173 10 20 IECD CC(=O)N1C[C@H]2[C@@H](NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)CCC[C@H]2C1 808357400 GDYNVOAOVDNMJX-WWNPGLIZSA-N 428.577 2.342 10 20 IECD COCC1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCOCC1 816790922 SSKROIQCEGLAFU-UHFFFAOYSA-N 440.543 2.428 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCN(C)C(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 912704593 OYVHJJLYPUKEMH-INIZCTEOSA-N 426.469 2.460 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(CCO)Cc3ccccc3)CC2)cc1 916198006 FHWNRKLEHXXUKD-UHFFFAOYSA-N 426.561 2.411 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)c3ccsc3)CC2)c1 917484571 UZWJOTSGRSBHIX-UHFFFAOYSA-N 443.569 2.447 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)COc3ccccc3)cc2F)C[C@H](C)O1 918140195 KGGVITSVDWRUHG-IRXDYDNUSA-N 429.492 2.251 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc2c(cc1Cl)OCCO2 918284012 TYKJMUUWXJYULL-UHFFFAOYSA-N 449.866 2.342 10 20 IECD COc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1S(=O)(=O)NC(C)C 918374492 IANJQFHHBPDBGL-UHFFFAOYSA-N 433.530 2.471 10 20 IECD CC(C)NS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919970806 ZCWHTKUIKITHHR-UHFFFAOYSA-N 449.548 2.404 10 20 IECD C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637444 GDSKXWZJYNSOFT-LLVKDONJSA-N 442.440 2.418 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1)c1ccc(N2CCOCC2)cc1 920924671 DBCCPGQNMGOLNH-KRWDZBQOSA-N 436.512 2.466 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 1116237875 SJZURIMNLXKGSP-UHFFFAOYSA-N 436.505 2.356 10 20 IECD Cn1cc([C@@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2)cn1 1116547955 PLZDPQVOQPZACF-DEOSSOPVSA-N 437.519 2.391 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 1253854345 XKNWEXMTQJYUTR-GAJHUEQPSA-N 428.533 2.235 10 20 IECD O=C(CC1CCOCC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002661 VBUJDSQHRUTVKV-OAQYLSRUSA-N 438.908 2.011 10 20 IECD COc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1C 1796602464 LDXDMTMIBGZUOD-BCDXTJNWSA-N 425.485 2.304 10 20 IECD C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CC1(F)F 1808000413 IMDNCEHPXROKQX-WSXQUGQNSA-N 432.427 2.253 10 20 IECD CCOC(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)OCC 1817848480 LYLIABZJSKQIRX-OAHLLOKOSA-N 447.492 2.311 10 20 IECD COc1cc(F)cc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843251011 NCROMWNXWMVZCG-ONEGZZNKSA-N 427.432 2.171 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3cc(OC)c(OC)c(OC)c3)CC2)cc1 7354788 ZWYZPYPDPRYHRH-UHFFFAOYSA-N 429.517 2.159 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nnnn3CCN(C)C)c2C)cc1 108119562 FTDXAJCQYYWBCY-UHFFFAOYSA-N 442.545 2.404 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3cc(C)nn3[C@H]3CCS(=O)(=O)C3)CC2)cc1 726694145 CDDUYSGWFAJWNX-SFHVURJKSA-N 447.561 2.350 10 20 IECD C[C@H](OC(=O)CN(C)C(=O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733515172 WDPHZHFFHXHYQU-ZDUSSCGKSA-N 434.448 2.201 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(CN2CCOCC2)c1 741336677 BKXMNQKYZMKHRO-UHFFFAOYSA-N 425.529 2.400 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nn(-c4ccccc4)cc3OC)CC2)cc1 742927216 KFGFWUUZWMHCGI-UHFFFAOYSA-N 435.528 2.442 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@](C)(O)c3cc(C)oc3C)CC2)cc1 743566651 JBDPEBCQZJITJD-QHCPKHFHSA-N 430.549 2.234 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 747394800 UJUNPYCUOPLGNH-GBXCKJPGSA-N 440.588 2.499 10 20 IECD Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405506 FWFQLGBRRKPESB-JOCHJYFZSA-N 438.507 2.182 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 749645754 BWKVFCNYMRIKSH-UHFFFAOYSA-N 426.517 2.416 10 20 IECD COC(=O)C[C@H]1CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 752336917 KFZSBLNENPHDPM-GJZGRUSLSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)CC2)cc1 754081169 JGHAXASZIFRHCQ-PZJWPPBQSA-N 448.608 2.119 10 20 IECD CN(CCN1C(=O)c2ccccc2C1=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 754100202 NDHVBZCOXLPSPV-UHFFFAOYSA-N 440.475 2.100 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](CO)Oc4ccccc43)cc2F)C[C@@H](C)O1 759746023 AVDKFHXPEXCZNE-LMMKCTJWSA-N 443.519 2.315 10 20 IECD CN(C)S(=O)(=O)c1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761899725 VGTRPPYIHFYXPL-UHFFFAOYSA-N 437.905 2.260 10 20 IECD CS(=O)(=O)c1ccc(OCCNC(=O)NCc2cccc(Br)c2O)cc1 765492401 BSQQUEZUCOXUDM-UHFFFAOYSA-N 443.319 2.436 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1C(=O)OC(C)(C)C 772866999 XGGBPMUHJYZWDF-OLZOCXBDSA-N 427.523 2.234 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCS(=O)(=O)c2ccccc2C1 773239121 ZFRNGSOXTXKGKZ-UHFFFAOYSA-N 433.505 2.161 10 20 IECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C[C@H](O)C(F)(F)F 778202050 CMNLWYBGCXJOGS-DEYYWGMASA-N 435.462 2.301 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(C[S@](C)=O)c3)CC2)cc1 778284776 XFFTYGPNXACHHP-MNUDCFFLSA-N 441.553 2.417 10 20 IECD O=C(CS(=O)(=O)Cc1cccc(Br)c1)OCC(=O)c1ccc(O)c(O)c1 783139334 AWKKXYNNFUIFRB-UHFFFAOYSA-N 443.271 2.201 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)C(C)C)cc3)cc2)CC1 786655803 IXMARWOIGLUJCU-UHFFFAOYSA-N 443.569 2.467 10 20 IECD CC[C@H]1CO[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949768 KMIYKNMUBCFZPD-ZBFHGGJFSA-N 443.466 2.184 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@@H]1c1ccccc1 793732568 IPVYWTRIIXGQMN-ZNLUXHQJSA-N 434.540 2.224 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3cccc(C(C)C)c3)CC2)cc1 803746956 NPBCBYYWBSSRHA-UHFFFAOYSA-N 438.572 2.373 10 20 IECD CO[C@@H]1CCC[C@H]1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804108982 ASCJMCKKOPDCRM-HDMKZQKVSA-N 425.476 2.304 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(S(N)(=O)=O)oc1C 807931850 KNWHBSKNFRJJKP-UHFFFAOYSA-N 437.518 2.238 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(CCO)C3CCOCC3)cc2Cl)C1 807957095 WPEBLTRNLZMQDP-INIZCTEOSA-N 437.968 2.192 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 808899836 FOWAHEVWMHRDFC-QHCPKHFHSA-N 438.572 2.118 10 20 IECD Cc1cc(O)nc2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc12 809615789 LVMYPEPGWPZIPD-UHFFFAOYSA-N 425.510 2.414 10 20 IECD COC(=O)Cc1cccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)c1 811822779 MDACSNKZJBENQZ-UHFFFAOYSA-N 435.483 2.441 10 20 IECD CS(=O)(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 919969492 NRLFHMCDQQNDPD-UHFFFAOYSA-N 447.532 2.039 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc(N(C)C)cc3)CC2)cc1 1322308816 VZXKTDHQPBEJQN-UHFFFAOYSA-N 425.577 2.425 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777852182 WWVWXDCVILGELU-TUVUNVSASA-N 443.500 2.092 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1788241845 DXEOJCNPLFETLX-BEODPJQWSA-N 444.528 2.233 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1788241847 DXEOJCNPLFETLX-DFRHBOMNSA-N 444.528 2.233 10 20 IECD Cc1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1795183819 YZEPRKJGRXWYHG-FNLKRUPLSA-N 431.496 2.435 10 20 IECD Cc1cc[nH]c1C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1807624912 QYIANANJZFWGME-UHFFFAOYSA-N 434.587 2.028 10 20 IECD Cc1noc(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843759 YKDTVVDNMHCNPI-INIZCTEOSA-N 440.460 2.369 10 20 IECD COCc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427017 BGFWJYJVKHCIPC-KRWDZBQOSA-N 444.488 2.174 10 20 IECD O=C(c1cc(-c2cccs2)on1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250143 OZLGUJWTILFVCG-UHFFFAOYSA-N 426.454 2.340 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C[C@@H]3CCS(=O)(=O)C3)c2C)cc1 19607839 FZQZNFZBSAJAKJ-INIZCTEOSA-N 447.509 2.431 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc(OC)c1OC 33623914 VLWZKXVYBUGFAF-UHFFFAOYSA-N 434.514 2.426 10 20 IECD CCN(CC)c1ccc(CNCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1F 236960316 NPAYJJLRYZOREM-UHFFFAOYSA-N 449.596 2.309 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@](C)(O)c3ccsc3)CC2)cc1 303842266 JEIHKHIUYCLAHA-JOCHJYFZSA-N 432.590 2.476 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cc(Br)cn(C)c2=O)n(C)c2ccccc12 472785180 IEDIYJFCYPOIJB-UHFFFAOYSA-N 431.290 2.203 10 20 IECD COc1ccc(N2CCC(NCc3cc(OC)c(OCC(N)=O)c(OC)c3)CC2)cc1 726606449 DMDLPPAGTUMAJW-UHFFFAOYSA-N 429.517 2.335 10 20 IECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1cccc(-n2cnnn2)c1 727243506 NNEVHSIJTLZQBT-UHFFFAOYSA-N 428.455 2.315 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 728947930 VFMGZWLXSKHTEG-MRXNPFEDSA-N 426.517 2.349 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 733341652 DCBILTMSRGXIGJ-ARFHVFGLSA-N 429.558 2.404 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c1 734016626 VZRYRRWLNRCPRT-SFHVURJKSA-N 438.571 2.426 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1 734702365 ZFHVYJCTIVKEKB-UHFFFAOYSA-N 444.557 2.099 10 20 IECD Cc1nn(C)cc1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 741301136 YAHSBSDPYIJIMN-UHFFFAOYSA-N 431.430 2.395 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C)C(=O)N3CCS(=O)(=O)CC3)c2C)c1 749376381 NPPYCUJKYSPGKI-QGZVFWFLSA-N 431.558 2.086 10 20 IECD CCN(CC)c1ccc(CN(C)S(=O)(=O)CCNS(=O)(=O)c2ccccc2)cc1 763315918 ANUWIWNNNCJLGD-UHFFFAOYSA-N 439.603 2.273 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 764733157 AZZFACJEGLWHBN-RHSMWYFYSA-N 431.505 2.475 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/c3ccc(O)c(OCC)c3)nc12 768624284 JJQYHKZQRIJKAQ-SOFGYWHQSA-N 427.413 2.473 10 20 IECD COc1ccc(N2CCN(CCN[C@H](C)CCN3C(=O)c4ccccc4C3=O)CC2)cc1 769493322 UPZLJGZVDQWGCE-LJQANCHMSA-N 436.556 2.482 10 20 IECD CC[C@@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769863517 KNCKRIPJJNMMCW-CQSZACIVSA-N 435.458 2.352 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771064865 LEKSRTBHYIUKEY-MRXNPFEDSA-N 443.939 2.006 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccs1)N1CCOCC1)c1ccc(N(C)C)cc1 774809235 OHZVPQVBGHMSDA-QFBILLFUSA-N 430.574 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(OCC4CC4)CC3)CC2)cc1 778295298 RYXKKLODGOEAON-HJWRWDBZSA-N 427.545 2.318 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@H](Cc4ccccc4)C3)CC2)cc1 778423163 MMUHNZDUMXKABZ-UWHSVAFCSA-N 449.551 2.370 10 20 IECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccn1 778553194 UCBJTMUTWHHRJY-UHFFFAOYSA-N 430.480 2.224 10 20 IECD CSc1ccccc1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 780767579 UOTCBMLXCJBCPG-UHFFFAOYSA-N 426.585 2.122 10 20 IECD CN(CC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1)C(=O)OC(C)(C)C 785422394 KVWLYVLLXFTEQV-UHFFFAOYSA-N 432.565 2.474 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(CCOc3ccccc3Cl)CC2)cc1 785424509 IZDIMIZZHPEUTG-UHFFFAOYSA-N 444.963 2.245 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@@H]3CCCC[C@@H]3C)CC2)cc1 785528229 OTXNSFRUHRRGRS-PMACEKPBSA-N 430.593 2.266 10 20 IECD O=C(NCCCCCN1CCCCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799026 LVVMYSKKKVFXQX-UHFFFAOYSA-N 434.556 2.051 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)OC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 790360259 MHSAQZMZKZSJHE-OTWHNJEPSA-N 449.567 2.325 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)O[C@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 796612286 NQLBLZUGMSBPHF-UAKAABGRSA-N 449.567 2.325 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@]4(CCCOC4)C3)CC2)cc1 797412482 OOZBVUVXHSIAGU-GBXCKJPGSA-N 446.592 2.187 10 20 IECD CC(=O)N[C@](C)(C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(S(C)(=O)=O)cc1 797742849 COLGTRISSDWAEJ-QHCPKHFHSA-N 444.553 2.342 10 20 IECD C[C@@H](Sc1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1)C(N)=O 800861670 ZJHJZYQQZFDJMI-CQSZACIVSA-N 433.555 2.140 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 803311689 XUOIPTGZOUNJIV-INIZCTEOSA-N 429.492 2.207 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2)cc1 804317744 OEELHJDJIVMRKC-NHCUHLMSSA-N 449.555 2.361 10 20 IECD CCCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 805008750 AZNXSQZKMFPVKW-HXUWFJFHSA-N 448.583 2.392 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](N4CCCC4=O)C3)cc2)CC1 805020502 VYAMHUSQINBIJM-OAQYLSRUSA-N 426.561 2.153 10 20 IECD C[C@@H](O)CN1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H](C)C1 806683710 BNPPBLGQZZPYKN-HZPDHXFCSA-N 426.508 2.353 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCCN1C1CCCCC1 806788940 YUKJGZUTGHOJSU-HSZRJFAPSA-N 442.604 2.395 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 808095025 PASSKXOSBHACPC-GOSISDBHSA-N 443.500 2.044 10 20 IECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)N[C@](C)(c2ccc(S(C)(=O)=O)cc2)C1=O 917423434 XPDSGQXKUTUMJQ-JOCHJYFZSA-N 444.557 2.013 10 20 IECD CSc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918463633 LYHJAHRYRIFNOX-INIZCTEOSA-N 426.542 2.365 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(F)(F)C1)C2)c1cc(O)nc(O)c1 1777846563 OOEJBMFPBUEDJW-XBHMSOGKSA-N 439.459 2.056 10 20 IECD CC(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n[nH]1 1782007097 JJXDBZZQKWWTTG-NRFANRHFSA-N 448.907 2.355 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sccc3Cl)C[C@@H]21)c1cc(O)nc(O)c1 1787293243 DGDPQPVBVDTUQN-JKOKRWQUSA-N 437.905 2.115 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242245 XZOLMMTUBMMKAB-MIUNTBIASA-N 449.866 2.192 10 20 IECD C[C@H]1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792219117 KDMCEJVMFKBVDQ-JGDLYVIOSA-N 444.528 2.233 10 20 IECD C[C@](O)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)C(F)(F)F 1800712122 BBHSMURHSGCDHZ-UCSBCBTLSA-N 436.814 2.316 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848371 GLARXZOQYUJOJF-BLLLJJGKSA-N 439.476 2.288 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499667 SLPDQEZJFDCZHC-RGIROJJOSA-N 435.575 2.308 10 20 IECD CC(C)(F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826772048 MNEMJQYMESQBBW-CQSZACIVSA-N 429.583 2.215 10 20 IECD CC(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 19038323 LJHLYNPXTGLVAV-UHFFFAOYSA-N 447.557 2.255 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)CC2)cc1 110354061 KRSJGHILUVJZSD-UHFFFAOYSA-N 433.486 2.406 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n(C(C)(C)C)n1 737130171 BUQRLPLAOFHRCK-UHFFFAOYSA-N 431.512 2.302 10 20 IECD CCc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737246028 RJHFIGBGDWZQNQ-UHFFFAOYSA-N 429.542 2.047 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)CC1 741099917 NBJQSNTYYBHUHL-UHFFFAOYSA-N 447.583 2.455 10 20 IECD CCCc1cc(=O)n2nc(NCCN3CCN(c4ccc(OC)cc4)CC3)sc2n1 742926765 QICIFYTZXIBEKE-UHFFFAOYSA-N 428.562 2.346 10 20 IECD CN(C)c1ccc(N2CCC(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 743701413 TZKAPPBMYUVFTG-UHFFFAOYSA-N 432.546 2.229 10 20 IECD CCN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCS(=O)(=O)C1 745903608 HTNBTRPKBODMHQ-HOCLYGCPSA-N 431.505 2.475 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N(C)C)c(F)c3)cn2)C[C@@H](C)O1 747097711 XCEKHFZPHRDOIP-HUUCEWRRSA-N 432.500 2.046 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)c4ccc(C)s4)CC3)nc12 747834262 AIOZCDUERCBKSD-UHFFFAOYSA-N 443.529 2.376 10 20 IECD CN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2Cl)CC1 750342615 VOROGNJWFLXHTN-UHFFFAOYSA-N 429.952 2.413 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(c4ccccn4)C3)cc2F)CC1 753127929 QRCLERPLRWOYGW-LJQANCHMSA-N 426.540 2.441 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@@H](CNC(=O)OC(C)(C)C)C3CC3)CC2)cc1 754401404 LHFOWCUVIOTAJC-FQEVSTJZSA-N 432.565 2.237 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(CC[S@@](C)=O)CC3)c2C)cc1 755948555 DDKNUASGIRFFBR-WJOKGBTCSA-N 445.585 2.060 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 756157365 COGLABZHMDAVCH-UHFFFAOYSA-N 449.454 2.198 10 20 IECD C[C@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc([N+](=O)[O-])ccc1O 756712962 RKAPUAKBGYCSTI-HOTGVXAUSA-N 428.493 2.247 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(N2CCCCC2=O)CC1 764354381 OVTGORIYUNRBRP-UHFFFAOYSA-N 432.540 2.473 10 20 IECD C[C@H](NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 775256314 WKRKCHQDOCHQQJ-KRWDZBQOSA-N 446.573 2.063 10 20 IECD O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)N(Cc1ccco1)Cc1ccccc1O 776072631 AIRYQNCDPDIJRV-DYESRHJHSA-N 434.514 2.433 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 776704325 BDTAGZOESDNKJS-UHFFFAOYSA-N 426.473 2.198 10 20 IECD O=C(CN1CCC(Cn2cncn2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778220287 ZMFURLIAIQZHQT-UHFFFAOYSA-N 429.480 2.404 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(N2CCOCC2)cc1 778577537 ZOIJJLJYLBWFGI-CQSZACIVSA-N 440.475 2.363 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 779479671 MSSVXTLGPPBQMT-VQTJNVASSA-N 427.526 2.438 10 20 IECD O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N(CCO)[C@H]1CCS(=O)(=O)C1 782941462 YCWWASSCRSKZMX-SFHVURJKSA-N 430.486 2.049 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1 785525873 YQBAYRAISWOPMN-OAHLLOKOSA-N 433.530 2.046 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 787189855 HXTOIDNMVVYXJA-FQEVSTJZSA-N 440.544 2.457 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(CC2CCCCC2)CC1 788322034 FIATZYOJRFLPNP-UHFFFAOYSA-N 442.604 2.300 10 20 IECD Cc1cccc(=O)n1C[C@](C)(O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 792198005 IQSWNQDOHRXXPW-AOMKIAJQSA-N 435.471 2.294 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cn(C)nc1-c1ccccc1)c1ccc(N2CCOCC2)cc1 803300163 QCUZZIDDGOXSLH-GOSISDBHSA-N 447.539 2.417 10 20 IECD CC1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOCC1 804649968 UKHPAIGNNDAODX-OAHLLOKOSA-N 425.476 2.306 10 20 IECD COc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 807290491 WXFDQXPDKSJJTF-UHFFFAOYSA-N 436.556 2.278 10 20 IECD C[C@H](CO[C@@H]1CCOC1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 808276774 CYKZPFCPEMKUDI-DYESRHJHSA-N 429.517 2.185 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2F)cc1OC 917758308 OMPNJLHQRVREDW-UHFFFAOYSA-N 445.494 2.355 10 20 IECD O=C(CCCn1cnc2ccccc21)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338200 YBEAWXBZCKIVOO-UHFFFAOYSA-N 426.542 2.368 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 920926911 RQMCIYPXHSUTHH-SFHVURJKSA-N 438.528 2.176 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ncoc4[C@@H]4CCCO4)n3)CC2)cc1 1323585765 QVYAWRZPIFASLS-KRWDZBQOSA-N 439.472 2.476 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1 1325382588 VPWKFEISWCKCPJ-LPHOPBHVSA-N 434.395 2.160 10 20 IECD COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817846142 IYPMWKTXECEAFG-INIZCTEOSA-N 438.444 2.239 10 20 IECD CCN1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817848429 JBFLKCWVBMMJAT-KRWDZBQOSA-N 442.520 2.254 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnn2ccccc12 1818511856 DXPZGOJYJRNSQS-KRWDZBQOSA-N 447.455 2.483 10 20 IECD Cn1cncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708790 OROXHYNKBCXIAD-SNVBAGLBSA-N 447.904 2.481 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CNc2ccc(F)cc2)C1 1842886170 OHBDHGLNYVIHNJ-UHFFFAOYSA-N 449.486 2.234 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846643238 HTYLMRCVAAIDMP-PMGBHYCQSA-N 426.469 2.492 10 20 IECD CS(=O)(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 730279347 XBTQKRMDWFSWGA-UHFFFAOYSA-N 431.558 2.126 10 20 IECD NC(=O)[C@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN1c1ccc(F)cc1 731859122 RXNHFKNWWQQIIR-UYAOXDASSA-N 440.475 2.159 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC3(C(=O)N(C)C)CCCC3)CC2)cc1 733353481 NIOINSZULKLXNE-UHFFFAOYSA-N 445.608 2.155 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740609882 OCYAXFLOFLQFKF-UHFFFAOYSA-N 446.529 2.156 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742755463 XIUOUGZFGVTYSJ-YJBOKZPZSA-N 439.578 2.259 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3S(=O)(=O)C(C)C)CC2)cc1 742919444 IQMNMPGQUAZEMK-UHFFFAOYSA-N 445.585 2.429 10 20 IECD O=C(CN1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1)NCc1ccc(N2CCOCC2)c(F)c1 748830884 NKZJIHQDIWUEMR-GREBRCKQSA-N 430.568 2.085 10 20 IECD O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407180 SVYVXYYIHWSYFA-UHFFFAOYSA-N 444.898 2.410 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CSCCS1 750993221 IUHZQWGOMQNNLC-SFHVURJKSA-N 433.578 2.407 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 756483774 QEQSRZJWFXNWQY-CRAIPNDOSA-N 448.541 2.487 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(-c4ccco4)n3C)CC2)cc1 758202745 APUSJHFYLWHRDA-QGZVFWFLSA-N 429.546 2.359 10 20 IECD COc1cc(N2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)cc(OC)c1OC 759104507 XVDRDXPIOAVUHP-UHFFFAOYSA-N 427.567 2.344 10 20 IECD COc1cc(N2CCN(C(=O)NCCNC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 759259378 UPBBJMDRJJBFPH-UHFFFAOYSA-N 438.525 2.069 10 20 IECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NCc1ccc(CN2CCOCC2)cc1 759588016 GZKIZKDBOGDRHP-KMDWOBIYSA-N 440.496 2.191 10 20 IECD O=C(N=c1cc[nH]cc1I)NCc1ccc(N2CCOCC2)cc1 760029977 QHXZJPPGEXBZNJ-UHFFFAOYSA-N 438.269 2.266 10 20 IECD Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 770350526 NFMCWSCTMKVGHC-LAUBAEHRSA-N 445.539 2.176 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)c1 772725646 YWYMSBYIEPYEBE-AWEZNQCLSA-N 440.543 2.225 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccc(N(CC)CC)c(F)c1 777938472 JFFXUXINNOOISN-UHFFFAOYSA-N 443.566 2.449 10 20 IECD COC(=O)C1(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCCC1 778226024 NCJUPGRXBKMCHV-QXMHVHEDSA-N 443.544 2.282 10 20 IECD CNC(=O)Cn1nc(NC(=O)C(=O)N(c2ccc(N)cc2)[C@H](C)c2ccccc2)cc1C 783482588 IOISXBWNUXZSKV-MRXNPFEDSA-N 434.500 2.253 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1Cl 789381382 CZXRROCEVXZSEP-HNNXBMFYSA-N 444.919 2.305 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(C)o1 789828133 WPNDVNKTCCRORZ-BXWFABGCSA-N 447.507 2.461 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N(CCCO)Cc1ccccc1 789856231 QZLROUPQIQMDPL-UHFFFAOYSA-N 427.570 2.267 10 20 IECD CC(C)(C)OCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949709 JYOGPPANPMEWPI-UHFFFAOYSA-N 431.455 2.090 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cc3c(cc2OC)NC(=O)CO3)cc1F 797446378 XGTPPMVHPCNQET-UHFFFAOYSA-N 437.493 2.490 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccc(N2CCOCC2)cc1 803303246 JGYTZEVYHZYBKG-HKUYNNGSSA-N 447.601 2.261 10 20 IECD C[C@@H]([C@@H](C)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)N1CCOCC1 803677051 DVRIKNKUXFSYRY-MOPGFXCFSA-N 430.593 2.297 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cc1F 804853256 VEEIVVGKZILIGR-AWEZNQCLSA-N 432.462 2.383 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cn1C 804959793 HIQXVPZBEFBUMU-UHFFFAOYSA-N 433.530 2.190 10 20 IECD COC[C@@H](C)NS(=O)(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1 863991800 MIBNHQYPFBLCGR-GOSISDBHSA-N 432.590 2.364 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H]1CCc2ccccc21 1804336229 LHBVARNCQQNPAM-DFGXFYAUSA-N 443.594 2.215 10 20 IECD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C1(O)CCC1 1817842800 OSXWHQKQIWFNNO-WFASDCNBSA-N 429.477 2.073 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818147877 NZYVZHKFWIFGAK-RDTXWAMCSA-N 438.488 2.230 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2ccnn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293385 KKCVVDZCPMVYEM-CQSZACIVSA-N 445.867 2.072 10 20 IECD Cc1nc(N)sc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826969984 PZGAXCGEMFJNQM-HNNXBMFYSA-N 445.545 2.387 10 20 IECD CC(C)(C)CC(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828242192 CJAYHCRBLJHFOS-SNVBAGLBSA-N 440.616 2.352 10 20 IECD Cc1ncncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829357263 CPIXZBHLKLWUDW-SFHVURJKSA-N 425.489 2.138 10 20 IECD Cn1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1Cl 1829494868 LYEQSEPENAPQGM-INIZCTEOSA-N 447.923 2.427 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)ncc1[N+](=O)[O-] 1845501137 FAHOILBVYWVZDV-UHFFFAOYSA-N 446.847 2.494 10 20 IECD C[C@H](Oc1ccccc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846059026 OEDNXUJRZORKCV-SFHVURJKSA-N 446.507 2.450 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)cc1 4669408 OWZXCJUQURHKOZ-LJQANCHMSA-N 428.577 2.115 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(C(=O)NCC(N)=O)cc3)ccc21 590701650 DWFXWMFDOCPVPS-UHFFFAOYSA-N 436.512 2.050 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 726240283 VDONNLAIKXGOOO-HBMCJLEFSA-N 431.625 2.483 10 20 IECD O=C(NCC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCC(CO)CC2)cc1 726619645 SMWAZDIYLMUXDM-UHFFFAOYSA-N 436.556 2.279 10 20 IECD CCOCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 726723177 NSFTVGRKATZHIU-IBGZPJMESA-N 438.528 2.180 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726726986 DORHRVYJOXGFEL-UHFFFAOYSA-N 445.541 2.213 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C 728301616 IYKPIPUSNYMHIV-UHFFFAOYSA-N 431.558 2.077 10 20 IECD C[C@H](NC(=O)NCCOc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 730067439 UMPHAYCCHYASDF-KRWDZBQOSA-N 447.557 2.366 10 20 IECD COc1cc(OC)c(CNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)c(OC)c1 733029512 GQVOCAYKKWTTTF-UHFFFAOYSA-N 443.544 2.297 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(=O)n(-c4ccc(C)cc4)[nH]3)CC2)cc1 742240398 DIBVVYFLUZZGHJ-UHFFFAOYSA-N 449.555 2.425 10 20 IECD CCOC(=O)c1[nH]c(C)c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1C 742916824 POEIYEHHCDJKKA-UHFFFAOYSA-N 428.533 2.369 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC(=O)Nc3ccc(F)c(F)c3)CC2)cc1 742948565 YYAOPZVSKOQIBI-UHFFFAOYSA-N 447.486 2.033 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1c(F)cc(F)cc1F 743892947 NCPWLZQIJHUVRK-UHFFFAOYSA-N 425.382 2.459 10 20 IECD COc1ccc(C[C@@H](CO)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1O 745649166 QYQLQQBVAUZUNQ-GOSISDBHSA-N 447.507 2.027 10 20 IECD Cn1ccc(N2CCC[C@@H](NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)C2=O)n1 745882807 JSAWFBZKZGUJGH-ZWKOTPCHSA-N 427.505 2.012 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(CCOC(C)C)CC3)cc2F)CC1 746418186 OMVZIAZMSVMQJA-UHFFFAOYSA-N 435.588 2.220 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]3C)nc12 752068958 NBNNGMVYVRGDPS-UONOGXRCSA-N 433.509 2.347 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3nccn3CC(F)(F)F)CC2)cc1 754027374 IJGFKXZAAHAKES-SFHVURJKSA-N 441.498 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-c4n[nH]c(C)n4)c3)CC2)cc1F 754212580 LXJJWBHWUBNCAY-UHFFFAOYSA-N 438.463 2.215 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](c3ccco3)N3CCCC3)CC2)cc1 758186829 SBNXYZYUSJFQGJ-JTHBVZDNSA-N 428.577 2.198 10 20 IECD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1 758548226 QLPGOEYEGHVEEL-JTQLQIEISA-N 442.877 2.186 10 20 IECD COC(=O)c1c(C)[nH]c(C(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 759885841 IEFRJHDPUNHWQS-UHFFFAOYSA-N 445.516 2.449 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 760591800 HAQRWDSFGXRHKT-UHFFFAOYSA-N 442.534 2.139 10 20 IECD COCCCN(CCOC)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769709990 GOTHWXAHDWBABZ-UHFFFAOYSA-N 428.532 2.380 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1 772775714 OCEMRJOVXRSHBV-RKXVYHDYSA-N 448.497 2.368 10 20 IECD COc1ccc(C)cc1NC(=O)CNC(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775253699 BRCOBEOWBNURLT-GOSISDBHSA-N 440.544 2.246 10 20 IECD CNC(=O)c1cc(C)ccc1NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778289405 LLBQWBUMJMAVEC-ZHACJKMWSA-N 436.512 2.207 10 20 IECD C[C@@H](c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1)N1CCOCC1 785304826 RRSINAZWWCOBNQ-CVEARBPZSA-N 427.501 2.177 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 785529123 LNKNNEKJNMGMJR-UGKGYDQZSA-N 428.577 2.115 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)C(=O)NC4)cc2F)C[C@@H](C)O1 788792074 VEZUGZYZQOPYII-HUUCEWRRSA-N 427.476 2.378 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cnc[nH]4)CC3)cc2F)C[C@H](C)O1 789817142 GBECYPMBDFGJFN-HOTGVXAUSA-N 443.523 2.185 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)O[C@]4(CCO[C@@H]4C)C3)cc2F)C[C@@H](C)O1 790369503 PXCCHKKMVAHEBS-CDXSOPQDSA-N 449.567 2.324 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 792231600 LBZCTRSKMXXOMY-UHFFFAOYSA-N 440.544 2.495 10 20 IECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccc(OC)cc2O)c1 795356362 AKFQVGPJACCPKD-YVMONPNESA-N 437.470 2.083 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1OC 796786755 SCKYZLQFIYDUOD-UHFFFAOYSA-N 441.484 2.214 10 20 IECD Cc1[nH]c(C=O)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 801409370 GAJJHHQZCSCBOL-KBPBESRZSA-N 431.464 2.362 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCc2ccccc21 803297962 LDXHXJGUGYHWNB-RBUKOAKNSA-N 436.556 2.268 10 20 IECD CN1CCC(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803374532 OYQFSDZVJWEPDE-UHFFFAOYSA-N 438.519 2.221 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCC[C@H](N4CCCC4)C3)CC2)cc1 804318261 FLHWPILAEOJAEK-NRFANRHFSA-N 428.577 2.257 10 20 IECD CN(C)c1ccc(CNC(=O)Cn2nnnc2Cc2ccc(Br)cc2)cc1 804907888 GNLNHZKBOOURMS-UHFFFAOYSA-N 429.322 2.409 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cc(C)on3)cc2F)CC1 805009905 PXLAKMFRFMFBET-OAQYLSRUSA-N 443.523 2.244 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCCC[C@H]1N1CCOCC1 806090254 IJSNJBOSZMGJRA-DHIUTWEWSA-N 442.604 2.395 10 20 IECD CCN(C)C[C@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770923 PNULVYHGPJQBPA-SJORKVTESA-N 438.519 2.173 10 20 IECD COc1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 810353187 WNQHDJPESCSAGX-UHFFFAOYSA-N 433.455 2.437 10 20 IECD O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NCc1cc(Cl)cc(Cl)c1O 811529706 PUMPEZYGEZNKOF-UHFFFAOYSA-N 429.285 2.170 10 20 IECD O=C(Nc1ncc(CCO)s1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816635610 QZXSFRBXDVGMBW-UHFFFAOYSA-N 425.513 2.498 10 20 IECD CCOC(=O)N1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 825293519 YNRTZKFZOPIKEH-UHFFFAOYSA-N 437.408 2.285 10 20 IECD Cc1cc(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1cccc(Cl)c1 919979687 FWJCUNQTVLYVAO-INIZCTEOSA-N 437.949 2.171 10 20 IECD COC(=O)[C@H](C)NC(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 931283146 RLDODQAWKGAHMB-HNNXBMFYSA-N 442.472 2.221 10 20 IECD COc1ccc(N2C(=O)/C(=C\c3ccc(OC)c(OCC(N)=O)c3)SC2=S)cn1 1115963882 OFYDWTJKDNNYTK-OVCLIPMQSA-N 431.495 2.369 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(OCc2ccccc2)CCOCC1 1320394163 PAZRCTGXVKNCLS-IBGZPJMESA-N 443.496 2.454 10 20 IECD Cc1nc([C@H](C)NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 1322789753 JMNIBXVLIZDCOV-AWEZNQCLSA-N 440.483 2.194 10 20 IECD CN1CCN(c2ccc(CNc3cccc(NC(=O)NCCC(N)=O)c3)cc2F)CC1 1326942553 GETCZQFFNUWNIA-UHFFFAOYSA-N 428.512 2.187 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnc(O)[nH]4)C3)C2)cc1 1779645051 GMXNINMHEOWVGY-DEOSSOPVSA-N 449.511 2.280 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2 1785507012 IHIRVVYULOGCQR-ZZNNXKBLSA-N 448.859 2.207 10 20 IECD CC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313956 NMEQUTQBEYMWLR-UHFFFAOYSA-N 433.555 2.350 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1 1795822595 XPIAHWZKWNCYOY-RTJJCOEGSA-N 438.480 2.188 10 20 IECD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598725 AMVHTVBIAUWBJY-BJWYYQGGSA-N 440.456 2.286 10 20 IECD CCc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)co1 1796934977 YZBCWHAKYFOVGQ-ACHSLPGTSA-N 435.484 2.282 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnccc1F 1804285037 ASHNFELGEWBCBG-BPQKRJORSA-N 427.432 2.303 10 20 IECD Cn1cc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286495 RPWLZBZPQYXIQE-NCSLWMNCSA-N 429.448 2.246 10 20 IECD CCc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804990303 XMBCLYJCSVMKRP-AOMKIAJQSA-N 447.495 2.479 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)C1CC1 1813712826 UZJXYSRAMKSVLF-GCJKJVERSA-N 431.496 2.290 10 20 IECD CO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822456937 ITTYDJVALVSWJX-DERGHVRDSA-N 430.461 2.267 10 20 IECD CCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827426787 GUZKRARDMSXJRC-GOSISDBHSA-N 427.505 2.256 10 20 IECD O=C(c1cc[nH]n1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714518 DFVNNIPMNLQXJX-OAQYLSRUSA-N 448.527 2.436 10 20 IECD O=C1/C(=C/c2ccc(N3CCOCC3)cc2)SC(=S)N1CCCN1CCOCC1 28964163 GAGOTRAMQMTHJM-MNDPQUGUSA-N 433.599 2.447 10 20 IECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 736072439 KQDJZDWMOMTSQP-UGKGYDQZSA-N 445.608 2.154 10 20 IECD COC(=O)[C@@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 736311467 KIRGIVAVSAOEPM-JOCHJYFZSA-N 429.492 2.125 10 20 IECD C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742921785 ZQPJAKMOIJMBHU-IBGZPJMESA-N 434.540 2.449 10 20 IECD COc1ccc(N(CC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)CC(C)C)cc1 744395724 WNYXEXLUAROUAI-FPOVZHCZSA-N 438.590 2.352 10 20 IECD Cn1ncnc1COc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1 746664459 GWWYLWJKCCHZDM-UHFFFAOYSA-N 425.561 2.311 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1OC 747608459 XKBNKOFVLHLLGR-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCN3Cc3ccc(F)cc3)nc12 750505878 ZJHRTPZIBAQGJR-GOSISDBHSA-N 442.447 2.459 10 20 IECD Cc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c(O)c1O 750623141 UKGFCQPCTODBIB-UHFFFAOYSA-N 442.877 2.105 10 20 IECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751229609 ZYXATSAQGWFCBG-UHFFFAOYSA-N 439.465 2.182 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H](C)c3nnc4ccccn34)CC2)cc(OC)c1OC 759215471 FUNAQFOLCKHZGS-HNNXBMFYSA-N 440.504 2.348 10 20 IECD COc1cc(N2CCN(C(=O)c3ccnc(O[C@@H]4CCOC4)c3)CC2)cc(OC)c1OC 759221463 QYRPOUDXAYWVLE-GOSISDBHSA-N 443.500 2.238 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cnc4ccccc4c3)CC2)cc1 770262970 WWQKYJLZAPLPFT-UHFFFAOYSA-N 426.542 2.344 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCCN(CC(C)C)C3)CC2)cc1 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432.471 2.435 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCC[C@H](C(C)C)C3)CC2)cc1 803751762 WLJFVLIIIOWESD-VQTJNVASSA-N 430.593 2.264 10 20 IECD CC(C)(C)OC(=O)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804903634 NWMPCBQVZSQIER-AWEZNQCLSA-N 441.475 2.221 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1 805755828 KQLFKJVSWFPOPI-SFHVURJKSA-N 438.528 2.002 10 20 IECD C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771179 SFZRVEFMTFFXKT-QKPAOTATSA-N 425.476 2.397 10 20 IECD Cc1ccccc1[C@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(N)=O 914642912 NLAZPLLPHUWLLK-FQEVSTJZSA-N 426.517 2.362 10 20 IECD O=C(COC(=O)CCCNC(=O)C1CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915423589 RIAXAMLYPJQBJE-UHFFFAOYSA-N 434.448 2.250 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1C 916672259 DYVPIWJBVMZXGO-UHFFFAOYSA-N 446.573 2.434 10 20 IECD COc1ccccc1N1C[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 917706772 PBXMKOFWXBWXSO-QGZVFWFLSA-N 427.476 2.340 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2 918121468 HGZPTVTXKVHRDI-YJBOKZPZSA-N 435.528 2.443 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4ncon4)C3)C2)cc1 1779869135 PNTMAOAJQQDDGA-HSZRJFAPSA-N 435.484 2.234 10 20 IECD Cc1cncc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782004435 DRNKHGFCAUUZCR-OAQYLSRUSA-N 431.876 2.212 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2nc[nH]c12 1796680093 COCVUIGXQWFRGQ-BPQKRJORSA-N 449.467 2.040 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)C1CC1 1813712825 UZJXYSRAMKSVLF-AVRDEDQJSA-N 431.496 2.290 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1)CC2 1828246893 HRRMTGPFAZZYQW-LBPRGKRZSA-N 446.579 2.229 10 20 IECD O=C([C@@H]1CCC(F)(F)C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440900 RMKFPRUZHXPMPR-OAHLLOKOSA-N 430.455 2.418 10 20 IECD Cn1nc(Br)c2c(NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ncnc21 116644830 CLWCUKTUTKPKPS-ZDUSSCGKSA-N 444.337 2.440 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](C(C)C)N3CCOCC3)cc2F)CC1 303312874 PLMZUXKDSLCDRM-JOCHJYFZSA-N 435.588 2.124 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(Cn4cncn4)c3)CC2)cc1 726726831 CJWKHYDUWSDXSC-UHFFFAOYSA-N 434.500 2.059 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3nc4nc(C)cc(C)n4n3)cc2F)CC1 730110816 UPVJYYADSKEYPV-UHFFFAOYSA-N 426.500 2.344 10 20 IECD CNS(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 731038590 GWAMYGWNKJNTAU-UHFFFAOYSA-N 437.587 2.310 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCCCSc3nccs3)C2=O)cc1 733881002 VJYRDAZGMSJSNO-IBGZPJMESA-N 434.543 2.217 10 20 IECD COCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1Cl 734702374 ZMHZKICXEGFYBG-UHFFFAOYSA-N 446.935 2.346 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(-c4cnco4)c3)CC2)cc1 743432488 NJBPVQFASFLOLQ-UHFFFAOYSA-N 449.511 2.227 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCC(=O)N[C@@H](C)c3ccc(F)cc3)CC2)cc1 744389739 YNGFLRRPILBLDB-SFHVURJKSA-N 442.535 2.340 10 20 IECD CC(C)CC(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 749197831 LZLYCMOUFQIPHZ-LJQANCHMSA-N 443.592 2.225 10 20 IECD Cc1cc(C)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(C)c1NS(C)(=O)=O 751191624 ZCXBKJRWNUOZPV-UHFFFAOYSA-N 428.488 2.188 10 20 IECD Cc1c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cnn1-c1ccccn1 751236161 FXWSRWHXUIWFDW-UHFFFAOYSA-N 441.557 2.263 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nn(-c4ccc(F)cc4)cc3O)CC2)cc1 752801521 RJQLLGDHFIAPPL-UHFFFAOYSA-N 439.491 2.278 10 20 IECD CCC1CCC(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)(C(=O)OC)CC1 754064413 PTMNGELZWCPUQR-KWLQHXCVSA-N 433.593 2.280 10 20 IECD COC(=O)C[C@H]1CN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 754067272 NZCVOYVPKQBICT-PZJWPPBQSA-N 439.556 2.345 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 754203014 DEOHBGCFHCXZMP-UHFFFAOYSA-N 448.570 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(F)c(NC(C)=O)c3)CC2)cc1F 754210863 AZKSIPBLWAPQNQ-UHFFFAOYSA-N 432.427 2.219 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](C)CC3(C)OCCO3)CC2)cc1 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435.540 2.379 10 20 IECD CCC(CC)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801874 VFKYWQCXSUITRO-WIYYLYMNSA-N 435.540 2.379 10 20 IECD C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812583 MMRVSEBMEVQYGY-ZFWWWQNUSA-N 431.430 2.468 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3C3CCCC3)cc2)C1 793716424 BMHGRAIMWXAGRU-PZJWPPBQSA-N 426.561 2.186 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cnccn3)cc2F)C[C@@H](C)O1 795920250 WUGAJSJXABBAPN-IYBDPMFKSA-N 430.480 2.022 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 804968511 GRXUJMGJOWLHAB-INMHGKMJSA-N 427.542 2.063 10 20 IECD CC[C@@H](NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1ccncc1 805740160 SLALDFLUDLPLOK-GOSISDBHSA-N 442.516 2.024 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC[S@@](=O)C(C)(C)C 806198184 KSERYMAHKRSJKQ-RUZDIDTESA-N 433.368 2.167 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3c3nc(C)no3)CC2)cc1 806334606 QPZJMHFUAZSVLA-FQEVSTJZSA-N 428.537 2.445 10 20 IECD C[C@@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 808276777 CYKZPFCPEMKUDI-UWJYYQICSA-N 429.517 2.185 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3C[C@H](C)S(=O)(=O)[C@H](C)C3)cc2F)C[C@@H](C)O1 811864541 CMTGVKLOHGPDSK-GEEKYZPCSA-N 427.542 2.156 10 20 IECD CON(C)C(=O)C1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 812871645 XJPHGYJFKXTLSI-UHFFFAOYSA-N 435.480 2.132 10 20 IECD CCOC(=O)N1CCC[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 912901745 PRKNZOQIGRUHMN-IBGZPJMESA-N 432.565 2.192 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1)C1=S=CC=C1 916184763 YSIZOOBTFYKPST-UHFFFAOYSA-N 445.478 2.071 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C(=O)C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 917012774 DHKOWBBOQWXERF-QZTJIDSGSA-N 448.583 2.246 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1Cl 917735757 RXAVBUDZQORDAD-UHFFFAOYSA-N 443.934 2.405 10 20 IECD COC(=O)CCOc1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 917845102 PODPKENBCAYYLL-UHFFFAOYSA-N 434.514 2.148 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1Cl 918466321 ZNLBYXIAZPTAEG-HNNXBMFYSA-N 444.919 2.305 10 20 IECD C[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(N2CCOCC2)cc1 920882154 UDZMKDKXLOPDQR-CQSZACIVSA-N 426.429 2.217 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 1342434905 PLAJVRYZNPXLPS-GJZGRUSLSA-N 438.546 2.026 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)C3(F)CCCCC3)C2)C1 1778212772 LMBXZEWYMUEMHJ-HVPBSWBLSA-N 448.491 2.319 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CCC1)C2 1783222622 FIPCOPDGWFCNJX-OUWGLZAPSA-N 448.491 2.223 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CN)C[C@@H]32)cc1 1790126202 CLNOFMKJEHFXOO-AAEGSUEWSA-N 438.572 2.282 10 20 IECD COc1cc(OC)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796601398 CQWHTUVDOOWHCG-BTTYYORXSA-N 445.447 2.215 10 20 IECD CC[C@@H](NC)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809952756 FYLQWBNHZQFSKC-LJQANCHMSA-N 439.560 2.009 10 20 IECD CN(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708561 HAHJZSHZWMIMFH-LLVKDONJSA-N 438.937 2.385 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 117630419 GGNNMDVIMCRMHP-GJZGRUSLSA-N 435.521 2.277 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)N[C@H](C)CS(=O)(=O)c1ccc(C)cc1 479298405 ZIIWVCRGOKLCOI-OAHLLOKOSA-N 446.550 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)CC(=O)Nc3cc(F)cc(F)c3)CC2)cc1 727435788 ZYGZLOYJLMYSIX-UHFFFAOYSA-N 432.471 2.193 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H]3CN3CCCCC3)CC2)cc1 729606817 JORRXCCMJFYOAG-JOCHJYFZSA-N 429.609 2.477 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C(=O)C4CC4)CC3)cc2F)CC1 730114054 DARYTAOQOWCDKU-UHFFFAOYSA-N 431.556 2.168 10 20 IECD Cc1nc(COc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)no1 731128810 DAUCFNWBLZSQCO-UHFFFAOYSA-N 427.436 2.417 10 20 IECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 734075397 ZKPSZJORCNDVDN-INIZCTEOSA-N 445.541 2.051 10 20 IECD COc1ccc(N(Cc2ccco2)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1F 739631989 SJJYMTSGSYSPIW-UHFFFAOYSA-N 431.445 2.458 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)CC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)c1 749347607 ULIDJKDNFGBBBS-GOSISDBHSA-N 431.558 2.086 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN(C)C[C@H](O)CN3CCOCC3)c2C)cc1 751486129 UHWBZHXSDVKIFZ-NRFANRHFSA-N 429.561 2.300 10 20 IECD COC(=O)c1cccc(N2CC(=O)N(CN3CCN(c4ccc(OC)cc4)CC3)C2=O)c1 759725211 TTYDZYXFUQLWOY-UHFFFAOYSA-N 438.484 2.030 10 20 IECD COc1cc(N2CCN(C(=O)c3cnn(C)c3Br)CC2)cc(OC)c1OC 760454126 KFZZFJFUVMZWDL-UHFFFAOYSA-N 439.310 2.171 10 20 IECD CCCn1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 762414457 LACPCPQGTMUKEJ-UHFFFAOYSA-N 439.438 2.403 10 20 IECD CCOC(=O)c1cnn2c(C(=O)NCc3ccc(N4CCSCC4)cc3)ccnc12 763930559 NOZKYDSJKFKTPR-UHFFFAOYSA-N 425.514 2.389 10 20 IECD Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 764250916 APRJXELAFAETLB-UHFFFAOYSA-N 448.527 2.318 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cnn1CC(C)C 766578439 UFLYRFNNDQPXRQ-UHFFFAOYSA-N 427.549 2.311 10 20 IECD C[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CCOCC1 771060173 WNZJCIFFYRRAKO-PBHICJAKSA-N 444.981 2.109 10 20 IECD Cc1cc(Br)cn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1=O 772900978 NGDRSYGYFGFKHP-UHFFFAOYSA-N 438.297 2.211 10 20 IECD C[C@H](NC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(N(C)C)cc1 773987533 FABJELYIDGGXIC-INIZCTEOSA-N 447.557 2.460 10 20 IECD CCCc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 777127681 HKXLJOXISPYLNW-MRXNPFEDSA-N 443.573 2.361 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-n4ccnc4O)c3)CC2)cc1 778248838 ZGEZPTBMUDFTRM-MDZDMXLPSA-N 447.495 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CC[C@H]3CCCCN3C)CC2)cc1 778287692 CNIGKYRYSXFIDC-ZCPJJFRWSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCNc3ccc(C)cn3)CC2)cc1 778305931 LHKFQPVCPDNKKC-ZHACJKMWSA-N 437.544 2.222 10 20 IECD COCCn1c(NC(=O)c2ccc(C)c(O)c2O)c(NCc2ccccc2)c(O)nc1=O 780921927 XTXZNNGGCRANDU-UHFFFAOYSA-N 440.456 2.179 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1OC 782252002 PWIPVQVLPMKWDP-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CCn1c(=O)nc(O)c2c(C(=O)OCC(=O)c3ccc(O)c(O)c3)cc(C(C)C)nc21 782696015 MDVUVEADXVLEDW-UHFFFAOYSA-N 427.413 2.091 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N2CCOCC2)cc1 785397180 LAQQIVXSKLKGQK-ZWKOTPCHSA-N 448.527 2.159 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccc(F)cc3)N(C)C)CC2)cc1 787641606 UZFGFBNHYNMBGK-JOCHJYFZSA-N 442.535 2.292 10 20 IECD COc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 787871185 HWLIYOGCDTWCSK-QGZVFWFLSA-N 443.519 2.425 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)N1CCC(F)(F)CC1 789951311 VJLVRIHNTKSMRE-UHFFFAOYSA-N 435.393 2.416 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNS(=O)(=O)c1c[nH]c2ncccc12 791309288 WIGPGZWIYKIAMI-UHFFFAOYSA-N 441.557 2.490 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(CC(=O)N(C)C)CC3)cc2Cl)C1 800719812 NVMMVLMAGACATF-QGZVFWFLSA-N 436.000 2.492 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC(C)(C)O1 803448486 ATBBVSQEYFDEIX-CQSZACIVSA-N 425.476 2.399 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H]1Oc1ccccc1 803687339 CAOAEJYNLXTWKK-MZYLBHOOSA-N 437.540 2.426 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1F 804851980 VUFIHOGEBMVZLQ-FCHUYYIVSA-N 448.583 2.172 10 20 IECD CC(C)c1ccnc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)n1 806280834 WKXNSJWANULZED-UHFFFAOYSA-N 434.591 2.004 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CSCCS1 806477772 LLXNPFDQDDHAQZ-ZDUSSCGKSA-N 433.393 2.468 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCC1(CN2CCOCC2)CCCCC1 807287911 ODHIEXWXPFAXGP-UHFFFAOYSA-N 440.588 2.078 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O 808569150 ZLANJBDKESZJDN-IBGZPJMESA-N 442.466 2.103 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 808582141 UMOLXLARPCPMHN-IBGZPJMESA-N 428.920 2.252 10 20 IECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(C(=O)OC)cc3)cs2)cn1C 914789634 OHRARWKAPPAMAU-UHFFFAOYSA-N 434.499 2.096 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCC3(N4CCOCC4)CCCCC3)CC2)cc1 1322949406 NJJJGPMLJRHRDX-UHFFFAOYSA-N 444.620 2.359 10 20 IECD CC(C)Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1781916778 ZKWGFEVJMQEUET-DEOSSOPVSA-N 439.512 2.449 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)n1)C1=NN(c2ccccc2)C(=O)C1 1798754519 MHIGLGHQWFKXKK-ACHSLPGTSA-N 435.459 2.265 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnnc(Cl)c1 1804283959 RHINVNNKFQHVLD-BPQKRJORSA-N 444.875 2.212 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990395 HBWWZEFFFKUEBX-YCRPNKLZSA-N 434.452 2.227 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)C(F)F)CC2)c1cc(O)nc(O)c1 1816720367 NVCMUABJEYJUGM-ZETCQYMHSA-N 434.371 2.076 10 20 IECD CC[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)N(CC)CC 1843440805 BTMVMABAWLWVQP-FQEVSTJZSA-N 439.560 2.103 10 20 IECD CC(C)CCC(=O)NCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 110744306 OJSOFSIZGTXHNT-UHFFFAOYSA-N 436.464 2.496 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 734701535 CYCINLKCZLMSMD-UHFFFAOYSA-N 446.573 2.393 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 745777520 QLDFKAJEWUMDHF-AWEZNQCLSA-N 434.356 2.110 10 20 IECD CN1CCCc2cc(CNC(=O)CCS(=O)(=O)c3ccc4c(c3)OCCO4)ccc21 746811872 QFVQHNPVTMJZFL-UHFFFAOYSA-N 430.526 2.320 10 20 IECD C[C@@H]([C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOCC1 751060641 IEJTZNJSMJIGFM-KGLIPLIRSA-N 439.559 2.094 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C)c(C(=O)N(C)C)c3)CC2)cc1 751818275 OBZWUAVJIHXWBY-UHFFFAOYSA-N 438.528 2.429 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2OC)cc1 752097258 PCMMWHPASYFHLW-UHFFFAOYSA-N 426.517 2.498 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@]4(C[C@@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 756937753 CQARKGDPORRULX-MRSFGVLCSA-N 442.560 2.481 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 758211354 UEWMJXSAYGGDAA-HXUWFJFHSA-N 438.488 2.045 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)OCc3ccccc3)CC2)cc(OC)c1OC 759406350 RWSAIPKMCNEQAG-UHFFFAOYSA-N 443.500 2.287 10 20 IECD CC(C)(C)OC(=O)NC1CCN(CC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 769142750 FOIFHLAXZIXLQD-UHFFFAOYSA-N 432.565 2.129 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1 771054951 WRFORQWBRFLQRB-CRAIPNDOSA-N 443.997 2.188 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1 774369510 HQKAFUKNIQYEHI-UHFFFAOYSA-N 433.464 2.325 10 20 IECD COc1ncnc(N(C)C)c1NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 775139213 SGCLFKBPRXDXJI-UHFFFAOYSA-N 425.445 2.017 10 20 IECD COc1ccc(O)c(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1 775668121 RIANMORBIPMGQT-UHFFFAOYSA-N 434.514 2.069 10 20 IECD COCCCOCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775922663 BYNALGUCFXQSGP-AWEZNQCLSA-N 425.437 2.385 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1Br 778685212 HPDNUADZNXAKOY-UHFFFAOYSA-N 439.262 2.175 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 779486237 SUHXSEHDDJCOMX-LEWJYISDSA-N 441.553 2.216 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)[C@H](C)O)cc1 779498065 HOOGWKDAHPEPPG-JTSKRJEESA-N 445.585 2.280 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 782773961 OTSXBVXROVITLL-UHFFFAOYSA-N 449.847 2.194 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1 785304208 NNTJEBTYKJGSBS-INIZCTEOSA-N 439.512 2.339 10 20 IECD C[C@@H]1CCCN(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 787674438 FFHZHMSPPMUUTL-MRXNPFEDSA-N 438.519 2.221 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 787706966 PQNGIVUHKRGWEM-BGYRXZFFSA-N 430.593 2.218 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cccc(OC)c3OC)CC2)cc1 787924516 GZTIGGQVEKATCF-UHFFFAOYSA-N 441.528 2.156 10 20 IECD C[C@H]1CCCC[C@H]1OCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787985248 AXVNZEYKUHKQDG-HRAATJIYSA-N 435.540 2.115 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788938401 RMYHUDBVZXVEMM-UHFFFAOYSA-N 436.556 2.398 10 20 IECD O=C(CCOCC(F)(F)C(F)(F)F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 790366881 JNONSYRXINVWFU-UHFFFAOYSA-N 444.422 2.142 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(Cc3cccs3)C3CC3)cc2)C1 793733084 KPVFPNYVTDSVQX-QGZVFWFLSA-N 440.569 2.257 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCCC3=O)cc2)cc1F 793917511 HSOLHVQXIMQJDR-UHFFFAOYSA-N 426.492 2.341 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 804266426 CFWFZURTNDCUHS-IBGZPJMESA-N 428.533 2.195 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCCCSc2nccs2)C1 806282052 GHYPHGQXTGREDO-ZIAGYGMSSA-N 428.580 2.115 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3c(C)c(C(F)(F)F)nn3C)CC2)cc1 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CC[C@H](NC)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809958183 CUEAOXPBPJEZBI-JKNJVXJCSA-N 431.533 2.046 10 20 IECD CN(C)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814550175 ABRLWUVZWOZRGC-NSHDSACASA-N 438.937 2.385 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cocn1 1816602447 YFWPNMKCAUUJSN-GOSISDBHSA-N 447.455 2.497 10 20 IECD O=C(/C=C/c1cnccn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429406 VEPDCCNLTACGHJ-VZSQWMKGSA-N 437.500 2.230 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=COCC1)CC2 1828200191 MLKKUHTZVLPXNQ-NHEDYWLLSA-N 443.481 2.190 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(CO)o2)CC1 1829268720 JSVIHHWEUHIZPY-KRWDZBQOSA-N 429.473 2.125 10 20 IECD COc1ccccc1CC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846063105 MFPOPLSCXRDVPA-CSKARUKUSA-N 438.480 2.271 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C(N)=O)c(Cl)c3)CC2)cc1 726725814 JMDSZZIUZVVVSY-UHFFFAOYSA-N 430.892 2.171 10 20 IECD COC(=O)CN(CC(=O)NC(=O)Nc1ccc(OC)cc1)Cc1cc(Cl)ccc1O 731846627 OHVDOJJGPAMCGZ-UHFFFAOYSA-N 435.864 2.378 10 20 IECD COC(=O)[C@@H]1CC12CCN(CC(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CC2 733795629 FAYCZVGXCDNIHE-LMMKCTJWSA-N 447.551 2.331 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(S(N)(=O)=O)ccc1Br 734467810 FXYSFNHZYNPTBW-UHFFFAOYSA-N 426.336 2.401 10 20 IECD CN(CCN1CCN(c2ccccc2)CC1)C(=O)NCc1ccc(N2CCOCC2)cc1 738990690 USUWUUQATLWLQK-UHFFFAOYSA-N 437.588 2.487 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N(CC)[C@@H]1CCS(=O)(=O)C1 743870900 GKWLZYZBMVCWFD-CZUORRHYSA-N 447.395 2.401 10 20 IECD Cc1noc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)n1 747300640 JHPAPLQSUAFXTQ-QZTJIDSGSA-N 426.521 2.169 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(NS(C)(=O)=O)c3)CC2)cc1 747545255 AOVRUJDTQYKYNT-UHFFFAOYSA-N 434.518 2.429 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)C1 750875977 XDIMIRNFSHWQGB-PZJWPPBQSA-N 437.606 2.322 10 20 IECD COC(=O)c1c(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n[nH]c1C 751065146 UJVNFFHAKIDVGI-UHFFFAOYSA-N 444.460 2.053 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccccc4F)CC3)CC2)cc1F 753856739 FWADXLZWVIFPGY-UHFFFAOYSA-N 430.499 2.444 10 20 IECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754948694 YECUPEIBAASDMZ-LBPRGKRZSA-N 443.401 2.473 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc4nc(O)n(C)c4c3)CC2)cc(OC)c1OC 759403722 FBWLDLWMXNXIFY-UHFFFAOYSA-N 426.473 2.267 10 20 IECD COc1cc(N2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 760084149 KYCKTCAHGIQBBV-UHFFFAOYSA-N 430.461 2.381 10 20 IECD Cc1cc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n(C)n1 769704471 BDQDCECRZIPAKV-UHFFFAOYSA-N 431.430 2.395 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)c4c(C)nn(C)c4C)n3)CC2)cc1 771069535 WNHOWXPPXUFRPH-OAHLLOKOSA-N 438.532 2.472 10 20 IECD CN1CCN(c2ccc(/C=C3/SC(=S)N(CCCN4CCOCC4)C3=O)cc2)CC1 771514612 RPEVYGUWWBOHKW-LVZFUZTISA-N 446.642 2.362 10 20 IECD COCCN(Cc1ccco1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778230551 CODKGZXYZJKGNE-KTKRTIGZSA-N 427.501 2.168 10 20 IECD CCn1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 781417920 DYFUPDHVQVIUQS-IYBDPMFKSA-N 432.496 2.058 10 20 IECD COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781440121 BAKBPCCSXUYKTE-UHFFFAOYSA-N 449.866 2.357 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1CN1CC[C@H](O)C1 781797101 YWLCNXYASRSHSH-NRFANRHFSA-N 442.535 2.228 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 785298019 UACIBLDDMABFEH-XJKSGUPXSA-N 432.448 2.481 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2)CC1 786259394 NTJQWWFHSGLEDB-LJQANCHMSA-N 438.503 2.164 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccn(Cc4ccccc4)c3=O)cc2)CC1 786655705 HOGTUZDXMWXFAR-UHFFFAOYSA-N 444.535 2.495 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C4CCOCC4)C3)cc2F)C[C@@H](C)O1 789823727 FNHNKYDVDSQORR-HLIPFELVSA-N 447.551 2.331 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 790912163 OABJHQUWORDKDE-MSOLQXFVSA-N 442.516 2.166 10 20 IECD CC(C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)N1CCCC1 794405655 YUQMNEUXSOUVGT-UHFFFAOYSA-N 437.543 2.385 10 20 IECD COc1ccc(N2CCN(CCN[C@H](C)c3cc(S(N)(=O)=O)c(C)cc3C)CC2)cc1 794806653 UHJIBVFWCKLVMQ-LJQANCHMSA-N 446.617 2.432 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCN(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803298019 MQGCZIYCSADXSP-HXUWFJFHSA-N 436.556 2.439 10 20 IECD C[C@H](NC(=O)C(=O)NCCCOc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803310596 MBEQOMXCCVAYNC-KRWDZBQOSA-N 429.492 2.425 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCCN2CCOC(C)(C)C2)cc1)C1CCCCC1 803676385 GZYZDZSRUACMOO-UHFFFAOYSA-N 430.593 2.299 10 20 IECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCc2ccccc21 803910212 UUFMPCUYWOLFEB-WIYYLYMNSA-N 437.540 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOc4cc(O)ccc4C3)CC2)cc1 804567126 IROMTNZOZMRYAY-CMDGGOBGSA-N 437.496 2.027 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CC(C)(C)CN2CCOCC2)cc1F 804854089 XQZJXBCCEUIUAJ-UHFFFAOYSA-N 436.572 2.105 10 20 IECD O=C(N[C@H]1CCOC1)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806513008 WYTRTKLLRRGBQY-FPOVZHCZSA-N 446.548 2.102 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc21 807385225 FTZBGJRCCIIAJR-UHFFFAOYSA-N 432.274 2.319 10 20 IECD CCN(CCOCCO)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807953572 VDCZRFXUFNRUIS-INIZCTEOSA-N 425.957 2.050 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C[C@@H](C)O)c3ccccc3)CC2)cc1 809460197 STUJBIJBHGTYOE-TZIWHRDSSA-N 439.556 2.405 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(S(=O)(=O)NC2CC2)c1 919968781 KDYZBTAFYHGATD-UHFFFAOYSA-N 443.569 2.266 10 20 IECD O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971110 ONYJXMHNXJZZDX-UHFFFAOYSA-N 427.476 2.367 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCc4c3cccc4S(C)(=O)=O)CC2)cc1 1320009701 KVBUWFGGKFAJMO-UHFFFAOYSA-N 443.569 2.200 10 20 IECD Cc1c[nH]cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827788669 KCDFHAZGSAHGGJ-KRWDZBQOSA-N 448.614 2.417 10 20 IECD CC[C@@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1842620884 HFXAIJPGEFFPHP-MRXNPFEDSA-N 431.583 2.244 10 20 IECD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056281 ZOFQFKXBYXACJI-AWEZNQCLSA-N 449.573 2.068 10 20 IECD CC(=O)N1C[C@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)Oc2ccccc21 7077669 KVLCXSDCGPEWKO-OAQYLSRUSA-N 425.485 2.068 10 20 IECD COc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cn1 16699167 YWNQCMHYOSUCEH-UHFFFAOYSA-N 443.481 2.185 10 20 IECD CCc1cc(N2CCC[C@H](NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2)ncn1 568548142 WYXFTBODHAWHCE-SFHVURJKSA-N 434.544 2.241 10 20 IECD CC(C)N(C)CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 726194606 MYBGGWPZVGSDAD-UHFFFAOYSA-N 436.490 2.171 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2c(C)n[nH]c2n1 727002921 UQFRJBXNWCILIV-UHFFFAOYSA-N 441.463 2.024 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 728302616 VUEKTDCCEBCPFG-UXHICEINSA-N 427.526 2.186 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cc(F)cc(S(N)(=O)=O)c1 737116345 CCRVLOYXCAKFEX-UHFFFAOYSA-N 448.520 2.061 10 20 IECD CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 741181655 AOWIQARFCGEAQN-UXHICEINSA-N 443.592 2.082 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 743809483 UINDRUSGLCALPJ-GNTOHDJUSA-N 433.302 2.310 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3CN3CCOCC3)CC2)cc1 746175943 YHGLHMIRRJKYIV-UHFFFAOYSA-N 438.572 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3csc([C@H](C)OC)n3)CC2)cc1 747850473 DAEFZJHWTPOYQI-PEGYKEAPSA-N 437.587 2.457 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNS(=O)(=O)c1ccc(Cl)s1 749838960 UGMFBUQPTBZMSJ-UHFFFAOYSA-N 443.978 2.175 10 20 IECD COc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(F)c1 751212994 IXZQMHXEFVRRDH-UHFFFAOYSA-N 432.470 2.009 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c([N+](=O)[O-])c1 751240618 UEVNUHSRLAYDAO-UHFFFAOYSA-N 435.502 2.291 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](N(C)Cc4ccccc4)C3)CC2)cc1 754050244 IYBNASFUZDYPNY-RPBOFIJWSA-N 438.616 2.384 10 20 IECD COc1cccc(OC)c1OC[C@H](O)COc1ccc(N2CCN(C(C)=O)CC2)cc1 755302506 CYZKRROARLVTJA-LJQANCHMSA-N 430.501 2.191 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc(OC)c1OC 759099421 ATBDRAIILCIYTE-UHFFFAOYSA-N 449.529 2.182 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)(F)F)CC3)cc2F)C[C@@H](C)O1 760984507 PAMVBOWJPQIYQP-GASCZTMLSA-N 447.473 2.445 10 20 IECD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 763280049 PYXKABAXDUPLIF-PBHICJAKSA-N 438.571 2.245 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC(C)(C)CNC(=O)OC(C)(C)C)CC2)cc1 769082781 NAQSXQZDGJSPMH-UHFFFAOYSA-N 449.596 2.420 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)c1O 776045600 RQBQMQUERNQLHV-UHFFFAOYSA-N 439.262 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc(C)c4ccccc4n3)CC2)cc1 778253395 FPNFRGUVQBAGSV-QXMHVHEDSA-N 445.523 2.468 10 20 IECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1ccccc1Cn1cncn1 781396940 VFJNPUAGYGYZIP-UHFFFAOYSA-N 429.571 2.358 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C3CCCC3)C3CC3)CC2)cc1 785529094 LFNDCFIKLPSTOQ-UHFFFAOYSA-N 428.577 2.257 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@]1(N(C)C)CCSC1 788252465 OZYSDFMORZXBEQ-SFHVURJKSA-N 444.395 2.057 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3nnnc3CCCc3ccccc3)CC2)cc1 788433486 BDWDSZKONVDXJW-QFIPXVFZSA-N 436.560 2.040 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCN1C(=O)CN(C)C1=O 791249127 CVMRAXQSLDJDRX-UHFFFAOYSA-N 432.521 2.049 10 20 IECD Cc1cc(C)cc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793716270 AGNJHXBVOLBUDK-UYAOXDASSA-N 436.556 2.499 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccc(N(C)C)cc1 803132133 WJTLDFVZSJGYNZ-MOPGFXCFSA-N 438.572 2.467 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 803747395 QWCCAMKXKMXMOS-XUVXKRRUSA-N 428.577 2.018 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3C[C@H](C)[C@H]3c3ccccc3)CC2)cc1 803751853 XFDZOBKWXHYDMI-CVDCTZTESA-N 436.556 2.153 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 804843673 RURNANYVQNVOSE-ZDUSSCGKSA-N 426.514 2.415 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCOc3ccccc3)cc2F)CC1 805007945 VTQATDNUENZVQV-UHFFFAOYSA-N 442.535 2.121 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1 807100164 KZPZUMYIVCZMOE-WMZHIEFXSA-N 438.572 2.083 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1N1CCNC1=O 807386712 GBFUSMRKBQOMSU-UHFFFAOYSA-N 447.289 2.248 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1 807911845 CCKZRNWXHIMLSK-GOSISDBHSA-N 427.524 2.420 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1 808229083 ZPNVFLVOGDVEIL-KRWDZBQOSA-N 442.482 2.161 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@@H](c1cccnc1)C1CC1 808292646 LWNLBCGGHXCAGU-XMMPIXPASA-N 447.583 2.497 10 20 IECD C[C@H](OC(=O)C[C@@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808689702 GOQGFXIOFHCGPX-KBPBESRZSA-N 434.448 2.391 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(OC)nc3OC)cc2F)CC1 811971929 JINSKCFRKCWFEY-UHFFFAOYSA-N 431.512 2.379 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cccc(S(N)(=O)=O)c3)cc2F)C[C@H](C)O1 917998580 LPXIZBPLVIEMAI-KBPBESRZSA-N 436.509 2.408 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCNc2ccc(C(F)(F)F)cn2)c1 919813031 RNOYERDUEHDEDC-UHFFFAOYSA-N 432.424 2.410 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1C(=O)N1CCCC1 920194833 JLPGZNKSQDPHCQ-UHFFFAOYSA-N 436.512 2.014 10 20 IECD CCCS(=O)(=O)CC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 920631373 ZBPDQWVUOBGGDH-ZDUSSCGKSA-N 443.477 2.157 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 1324158265 JQSXXOMKCDFEJV-KRWDZBQOSA-N 447.557 2.078 10 20 IECD C/C=C/C=C\C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1781734617 BFQRTVZBRQKOST-SMOHMGIOSA-N 442.512 2.463 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cncnc2)C3)cc1 1799620557 RNUQDGZOTWNIJG-IUTQVRIDSA-N 445.523 2.401 10 20 IECD CC(=O)O[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C(C)C 1804286336 QVSRVEYFPQYHPY-IUIMINKPSA-N 446.500 2.043 10 20 IECD COc1ccc2c(CC(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c[nH]c2c1 1843248767 LWQYSWOCFMDZQS-UHFFFAOYSA-N 436.468 2.042 10 20 IECD COc1cc2c(cc1NCC(=O)NC(=O)N[C@H]1CCS(=O)(=O)C1)oc1ccccc12 11619435 FHBZYNQIDAYAQB-LBPRGKRZSA-N 431.470 2.019 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c(OC)c1OC 559720608 ZABBDKNQIDAALV-UHFFFAOYSA-N 425.485 2.445 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCn3c(=O)n(C)c4ccccc43)cc2F)CC1 730194426 HWUBKSHAASZYCO-UHFFFAOYSA-N 439.535 2.328 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2F)CC1 730194732 OISHJGYLZZSIDN-UHFFFAOYSA-N 448.564 2.148 10 20 IECD COc1ccc(N2CCN(CCCNc3cc(N4CCC[C@H](CO)C4)ncn3)CC2)cc1 731919533 UPNSHROWYVWYCA-FQEVSTJZSA-N 440.592 2.318 10 20 IECD CCc1nsc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 743552963 BMQJUVYJLFYHEN-UHFFFAOYSA-N 448.568 2.498 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)cc1 748834735 GUSKTEYHASRKRS-UHFFFAOYSA-N 426.536 2.285 10 20 IECD O=C1NCCc2ccc(S(=O)(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc21 751371904 MBWVAIYFEIBVMN-QGZVFWFLSA-N 449.960 2.274 10 20 IECD C[C@@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCSCC1 759811961 QFPMRKIJXYSSJN-AWEZNQCLSA-N 438.505 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3-c3cc(C)ccn3)CC2)cc1F 760256565 ONHAJPRVZCMWNW-UHFFFAOYSA-N 438.463 2.011 10 20 IECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc(Cl)c1F 761259210 KLGLVHDIKYXNAH-UHFFFAOYSA-N 428.869 2.492 10 20 IECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)NCc3cccc(Br)c3O)c2)CN1 765927379 QRBVDLYIQXQWIK-CYBMUJFWSA-N 432.274 2.013 10 20 IECD CC(=O)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC12CCCCC2 766249741 PXJPECPPLNEHPW-UHFFFAOYSA-N 446.567 2.146 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@]4(CCSC4)C3)cc2)C1 769035817 BXRINAQIVQCPAD-FGSXEWAUSA-N 432.590 2.242 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 770022204 BGRMVIZBPIIDEX-UHFFFAOYSA-N 429.542 2.047 10 20 IECD CCN(CC)C(=O)CCCc1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771057614 QWLMJTMXYSMUGD-UHFFFAOYSA-N 443.548 2.161 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(Cl)sc1S(N)(=O)=O 773726140 OUBRZOHRIJKLDU-UHFFFAOYSA-N 429.951 2.158 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1 775373272 QKGQXJAYNLUWIE-CQSZACIVSA-N 446.529 2.161 10 20 IECD O=C(N[C@@H]1CCC[C@H]1CCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 779354505 BKTLOWQLIHUNNV-SCLBCKFNSA-N 449.485 2.382 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 781481232 CNTVWKZEDBHUKW-UHFFFAOYSA-N 441.484 2.214 10 20 IECD CN(CCOc1cccc(Cl)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318909 JICRYEYPKQIWAR-UHFFFAOYSA-N 431.920 2.330 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC[C@@H]3c3ccco3)cc2F)C[C@@H](C)O1 789828701 YEEWETBRVFOZKB-JXXFODFXSA-N 445.491 2.249 10 20 IECD CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451550 OSYVRNYGMWFVDI-KURKYZTESA-N 437.487 2.303 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(c2ncnc3sccc23)CC1 807291800 OJHZDRUGIKJSAZ-UHFFFAOYSA-N 448.552 2.033 10 20 IECD CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807512753 HRKIGZBDXNFZJI-UHFFFAOYSA-N 431.297 2.499 10 20 IECD COCC1(O)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 807954513 UPFYWOJVDVNEOC-MRXNPFEDSA-N 437.968 2.192 10 20 IECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 808357531 JNUFNTHOLYAOEK-FBBABVLZSA-N 432.540 2.233 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(N(C)C)cc1 808568417 KGDIMINVFMXXRU-SCLBCKFNSA-N 430.455 2.130 10 20 IECD COc1cccc(CNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c1O 812501080 ORJFXTZNEIKCJS-UHFFFAOYSA-N 429.539 2.067 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NCCc2ccc(O)c(O)c2)cc1 917371523 BJJDJZHYHVLCSL-LJQANCHMSA-N 446.525 2.203 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1 918428977 GHRWQOODGRTXNE-UHFFFAOYSA-N 432.546 2.038 10 20 IECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(N3CCSCC3)cc2)C1=O 918617771 FFSJTXKGWJARNP-QHCPKHFHSA-N 438.553 2.323 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920866004 RRPMNTRWUGDXAX-INIZCTEOSA-N 434.514 2.115 10 20 IECD Cc1noc(C)c1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794148289 HVEWOHITKMDBKH-BJKLQHCMSA-N 441.484 2.302 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)ccc1C 1804335772 KSNFBLSJFUBLMI-MUJYYYPQSA-N 447.582 2.116 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCCn2cccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997806 DRFAYHJDWHWDRN-MBSDFSHPSA-N 449.511 2.489 10 20 IECD Cc1noc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722402 ZMZBSWMCXUDDAI-NSHDSACASA-N 429.458 2.094 10 20 IECD CCc1noc(C)c1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441569 GNAFKYCCRITATR-UHFFFAOYSA-N 435.484 2.155 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n[nH]1 1843442734 WYFNCFSKWDQBCR-UHFFFAOYSA-N 434.500 2.143 10 20 IECD O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)N[C@@H]1CCS(=O)(=O)C1 11643490 JFSLAOAIZXSVCC-IAGOWNOFSA-N 435.571 2.125 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)N2CCOCC2)o1 520766487 BXMPVNVPOPTFQV-NRFANRHFSA-N 438.528 2.194 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)CCN4C(C)=O)CC2)cc1 726726481 SHQYMILZSCTZFN-UHFFFAOYSA-N 436.512 2.328 10 20 IECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 731283583 DBYVKXPTKSCDIC-PKOBYXMFSA-N 433.572 2.414 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 735196510 XJDBZUQUFXEZLN-SSEXGKCCSA-N 435.521 2.042 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(O[C@H]4CCOC4)CC3)cc2F)CC1 748627920 PVEFRSRZIPVFAI-FQEVSTJZSA-N 434.556 2.447 10 20 IECD C[C@H](CC(N)=O)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 748718255 HOQHCJCYNFAKQX-JBBGTMGVSA-N 442.360 2.030 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc([S@](C)=O)cc3)CC2)cc1 749565028 RWDWWPMPDXHDPK-HKBQPEDESA-N 444.601 2.396 10 20 IECD COC(=O)c1c(F)ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1F 754040579 RNUITILSAZTLAK-UHFFFAOYSA-N 444.431 2.410 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4cccc(F)c4)CC3)CC2)cc1 754097627 KIKLZJIQALVUSG-DEOSSOPVSA-N 442.579 2.135 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C4CC4)n(CC)n3)cc2F)CC1 759034398 YXEOAPWXSNUAMI-UHFFFAOYSA-N 442.539 2.316 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccn(Cc4ccccc4)n3)CC2)cc1F 759039758 OKBRMVBHPMQZFB-UHFFFAOYSA-N 437.475 2.366 10 20 IECD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 765727868 QGCYVPUADPAPEY-LBPRGKRZSA-N 431.283 2.227 10 20 IECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769857293 FXYQDVZSMFQKAX-RYUDHWBXSA-N 446.572 2.148 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771056704 GQMLPUYRGWBNNW-GOSISDBHSA-N 437.949 2.229 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 773744420 BHWXOHOPRBWWRR-SNVBAGLBSA-N 426.441 2.178 10 20 IECD Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773858556 QYOYZTINZCSEOA-QGZVFWFLSA-N 438.528 2.349 10 20 IECD COCCn1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 782425012 MVZVQKRIISKKQX-UHFFFAOYSA-N 425.489 2.356 10 20 IECD Cc1cc(F)ccc1-n1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 783570301 AGXFEAMNAUPRDE-UHFFFAOYSA-N 442.516 2.485 10 20 IECD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 789168611 KMGYMJPNSVGHKV-PKOBYXMFSA-N 442.560 2.262 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@H]1CCCN1C1CCCCC1 789799570 JSRGNLHBXHZTIP-HXUWFJFHSA-N 446.567 2.192 10 20 IECD CC[C@@H](CN1CCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789815896 BIPPXZUAHHSJKQ-SCTDSRPQSA-N 434.556 2.046 10 20 IECD CN(CCN(C)c1ccccc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855668 VRFGBUZOWNWCFF-UHFFFAOYSA-N 426.586 2.451 10 20 IECD C[C@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789948453 AVCSLXYLUNFZHQ-CQSZACIVSA-N 445.507 2.370 10 20 IECD COCn1nc(C)c(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 790012765 IZDFUQNTMGDBMW-KBPBESRZSA-N 440.541 2.335 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC4(CCC4)[C@@H]3[C@H]3CCCO3)CC2)cc1 794085993 JFJBGINBIOTJHE-BDFGNOQBSA-N 439.556 2.460 10 20 IECD COc1ccc(CNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)c(O)c1 794388645 YYIKWGYSRYSDMA-UHFFFAOYSA-N 443.319 2.100 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c(Br)c1 802721076 SODZRHAPXXFOEN-UHFFFAOYSA-N 434.289 2.382 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(O[C@H]2CCOC2)c1 803660934 JPSMJPKEEWPSIM-SFHVURJKSA-N 429.492 2.300 10 20 IECD CCOCCN1CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803678031 WUYMZPUWEFCYDP-UHFFFAOYSA-N 430.593 2.252 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN3c4ccccc4C[C@H]3C)CC2)cc1 803976266 YJWZGUGLKXTUHS-GOSISDBHSA-N 436.556 2.348 10 20 IECD O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809494015 XZIWXQPZGWIFDK-JBYIUTFZSA-N 434.558 2.071 10 20 IECD CNS(=O)(=O)c1ccc(-c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)o2)cc1 810200357 WNUYLSXBIPGUHM-RIYZIHGNSA-N 438.508 2.141 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F 810350929 APOIKVPBZFBKBJ-UHFFFAOYSA-N 434.443 2.093 10 20 IECD COC(=O)Cc1occ(C)c1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 811045239 KNPRUBWXBVZUBU-UHFFFAOYSA-N 432.473 2.292 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1S(=O)(=O)N(C)C 915778391 JWWOACBBZSHZCX-UHFFFAOYSA-N 444.557 2.100 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCCN3C(=O)NC4(CCCC4)C3=O)CC2)cc1 918006962 PYPZXWZHRVEAPA-UHFFFAOYSA-N 443.548 2.172 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(S(C)(=O)=O)ccc3F)CC2)cc1 918148148 XJWHQNUJDTUHNO-UHFFFAOYSA-N 449.548 2.180 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4c(cc3Cl)NC(=O)C4)cc2)C1 1318861154 ZKOCNDZKJBWXOU-CQSZACIVSA-N 426.904 2.466 10 20 IECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)o1 1319477136 CPWQGYCTNVWCII-UHFFFAOYSA-N 439.447 2.252 10 20 IECD CN1CCN(c2ccc(CNCc3ccc(C(=O)N4CCOCC4)cc3)cc2F)CC1 1323475025 FZOPQAJTHDYTEA-UHFFFAOYSA-N 426.536 2.340 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cn(C)cn2)cc1 1794903524 SWJUROPCNIOCLP-JHDGKUDLSA-N 447.539 2.345 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1 1814165211 CQUDTPJTMGOMJV-YDIIOFBBSA-N 441.459 2.420 10 20 IECD Cc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816720933 CPYFGJYHOAGIQW-SNVBAGLBSA-N 431.499 2.254 10 20 IECD COC1(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CCC1 1823071157 IMAZUGPUWNAQGA-HNNXBMFYSA-N 429.477 2.481 10 20 IECD CNCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708563 HEBMXQZPZPCCBD-LLVKDONJSA-N 438.937 2.433 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)CC1 1828369359 WIGYFDVFNPNOGJ-XZBNEWPCSA-N 444.528 2.207 10 20 IECD O=C(c1ccc(F)s1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441282 LCBNZBATJZVBDO-UHFFFAOYSA-N 426.473 2.497 10 20 IECD Nc1c(C(=O)OCC(=O)NC(=O)NC2CCCCC2)ccc2c1C(=O)c1ccccc1C2=O 10959269 GMLMPKSNBOILHX-UHFFFAOYSA-N 449.463 2.360 10 20 IECD COc1ccc(O)c(CNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)c1 734016993 VBBCSALRRBXVGJ-UHFFFAOYSA-N 443.319 2.100 10 20 IECD COc1ccncc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 748466035 LYURMBVYJYYJTL-UHFFFAOYSA-N 438.406 2.201 10 20 IECD Cc1c(C(=O)N(Cc2ccco2)Cc2ccccc2O)cnc2c1c(=O)n(C)c(=O)n2C 749238622 AWBQXJHKLDAUIE-UHFFFAOYSA-N 434.452 2.082 10 20 IECD C[C@@H](NC(=O)NCc1ccc2c(c1)CCS2(=O)=O)c1ccc(N2CCOCC2)cc1 757652733 TUKUNGQTGQBECX-MRXNPFEDSA-N 429.542 2.413 10 20 IECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NCc1ccc(CN2CCOCC2)cc1 759588018 GZKIZKDBOGDRHP-LKUPDRCFSA-N 440.496 2.191 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](C)S(=O)(=O)CC1 760000741 XEUCASSCSPSREP-HUUCEWRRSA-N 440.521 2.298 10 20 IECD COc1cc(N2CCN(C(=O)c3cc4c(nc3O)CCCC4=O)CC2)cc(OC)c1OC 760083152 BRJYRESZTKTCQH-UHFFFAOYSA-N 441.484 2.294 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 764255327 QASRBOQSABDLBG-UHFFFAOYSA-N 427.526 2.210 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@]4(CCSC4)C3)cc2)C1 769035818 BXRINAQIVQCPAD-HMFYCAOWSA-N 432.590 2.242 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O 773769192 QLXYUCKIRNOOME-MQJDWESPSA-N 449.866 2.405 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccnc1 774131866 YJCSSUCWJUFURJ-AWEZNQCLSA-N 436.434 2.431 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCC1(N2CCOCC2)CCCCC1 774843422 VGHCOTGHCCPKAT-UHFFFAOYSA-N 428.577 2.054 10 20 IECD CN1CCN(c2ccc(CN3CCN(CCNC(=O)c4ccccc4F)CC3)cc2)CC1 775682475 XVMDGKSJIYXFQI-UHFFFAOYSA-N 439.579 2.125 10 20 IECD CC[C@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 776040029 ZNYMIHFMZPJWEX-MAUKXSAKSA-N 440.548 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@@H](c4ccco4)C3)CC2)cc1 778319413 WTMMMXCMAUAMNH-HEDKFQSOSA-N 425.485 2.093 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)cc1 779500256 OBOLXIJCJGTZAP-LAUBAEHRSA-N 433.574 2.185 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)on1 781277784 XBBSXFRXVCNIIW-UHFFFAOYSA-N 434.360 2.032 10 20 IECD CNC(=O)[C@@H]1CN(C(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)c2ccccc2O1 784060608 GNLHOTMLPRAQHR-NRFANRHFSA-N 436.512 2.475 10 20 IECD C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(N2CCOCC2)cc1 784244683 DJDSRQFRLJPSFL-AVRDEDQJSA-N 437.544 2.470 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c(C)c2)CC1 785293664 HRSFQXCBAOTSLD-KRWDZBQOSA-N 440.544 2.234 10 20 IECD Cc1cc(NC(=O)COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)no1 785414428 WTQOVMIPVLVYEE-UHFFFAOYSA-N 437.455 2.346 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)Cc3cccc(F)c3)CC2)cc1 785528796 RPCAYGIOFKOMGD-UHFFFAOYSA-N 442.535 2.121 10 20 IECD O=C(NCc1ccnc(N2CCCC2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786503721 HYEMCOZNDLDFEV-FQEVSTJZSA-N 438.528 2.211 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(N2CCOCC2)c1 787191139 PBPTZSQSGFCWPU-UHFFFAOYSA-N 439.560 2.038 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccc(N(C)C)nc1 787632643 FHYNBSZBDBTJDQ-UHFFFAOYSA-N 435.322 2.281 10 20 IECD COc1cccc2c1CC[C@@H]2NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840419 HMMZEYRKHYJFPP-FQEVSTJZSA-N 441.503 2.215 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCc2ccccc21 789845849 NIUSXENKZPHUDW-SFHVURJKSA-N 438.597 2.423 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)c(O)c1 797388861 CPLZWTZUUZYPLS-UHFFFAOYSA-N 427.457 2.181 10 20 IECD CO[C@@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1(C)C 803448941 IUZPSGJUCDLEEP-DLBZAZTESA-N 425.476 2.303 10 20 IECD CCN1C[C@H](C)N(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H]1C 803449066 NBMUWZUBVBQDDL-HOTGVXAUSA-N 438.519 2.314 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H]1CCCS(=O)(=O)C1 804969050 ICORANOVJICUBA-AWEZNQCLSA-N 449.495 2.166 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292801 ZDHLXBBNNCYWEL-MJGOQNOKSA-N 428.533 2.052 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)CCc2ccccc2Br)cc1 812271659 QJLAZTOTLDFEMZ-UHFFFAOYSA-N 448.364 2.310 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)CC2)cc1 919914290 FFLIAZVVJBZGRT-UHFFFAOYSA-N 444.557 2.284 10 20 IECD CC(C)Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1781916780 ZKWGFEVJMQEUET-XMMPIXPASA-N 439.512 2.449 10 20 IECD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1F 1792729798 ODZGFYOTDHWVDH-BTTYYORXSA-N 435.546 2.246 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)C3=CCCS3)C2)CC1 1806108436 GGLYSEKGXMZGKW-UHFFFAOYSA-N 439.628 2.099 10 20 IECD O=C(Cc1cccs1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815589755 MAKZRLZSAILFOS-LLVKDONJSA-N 430.511 2.479 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2)CC1 1825833338 IKUBCYDNEQDZGG-KRWDZBQOSA-N 446.598 2.175 10 20 IECD C/C=C/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828247488 SWHAPSSDFNPAGW-SWVIMVIYSA-N 436.584 2.048 10 20 IECD Cc1ccc(C(=O)C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1846285886 ZNBMNHTWXUEXDK-UHFFFAOYSA-N 444.491 2.174 10 20 IECD CCOc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OCC(=O)OC 728517577 GAAAGUZOJDMELI-UHFFFAOYSA-N 428.485 2.404 10 20 IECD CCCn1c(CCC(=O)NCc2cccc(OC)c2O)nc2cc(S(N)(=O)=O)ccc21 729859913 WLZARNLMYHRBDM-UHFFFAOYSA-N 446.529 2.057 10 20 IECD O=C(NCCCCN1CCN(c2ncccn2)CC1)NCc1ccc(N2CC=CC2)cc1 740914176 TWYONRZYVKXONA-UHFFFAOYSA-N 435.576 2.254 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)c(F)c(F)c3)cc2)C1 741426393 IDFIMYXWVHCNEJ-ZDUSSCGKSA-N 434.418 2.061 10 20 IECD COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 746870530 FOMCDLWHOMHODY-LJQANCHMSA-N 429.542 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@H](C)N3CCCCC3)CC2)cc1 753286524 MZLGFQHTWRDTBB-JPMGXVIASA-N 428.577 2.281 10 20 IECD CCN(CC(C)(C)O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 757181107 DUZKLMNIGHJOHP-UHFFFAOYSA-N 430.528 2.245 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1cn[nH]c1 757926587 ZMCCPHBQWVUJCS-LLVKDONJSA-N 431.430 2.315 10 20 IECD CCCC(=O)N1CCC[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 760083141 BMCIDPVBYQJLIP-KRWDZBQOSA-N 433.549 2.400 10 20 IECD CC(C)N1CCN(C2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 760818613 HORUNKMAEVNMGQ-UHFFFAOYSA-N 447.599 2.362 10 20 IECD CO[C@H]1CCN2C(=O)N(Cc3ccc(N4CCOCC4)cc3C(F)(F)F)C(=O)[C@@H]2C1 761096604 JYVRTHHGGRVQHB-RDJZCZTQSA-N 427.423 2.484 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](S(C)(=O)=O)C1 763910305 CXOAHQFDNJYNBM-ZBFHGGJFSA-N 440.521 2.298 10 20 IECD CN(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)cc1F 765878248 DJQULGJHSAGQNE-FQEVSTJZSA-N 428.508 2.161 10 20 IECD COc1ccc(N2CCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)CC2)cc1F 767951275 XPDFSGWGONAOAT-INIZCTEOSA-N 425.501 2.413 10 20 IECD CN(CCN(C)C(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 768928788 CUSFPQKZARUTGR-SFHVURJKSA-N 447.580 2.397 10 20 IECD CCOC(=O)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(OC)c1 769713817 QDZIBNMQROVYRJ-KRWDZBQOSA-N 436.486 2.197 10 20 IECD COCCn1nc(C)c(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1C 772536374 RHHMCVQEIVNFOW-UHFFFAOYSA-N 444.580 2.489 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 773744229 QDTAVJLNGNPKNK-GDBMZVCRSA-N 436.505 2.385 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 773744233 QDTAVJLNGNPKNK-ZBFHGGJFSA-N 436.505 2.385 10 20 IECD Cc1cc(Br)cc(CNC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c1O 776215881 JEVQTKKMGZVMLT-UHFFFAOYSA-N 443.367 2.140 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CC(=O)c3ccco3)CC2)cc1 778326860 ZETUQIAXQYUBGK-DOOKAGJSSA-N 425.485 2.271 10 20 IECD CCNS(=O)(=O)[C@H]1CCN(Cc2cc(Br)cc(Br)c2O)C1 779609403 RDFBNTIZKGPUHQ-NSHDSACASA-N 442.173 2.431 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCN3CCCCC3)cc2F)C[C@@H](C)O1 785517853 QTFWILXCRJNPSB-HDICACEKSA-N 434.556 2.048 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)o1 785644353 CGZOLZPHWXGTKX-YLJYHZDGSA-N 428.533 2.021 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(OC)ccc3OC)CC2)cc1 786650387 SBDAYRLCUOCLGP-UHFFFAOYSA-N 427.501 2.068 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(c4cc(F)ccc4F)=NO3)cc2)CC1 786658604 BPCSHOQEOAYDIX-QFIPXVFZSA-N 442.466 2.443 10 20 IECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c(O)c1 794376159 CSQLDHKTALPQHU-UHFFFAOYSA-N 446.525 2.321 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(O)c1 797389727 WAVYNBMWTPWSOP-OKILXGFUSA-N 431.464 2.408 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccc(C)cc3)[C@H](C)S(C)(=O)=O)nc12 797997750 QJROIKWCJZLHCY-IFXJQAMLSA-N 446.529 2.184 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C2CCN(C)CC2)CC1 804009133 QRSQIDLRPZAICC-UHFFFAOYSA-N 430.593 2.196 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(C[C@@H]1CCOC1)C1CC1 807771892 YPXZMGIUVYUPGT-HOTGVXAUSA-N 437.487 2.401 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nccs1 808816886 RUHOEXIQHUHMQY-KRWDZBQOSA-N 441.601 2.211 10 20 IECD COc1ccc(N2CCCN(c3nnc(-c4cnn(C)c4)n3C[C@@H]3CCOC3)CC2)cc1 812385549 XWMRUFMLEIKTCI-SFHVURJKSA-N 437.548 2.440 10 20 IECD Cc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nnn1-c1ccn(C)n1 814412265 BEMKKWGHEGEFLI-CQSZACIVSA-N 431.447 2.309 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Cl)c2c(c1)OCCO2 916676244 CZOWOBDZRYPMOO-UHFFFAOYSA-N 436.917 2.276 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccccn4)no3)cc2)C1 917832661 DUWWLKUAVCJBTM-KRWDZBQOSA-N 434.500 2.082 10 20 IECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969735 FCNQBAHYPJIWPK-NRFANRHFSA-N 437.606 2.106 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)cc1 920482129 JTYGHEWIIKKJOW-UHFFFAOYSA-N 428.488 2.131 10 20 IECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920886231 DDSUBUUZNKBFNN-MRXNPFEDSA-N 433.512 2.397 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 1318142094 YDROPIJOZQYBLN-SCTDSRPQSA-N 446.567 2.046 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S[C@H]2CCOC2=O)cc1 1321366057 DPFWYSKREBWLNR-LPHOPBHVSA-N 445.493 2.410 10 20 IECD Cc1onc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)c1C 1784775604 UKSVBJYSYPQQMZ-JDFRZJQESA-N 449.891 2.263 10 20 IECD CC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@H]2C1 1790124343 PGAUHZKFHWMIPK-UDIDDNNKSA-N 439.556 2.458 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1CCC(F)(F)C1 1792435595 UZYPZZGZBSDBQK-YGSHXTJESA-N 444.862 2.390 10 20 IECD Cn1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)c1 1823708658 LPVJNIOSCBUKBC-SNVBAGLBSA-N 447.904 2.481 10 20 IECD CN(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843442617 PVIVEHDDCZJTHI-UHFFFAOYSA-N 445.523 2.363 10 20 IECD COc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1OC(C)C 727177868 QAGFYIBELKEYMW-XNTDXEJSSA-N 430.573 2.233 10 20 IECD CC1CCC(NC(=O)CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)CC1 728293833 KQXCJKGKRQVRTE-UHFFFAOYSA-N 443.636 2.024 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC[C@H](C(F)(F)F)NC3=O)cc2F)CC1 730235622 IYEGEOFHFMVCKW-RHSMWYFYSA-N 430.446 2.041 10 20 IECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 731283581 DBYVKXPTKSCDIC-MJGOQNOKSA-N 433.572 2.414 10 20 IECD CN(C)[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cl)c1 732274484 UGLYJROLTYFDNU-HXUWFJFHSA-N 435.977 2.494 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 736376173 PUGLDPHHBJEGOE-KLHDSHLOSA-N 427.542 2.156 10 20 IECD O=C(CN1CCC[C@H](OCC(F)(F)F)C1)NCc1ccc(N2CCOCC2)c(F)c1 738318250 BOCUCWAYIKWUHH-INIZCTEOSA-N 433.446 2.322 10 20 IECD CN(CCC1CC1)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 749530177 CEWIAZLNGJFTCK-WOJGMQOQSA-N 447.582 2.465 10 20 IECD NC(=O)CCOc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 749625073 DPFVYGHOPFLDKD-UHFFFAOYSA-N 437.452 2.407 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 749641058 VVNMGUQRUWKWGD-UHFFFAOYSA-N 438.528 2.424 10 20 IECD CC(C)COC[C@@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069810 AJMIBULOJASRAK-AWEZNQCLSA-N 428.532 2.018 10 20 IECD Cc1ccccc1[C@H](CN1CCOCC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753666353 XESHKOZVHKKCTK-DEOSSOPVSA-N 443.613 2.393 10 20 IECD COc1ccc(N2CCN(CN3C(=O)C(=O)N([C@H](C)c4ccccc4)C3=O)CC2)cc1F 754015193 XCCAYNMITVKTNX-MRXNPFEDSA-N 440.475 2.466 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@H](c4cccc(F)c4)C3)CC2)cc1 754028788 BTKFXDGSGCHIMQ-ISKFKSNPSA-N 429.536 2.391 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 754421760 IMGKIVYMAWCTER-QFIPXVFZSA-N 448.523 2.437 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1F 759500563 YWRPKAXLQZHBHS-UHFFFAOYSA-N 433.505 2.225 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCCC[C@@H]3N3CCOCC3)cc2F)CC1 763658718 XMKPCKNYIJFQMT-GMAHTHKFSA-N 447.599 2.410 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(NC(=O)[C@H](C)n2cncn2)cc1)c1ccc(N(C)C)cc1 773858919 RSFGJPZAPVKYDV-HOTGVXAUSA-N 449.515 2.360 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccnc(N3CCOCC3)c2)cc1 787190013 IVRKKKXUZNADIV-UHFFFAOYSA-N 439.560 2.039 10 20 IECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)cn2)n1 787492801 ZDFXSQJUUCUVOE-UHFFFAOYSA-N 432.528 2.417 10 20 IECD CCOCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787512477 CQRXKZGAJYNNNV-UHFFFAOYSA-N 429.492 2.131 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)cc1 788323993 PAQTWKMWGNGGNW-UHFFFAOYSA-N 436.556 2.397 10 20 IECD COc1ccc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1 789178179 VFSGEUCMGBOPHI-IYBDPMFKSA-N 445.491 2.245 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(O[C@@H]4CCOC4)cc3)CC2)cc1 789201173 YYFGNMTYGRWZLN-JOCHJYFZSA-N 440.496 2.369 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC4(CCCC4)C3)cc2F)C[C@@H](C)O1 789821953 VCCFUJPSGIXQRT-CALCHBBNSA-N 433.524 2.227 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1COc2ccccc21 789840827 NWJXJZGVAHQTIA-KXBFYZLASA-N 441.503 2.084 10 20 IECD CO[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789951618 XKXFREGPWMHEMO-FQEVSTJZSA-N 443.466 2.186 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(OC[C@H]4CCCCO4)CC3)ccc21 803687952 SNJCADZVSRRWPO-OAQYLSRUSA-N 429.561 2.262 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 804389304 BRCRNGHVVHYRSF-HOTGVXAUSA-N 446.573 2.058 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 806281950 CFRSVXKQMYKNTO-SFHVURJKSA-N 448.614 2.149 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676616 HSWKIMKFOTWORI-BXWFABGCSA-N 448.564 2.070 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N(Cc1ccccn1)C1CC1 808851953 MQUZHVBDMQMHLX-UHFFFAOYSA-N 447.583 2.421 10 20 IECD Cc1nnnn1-c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 916679330 ONGPQFZJWHTMPA-UHFFFAOYSA-N 425.468 2.393 10 20 IECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1C(=O)O 917912829 ZTHBNMDYTFVZRG-UHFFFAOYSA-N 447.435 2.057 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 918018034 JZCOKDZNVSYWSS-KRWDZBQOSA-N 441.488 2.305 10 20 IECD O=C(CCc1nc(-c2ccsc2)no1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918341000 ZRKYRMHWTREDFF-UHFFFAOYSA-N 446.554 2.282 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)on1 1781121326 OOLOVXLLFROMEW-DYESRHJHSA-N 449.891 2.489 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)COCCO)cc1 1800149601 XPZXHIQNFRNVHK-QQFNCUIESA-N 425.529 2.355 10 20 IECD CCc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)co1 1819896195 YYMHMOCGNYRXJH-AWEZNQCLSA-N 426.433 2.386 10 20 IECD CCOC(=O)N1CCN(C(=O)COC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 728637153 ILYVUCUFUPKNDF-UHFFFAOYSA-N 445.516 2.362 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 728839187 GLAVVBUXQHBKND-UHFFFAOYSA-N 442.463 2.141 10 20 IECD CCOc1cccc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)n1 730120190 DJLQNIILYJUJPL-UHFFFAOYSA-N 425.533 2.349 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(N2CCOCC2)c(F)c1 730176398 VGQQIIDYFPOITF-UHFFFAOYSA-N 433.505 2.149 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@@H]3CN3CCCC3=O)cc2)C1 732447772 CFXSUEHXVOCNTD-PZJWPPBQSA-N 441.576 2.075 10 20 IECD COc1ccc(OC(F)F)c(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 733000386 HBOOPUPLAJPUHF-WQLSENKSSA-N 438.499 2.047 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 735196508 XJDBZUQUFXEZLN-PMERELPUSA-N 435.521 2.042 10 20 IECD COC(=O)Cc1sc(NS(=O)(=O)c2c[nH]c(C(=O)OC)c2)nc1-c1ccccc1 743046489 LLIICSIDGAAMBA-UHFFFAOYSA-N 435.483 2.441 10 20 IECD CC(C)CN(C)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 744219944 MNDJKULDLMVTAX-MFOYZWKCSA-N 435.571 2.321 10 20 IECD CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 751481453 NEIDBEFHRQXJKB-QUCCMNQESA-N 444.601 2.483 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CC[C@H](O)CC1 753041129 VAKOVPKGLCYOFV-IYARVYRRSA-N 428.512 2.045 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCN4C(C)=O)CC2)cc1F 754039979 HHAKXUDDFVZBQS-UHFFFAOYSA-N 433.505 2.254 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2N(C)S(C)(=O)=O)C2CC2)cc1 757832299 BXSXHJVGMOKCEO-UHFFFAOYSA-N 444.557 2.278 10 20 IECD COCc1nc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 758818966 CAZAEEBHVUFMRY-UHFFFAOYSA-N 437.493 2.047 10 20 IECD Cc1n[nH]c(C)c1C[C@@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772087153 JAQPPQDCPXMILM-CQSZACIVSA-N 432.496 2.040 10 20 IECD CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)CC1 774364202 TZDIPJNUPAJWMO-UHFFFAOYSA-N 446.935 2.191 10 20 IECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)c1 775079079 HQJRVOUAPDZCSX-QFIPXVFZSA-N 442.535 2.470 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\C(=O)Nc3ccc4n[nH]cc4c3)cc2)C1 778638409 YGJKWHRRBSYASE-DOOKAGJSSA-N 446.511 2.076 10 20 IECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785527124 ASHLBLWDMDQBDU-KNQAVFIVSA-N 430.593 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)cc2)CC1 787320406 SXWVWPQSBDBGGS-UHFFFAOYSA-N 440.485 2.198 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)CNCc2ccc(N(C)C)cc2C(F)(F)F)c1 794716083 PWIPMCRRDWUAOT-UHFFFAOYSA-N 444.479 2.408 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)o1 804315900 UZVPCHADMYDHJA-FQEVSTJZSA-N 429.517 2.440 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@H](O)c3ccc(C)cc3)CC2)cc1 804467190 ATCCYYLQIDRZSV-LJNLZICSSA-N 437.540 2.447 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1Oc1ccccc1 807289207 LTUAPRGWTAOQAR-ZRBLBEILSA-N 435.524 2.420 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807383902 QWUUQCAFCZSLBB-KRWDZBQOSA-N 449.502 2.475 10 20 IECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)[C@H](C)C1 807953930 BOGAUTZAFIZPFA-JKSUJKDBSA-N 434.968 2.272 10 20 IECD CCN1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1=O 807955382 VNWDMZJCOKYGTI-MRXNPFEDSA-N 434.968 2.273 10 20 IECD C[C@H]1CCSCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854387 WRJKHAMQJSZMFR-SFHVURJKSA-N 430.618 2.189 10 20 IECD CC(C)C(=O)Nc1nc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cs1 917835590 CWTKKBUOGWAULT-MRXNPFEDSA-N 443.573 2.298 10 20 IECD COc1ccc(N2CCCN(C(=O)NC[C@@]3(N4CCOCC4)CCSC3)CC2)cc1 918006388 KQAHJIKUVWAONF-QFIPXVFZSA-N 434.606 2.125 10 20 IECD O=C(NCCc1nnc2n1CCCCC2)NCc1ccc(N2CCC(CO)CC2)cc1 918199863 QWUUKHZMECCRQE-UHFFFAOYSA-N 426.565 2.255 10 20 IECD COCCN1CCC(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 920814284 QPHDQFRAEXYHIR-UHFFFAOYSA-N 444.498 2.452 10 20 IECD C[C@@H](NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 1324886305 GABBIHKERMOBPN-GOSISDBHSA-N 432.565 2.253 10 20 IECD Cc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)c(=O)[nH]c1C 1788424362 XJGQOHCDQWREPF-UHFFFAOYSA-N 449.467 2.254 10 20 IECD CC[C@H](C)[C@H](N)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314048 YKZWYFFVCVYKMG-UGSOOPFHSA-N 448.614 2.354 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1=CCCS1 1803634923 USZGTNDBTIXQOQ-LIRRHRJNSA-N 426.498 2.228 10 20 IECD COC(OC)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1805774559 DEUHEYNHPOKXBM-UHFFFAOYSA-N 426.897 2.215 10 20 IECD CN1CCCC[C@@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1814887043 NSUVLGGOFZCMRH-JKSUJKDBSA-N 428.493 2.006 10 20 IECD Cc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816724751 FZQXSKUWAHOQBI-LBPRGKRZSA-N 425.470 2.192 10 20 IECD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1ccccn1 1816728490 QMEISJLWTMKGPP-YPMHNXCESA-N 439.497 2.374 10 20 IECD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)COC1 1823877783 MGMJKMSTBXMJCR-JHTBKMLMSA-N 444.528 2.473 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832308227 JDXDJVRRBJIIMH-DNVCBOLYSA-N 441.532 2.492 10 20 IECD Cc1cc(C)cc(CCC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1 1847056601 TTYDVJOZILZJLR-UHFFFAOYSA-N 445.610 2.300 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cc(C)ccc3OC)CC2)cc1 12069501 SPKLPGGDAUGSSG-UHFFFAOYSA-N 440.544 2.279 10 20 IECD CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 60093701 LNYBGLFDOORRGJ-CYBMUJFWSA-N 427.523 2.141 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](OCCN4CCOCC4)C3)ccc21 483625481 UNJVMSNRFOLEPD-NRFANRHFSA-N 429.561 2.468 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(Cl)c3)cc2)CC1 726975457 ATPCVRZSSJESEY-UHFFFAOYSA-N 432.926 2.192 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2OC(F)F)cc1C(=O)O 728015199 KXSRGZDUJFJFKI-UHFFFAOYSA-N 436.414 2.159 10 20 IECD CCS(=O)(=O)C[C@@H](C)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733196744 GHGHTBGWXJYRON-CQSZACIVSA-N 428.510 2.156 10 20 IECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc1 742057423 OPTVWZKXEDCQHG-UHFFFAOYSA-N 443.569 2.469 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCOC1 743555948 DLYBJXVSQNMWSH-WMZOPIPTSA-N 428.512 2.167 10 20 IECD NC(=O)Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743976028 XNIFJUMHYKDQLF-MRXNPFEDSA-N 446.454 2.040 10 20 IECD CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CCC[C@@]34NC(=O)N(C)C4=O)cc2)CC1 752010410 PFIYIQRTQDLFPM-FDDCHVKYSA-N 427.549 2.443 10 20 IECD CC1([C@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)OCCO1 753121964 PGIDZEGDQNLSTL-OALUTQOASA-N 430.549 2.073 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCN(c4ccccn4)C3)CC2)cc1 753126791 LXJICLYVHXDSPE-FQEVSTJZSA-N 438.576 2.180 10 20 IECD COC[C@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(F)c1 754170685 XLOSNCZWQGAUCM-XXBNENTESA-N 435.515 2.434 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)CC2)cc1 758220948 DERPWHPDRATNTL-LJQANCHMSA-N 438.488 2.045 10 20 IECD C[S@](=O)Cc1noc(-c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 762122775 UQSFQGILXDASNA-NDEPHWFRSA-N 438.443 2.030 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)c(OC)c2)cc1OC 767450098 NGFXTJDRHNTVAJ-UHFFFAOYSA-N 435.911 2.315 10 20 IECD C[C@H]1COCCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 772996967 FUQRGFOLPIBXLW-KRWDZBQOSA-N 428.512 2.263 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OC)c(NS(C)(=O)=O)c1 774125986 IKCONJIBVMGGPN-UHFFFAOYSA-N 448.545 2.120 10 20 IECD COc1ccccc1OCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 774816159 OFXFHQGVMJMWPZ-SFHVURJKSA-N 428.485 2.104 10 20 IECD COc1ncc(/C=C\C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 775136249 VGHCYZVKBHDWRA-TWGQIWQCSA-N 443.415 2.456 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 776819447 APUCAQILXOHMPM-ONTIZHBOSA-N 448.608 2.025 10 20 IECD COc1cccc(CS(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 785122269 PMAMVWVBLUICIT-UHFFFAOYSA-N 430.507 2.171 10 20 IECD COc1ccccc1[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nccn1C 785643921 QQHGTMMHFKQFKR-NRFANRHFSA-N 435.528 2.359 10 20 IECD Cc1cc2c(cc1C)O[C@@H](C(=O)OCC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 786393191 GNWUPRJKCZFMJS-JOCHJYFZSA-N 442.487 2.442 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 788399920 FVONDSQDWVFMHK-QZTJIDSGSA-N 441.528 2.293 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)cc1 788953630 BZUCVDGPIYZMNL-KDURUIRLSA-N 444.576 2.474 10 20 IECD COc1cccc(CNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 789314442 VUXVUEJDOZRPFC-GOSISDBHSA-N 445.491 2.057 10 20 IECD CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793727037 VICWPQQYWMNMBB-KNOQFWTLSA-N 440.588 2.432 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)COCc1ccccc1 793952984 CVRUMAGZODDDQC-HXUWFJFHSA-N 439.556 2.451 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)cc1F 799765882 KNKGLADMTJFRLG-UHFFFAOYSA-N 430.299 2.232 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCN3C(=O)OC(C)(C)C)ccc21 803688998 HQHSFOCBXAXEDZ-SFHVURJKSA-N 430.549 2.201 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCN1CCCc2ccccc21 804000648 OUGZLPFUMBWMGD-UHFFFAOYSA-N 436.556 2.051 10 20 IECD C[C@@H](NC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 804988520 CRGBDQDZVZGNIT-CRAIPNDOSA-N 430.471 2.147 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)CCc2ccccc2Br)ccc1O 812271604 ONWIRAUWWNLHBN-UHFFFAOYSA-N 449.348 2.047 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@@H]1CCS(=O)(=O)C1 914454102 PXSKGEGTEFWBOS-CJAAZZPWSA-N 444.625 2.280 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3cccs3)cc2F)C[C@@H](C)O1 918632996 HJIGVQBCDONICX-ZIAGYGMSSA-N 441.550 2.096 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](NC(C)=O)c1ccc(C)cc1 1321362146 YVTGJHACUCIEHL-OALUTQOASA-N 428.485 2.264 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(=O)n(CCOC)c3)cc2F)CC1 1322563718 YAQLTBCYXCXOSA-UHFFFAOYSA-N 431.512 2.097 10 20 IECD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781833403 YRFJTQDAEYWGMV-UYLJANOPSA-N 443.544 2.447 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2 1782009256 VCYTVDFJVDIUSW-VQTKTOELSA-N 433.263 2.119 10 20 IECD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603098 ADLROSZZAZXGBN-ORIYUZMUSA-N 438.440 2.366 10 20 IECD Cc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1808907692 ZKDKYMHVIAUNLC-IFXJQAMLSA-N 439.497 2.286 10 20 IECD O=C(CCN1CCCCC1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722605 QQSSKWHOJCCCPE-CQSZACIVSA-N 445.545 2.051 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1F 1841161014 BDXAFAIVHKMUFU-VMPITWQZSA-N 442.443 2.482 10 20 IECD O=C(NC1CC1)[C@H]1CCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 195649077 HUNYDFVPEJXDKD-GOSISDBHSA-N 440.466 2.495 10 20 IECD Cc1c(CNC(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)n(C)c2ccccc12 472221379 NNEJTDUSVWODQN-UHFFFAOYSA-N 441.557 2.166 10 20 IECD Cc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1-c1nccs1 727176688 OAALDSXXADODTN-LCYFTJDESA-N 442.613 2.301 10 20 IECD COC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 727616469 LXLCGBFJMUSQQE-UHFFFAOYSA-N 430.436 2.096 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(CC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1 728932364 MWUXOJOXEMTBHJ-NRFANRHFSA-N 440.588 2.436 10 20 IECD O=C(Nc1ccc(NC(=O)C2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 731405540 GYGLOPBEMUGZSM-GOSISDBHSA-N 438.484 2.282 10 20 IECD CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H](C)CS(C)(=O)=O 732984875 HZDJVNOVIFUUGK-CQSZACIVSA-N 428.510 2.156 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC[S@](=O)Cc3ccccc3)CC2)cc1 735095304 JCNUGCMGAXGSJJ-HKBQPEDESA-N 444.601 2.065 10 20 IECD CC(C)[C@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743713164 WZMUTRGOYNXTOJ-LJQANCHMSA-N 437.474 2.238 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnn(C)c4)CC3)cc2F)C[C@H](C)O1 746414572 FPXJFMOWQUPUEV-IRXDYDNUSA-N 430.528 2.205 10 20 IECD Cn1cc(-c2csc(NS(=O)(=O)c3ccc(OCc4ncnn4C)cc3)n2)cn1 746598633 XYRWIHUNCXVLGM-UHFFFAOYSA-N 431.503 2.052 10 20 IECD COc1ccc(N(C)CC(=O)N2CCCc3cc(S(=O)(=O)N(C)C)ccc32)c(OC)c1 752125090 NOVGCSAWHXUAAS-UHFFFAOYSA-N 447.557 2.370 10 20 IECD COc1ccc(N(C)CC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)c(OC)c1 752126125 XFYBFROQVUFXRZ-OAHLLOKOSA-N 438.571 2.417 10 20 IECD CCNC(=O)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 754445104 ADEBQRZTLNMXTJ-UHFFFAOYSA-N 437.543 2.291 10 20 IECD COc1cccc(CNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)c1O 757380653 JQEMJTRISAPXGR-UHFFFAOYSA-N 429.292 2.049 10 20 IECD O=C(Nc1ccc2c(c1)S(=O)(=O)CC2)C(=O)N(Cc1ccco1)Cc1ccccc1O 764254723 RXRJZZDPNCPBGL-UHFFFAOYSA-N 440.477 2.483 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cnn(Cc2ccccn2)c1 765932126 VMTYNETWKHWLFA-UHFFFAOYSA-N 430.262 2.049 10 20 IECD CN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C(C)(C)C1 770157610 PPVFZQRIJURMKR-UHFFFAOYSA-N 448.501 2.267 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 772456025 PZYCIVHPPNZMEB-LJQANCHMSA-N 446.592 2.438 10 20 IECD CCOC(OCC)c1nnc(SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1C 775179865 MSWAXIAYGODSMJ-UHFFFAOYSA-N 449.577 2.336 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H](N4CCCC4)CC3)CC2)cc1 778288323 XOEZBBCRBYUYLS-XPTLAUCJSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)cc1 778394764 BTNMJCMUTWTXTC-GBJNBNQZSA-N 434.540 2.203 10 20 IECD COC(=O)[C@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c2ccccc2O1 783317316 PIZRVUJCENZGHN-OAQYLSRUSA-N 439.512 2.457 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)csc2C(=O)OC)cc1OC 785488973 QUAXPXXXNCQCKS-UHFFFAOYSA-N 448.544 2.414 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cc1F 787092449 DDOMRGRJYDMPEE-UHFFFAOYSA-N 444.482 2.068 10 20 IECD COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)n2)cc1 787325635 PCCKCZYBNLDWNZ-UHFFFAOYSA-N 449.511 2.185 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2ccc(Cl)cn2)CC1 788934649 XEQMJGSYDHSZGH-UHFFFAOYSA-N 427.936 2.300 10 20 IECD CC(C)CN1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789819436 MVZDXJHCBDUCGT-WSTZPKSXSA-N 448.583 2.150 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(O)cc3)cc2F)C[C@@H](C)O1 789821333 RZUKHZATIIUOLP-HZPDHXFCSA-N 429.492 2.420 10 20 IECD CCC[C@@H](CCCS(C)(=O)=O)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 790045185 BCAPGLDUTUVJOS-FQEVSTJZSA-N 437.606 2.212 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(S(C)(=O)=O)CCC3)cc2F)C[C@H](C)O1 792835930 OCFMZHJLARYWCI-GJZGRUSLSA-N 427.542 2.206 10 20 IECD CN(CC1(c2ccccc2)CC1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793730001 BJWGACIUAKHFLG-HXUWFJFHSA-N 448.567 2.195 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743045 QXVKJWGHZRUIIL-WMZHIEFXSA-N 438.572 2.428 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)c(O)c1 797390485 HEKRMCOFURUUQJ-IYBDPMFKSA-N 427.501 2.265 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 804844982 LAAVOUHGRVJRPP-SFHVURJKSA-N 426.467 2.352 10 20 IECD CC1(C)CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1CCO 806878338 PEIFSCMZZMFSFX-MRXNPFEDSA-N 426.508 2.355 10 20 IECD CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807511297 KGWDEBPFYGUAMM-UHFFFAOYSA-N 435.260 2.497 10 20 IECD CCN(C)C[C@@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770920 PNULVYHGPJQBPA-DLBZAZTESA-N 438.519 2.173 10 20 IECD O=C(CN1CCN(C(=O)N2CCCC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 818364635 SIPRKZZXUCZUTF-UHFFFAOYSA-N 446.507 2.234 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)S(=O)(=O)c3ccccc3)cc2F)C[C@H](C)O1 917714712 NYQCFCZRHLZBGT-IRXDYDNUSA-N 449.548 2.376 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(CCc4ccccc4)CC3)cc2)C1 918117727 IBFNSDJOUGUEQZ-HSZRJFAPSA-N 449.599 2.458 10 20 IECD O=S(=O)(c1ccc(NC(=S)NNc2cc(F)cc(F)c2)cc1)N1CCOCC1 920073244 DCXKNGRHGMLAFP-UHFFFAOYSA-N 428.486 2.299 10 20 IECD C[C@@H](NC(=O)N1CCN(C(=O)c2ccccc2O)CC1)c1ccc(N2CCOCC2)cc1 920867738 YMAACXLVQYIIAJ-GOSISDBHSA-N 438.528 2.457 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1F 1116239361 JJRFJRSHEFBHSL-UHFFFAOYSA-N 436.528 2.036 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 1320749816 ACPKVRLZUQLLGC-UHFFFAOYSA-N 449.485 2.337 10 20 IECD Cc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1785510326 VYAORFKHBKXDBA-HLZSCNFSSA-N 438.480 2.269 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ccno3)cc2)CCC1 1787372544 NXIUSPZBOHZUTQ-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(Cn1cnnn1)Nc1ccc(C2(NC(=O)c3cc(O)c(O)c(Cl)c3)CCC2)cc1 1788264026 KFMIRLWDAWMHKA-UHFFFAOYSA-N 442.863 2.186 10 20 IECD Cc1onc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1C 1803890115 VQERFWRWVZODFQ-YWZLYKJASA-N 437.456 2.126 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1CCCC1 1816683445 KIENALHJEQOKLF-CQSZACIVSA-N 435.575 2.452 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CCc2nc(N)n[nH]2)C3)cc1 1845398898 PLVBUGPYLVJFKO-UHFFFAOYSA-N 447.543 2.244 10 20 IECD CCn1c(N2CCOCC2)nn(CN(C)Cc2ccc(N3CCOCC3)cc2)c1=S 16878852 WYKVENFGTGFGFH-UHFFFAOYSA-N 432.594 2.197 10 20 IECD CCc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc2o1 737138674 KXUZFNNAEFSDIK-MRXNPFEDSA-N 449.511 2.347 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nccnc3NC(=O)C(C)(C)C)CC2)cc1 742591195 VUAVQCCAIGAYQZ-UHFFFAOYSA-N 440.548 2.022 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)C2CC2)cc1 746989838 HGJMXRIBNIKPEM-UHFFFAOYSA-N 429.542 2.427 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1 747571752 PFSMFBXLFSXNPG-ZNMIVQPWSA-N 431.493 2.116 10 20 IECD NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2)CC1 749730794 DZQMVCRBMUXSJS-UHFFFAOYSA-N 447.586 2.082 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](N(C)Cc4ccccc4)C3)CC2)cc1 754050238 IYBNASFUZDYPNY-DQEYMECFSA-N 438.616 2.384 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CN1CC(F)(F)F 754462129 SDVXDRQTFCKGIS-UHFFFAOYSA-N 449.432 2.059 10 20 IECD COc1cc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c(O)c(C(C)(C)C)c1 754739264 ARXGOGUUMKBDDL-UHFFFAOYSA-N 436.578 2.247 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc2c(c1)CCS2(=O)=O 757740557 JBHBNLQYRNFXOD-UHFFFAOYSA-N 429.542 2.195 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)[C@]12CCCO2 759325614 ZVCMFPBGSPOEKQ-WMTXJRDZSA-N 446.592 2.233 10 20 IECD CC(C)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1CCCS1(=O)=O 761984450 ZATTUELSDHZNMJ-HKUYNNGSSA-N 443.997 2.186 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCc4c(F)cccc43)CC2)cc1 763360829 FLYMJBIXCNJERZ-UHFFFAOYSA-N 440.519 2.052 10 20 IECD O=C1CCc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)c(F)cc2N1 765928478 ZGUVRKCSGBKBIA-UHFFFAOYSA-N 436.237 2.433 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cc1 768063823 QWEWWQFWOSBVTN-UHFFFAOYSA-N 434.500 2.059 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O 768931205 XVVBJCDNVZAYLH-XMMPIXPASA-N 442.560 2.372 10 20 IECD C[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1C(=O)NC2(CCCC2)C1=O 771055738 DDZPGBPYYVZSIB-RHSMWYFYSA-N 448.951 2.379 10 20 IECD CC(C)[C@H](C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)N1CCCS1(=O)=O 772676757 GACOTOLSIDPIML-GQIGUUNPSA-N 441.569 2.116 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 773231128 ASKCUFYHDJLKBO-GOSISDBHSA-N 431.558 2.493 10 20 IECD CC1CCC(NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)CC1 775675749 BGSORSCKDVFHAH-UHFFFAOYSA-N 427.637 2.251 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCN3C(=O)CCc4ccccc43)cc2)CC1 786255901 OGLCGLKNEUASJK-UHFFFAOYSA-N 434.540 2.341 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccnc3-c3cnn(C)c3)CC2)cc1 786287046 DVQLLODLWAYOQZ-UHFFFAOYSA-N 434.500 2.168 10 20 IECD COc1ccc(OC)c(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 786647179 FHIQVEVBIXMYPP-INIZCTEOSA-N 427.501 2.034 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 787703293 AQAGEVBXIUPLOT-SFHLNBCPSA-N 431.577 2.384 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 788324586 VUZAIHVOIGUJAT-NRFANRHFSA-N 444.963 2.212 10 20 IECD Cc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801393 SPYGIBZRWAAHFU-JOCHJYFZSA-N 441.503 2.187 10 20 IECD COc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789826737 RBJYEDMHGMADRO-OAGGEKHMSA-N 444.507 2.337 10 20 IECD C[C@H](NC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1)c1ccc(N2CCOCC2)cc1 797652637 LUQHRMGZIGGHMZ-HNNXBMFYSA-N 433.534 2.051 10 20 IECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 799251839 UHQQDRFKRZTDFB-UHFFFAOYSA-N 446.435 2.224 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2O[C@@H](C)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 800302770 BMXVHBSHCRSHDJ-TUXXCZFBSA-N 434.514 2.281 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1F 803665243 VJDLUSALWCJOKK-INIZCTEOSA-N 436.528 2.414 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N3CCc4ccccc43)CC2)cc1 803910390 AUKABWCQNRHLGF-SFHVURJKSA-N 436.556 2.348 10 20 IECD CCN(C)C(=O)OC[C@@H]1CCCCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 805762099 NJNSWSXSOGQVNQ-FCHUYYIVSA-N 448.608 2.121 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(C(=O)NCCOC)c1 806846298 JDZJPXNZESRTBD-UHFFFAOYSA-N 426.517 2.116 10 20 IECD Cc1nnsc1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 813599609 QJABZQHDMRLIHC-UHFFFAOYSA-N 442.524 2.102 10 20 IECD CCN1C[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1=O 914912645 XMDSZZYRQAYFES-KRWDZBQOSA-N 426.469 2.475 10 20 IECD COCC(=O)NC1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 917119920 KPYCAJJQTGXFAL-HNNXBMFYSA-N 449.507 2.016 10 20 IECD COc1ccc(N2CCCN(C(=O)Cc3c(C)[nH]c(-c4ccncc4)nc3=O)CC2)cc1 918664203 QHXXUOJJJOVRSI-UHFFFAOYSA-N 433.512 2.430 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)s1 1777847595 GXYPLMAYIAGUNJ-IIBYNOLFSA-N 431.514 2.304 10 20 IECD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)ccn1 1782007264 NVNIIJPPYXEVLI-OAQYLSRUSA-N 431.876 2.212 10 20 IECD C/C(=C\c1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1783489769 ZOSXOQQEFYTICO-ZGTPDUGGSA-N 443.525 2.251 10 20 IECD N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccn1 1796062369 SNMWVNYTUDOXFW-AHXJXLJNSA-N 430.892 2.098 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cc[nH]c12 1797648031 GXIVOCKWYMTNIV-QDMKHBRRSA-N 442.566 2.280 10 20 IECD COc1ccc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1800538097 BSIDGLGLYKTPFS-QDMKHBRRSA-N 447.582 2.116 10 20 IECD Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804330855 MGWBDARTYIOBEJ-BCDXTJNWSA-N 445.610 2.426 10 20 IECD COc1cc(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804336072 UVEHVFTVAOWTCB-MUJYYYPQSA-N 447.582 2.116 10 20 IECD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1807994933 LRRJLTWYBWHKSI-XOBRGWDASA-N 437.456 2.072 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)c3cc(O)n[nH]3)C2)CC1 1809908469 SBTJZSLTMVUURT-UHFFFAOYSA-N 434.880 2.339 10 20 IECD CNCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826890179 DBDKAZWWRWZEOU-RQMBKDMJSA-N 445.560 2.436 10 20 IECD O=C([C@@H](O)c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424780 ODAHTAZPYJOLHD-JXFKEZNVSA-N 429.473 2.053 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1830436477 LBUSEDZXUJQHPF-LJQANCHMSA-N 441.532 2.309 10 20 IECD CN(C)c1cccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847038449 RVRZMQSDIWUIRJ-CSKARUKUSA-N 437.496 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)CC4CCCCC4)CC3)CC2)cc1 110303714 UHLRHGPULQEISB-UHFFFAOYSA-N 442.604 2.458 10 20 IECD C[C@H]1CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 725803782 QBTGYGWJAMQWDL-OLWAXZHHSA-N 433.555 2.075 10 20 IECD O=C(CSc1n[nH]c(-c2cccnc2)n1)NCc1ccc(N2CCOCC2)c(F)c1 728160313 BEGVYZUJSQLQIS-UHFFFAOYSA-N 428.493 2.251 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1 729062891 GIQFNMKERPJWJC-KKUMJFAQSA-N 428.489 2.225 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c1 734018442 ROIDZGXTGMPEQP-KRWDZBQOSA-N 433.486 2.477 10 20 IECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 741900966 NZOLEUFYQJYYDW-UHFFFAOYSA-N 443.569 2.419 10 20 IECD O=S(=O)(NCC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1 742394554 SUYCEJJCBBDCSB-UHFFFAOYSA-N 434.537 2.482 10 20 IECD COc1cc(OC)cc(N2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 759099365 NUIZWYXODGYILO-UHFFFAOYSA-N 449.529 2.133 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccnc3OCC(F)F)CC2)cc1 760640605 KKLSJSMCGMGAAF-UHFFFAOYSA-N 435.427 2.240 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CS(=O)(=O)c2ccccc21 763015070 USCWTZVKFMMHOA-GOSISDBHSA-N 433.505 2.115 10 20 IECD O=C(O)c1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(Cl)c1 768500086 ONEXOUQSMCDUBP-UHFFFAOYSA-N 444.918 2.074 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](c1ccc(C)cc1)n1cncn1 770116392 MPYYMNXPRNUMSG-UYAOXDASSA-N 443.529 2.462 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(Br)cn1 772952026 DWTSCSVWBIKTKC-UHFFFAOYSA-N 447.333 2.308 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 773742006 OLQHTCZYZFRUKA-HOCLYGCPSA-N 435.521 2.051 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 774778819 FNUVNFDJEVBBKI-SFTDATJTSA-N 425.529 2.319 10 20 IECD O=C(c1cccc(O)c1O)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 776315297 SYIMKNIKVZWAGP-UHFFFAOYSA-N 447.332 2.069 10 20 IECD COC(=O)CN(CCc1ccccc1)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 777746800 BIPBUZMYHYOPDC-UHFFFAOYSA-N 425.529 2.062 10 20 IECD CCn1c(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)nc2ccccc21 785463054 SKJJNZRFJMOPEG-UHFFFAOYSA-N 435.528 2.466 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC3(c4ccccc4)CC3)cc2F)CC1 785862821 BZUIUBXRVRCOTA-UHFFFAOYSA-N 438.547 2.432 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C 802609709 JPEUZSLQRZOJKK-UHFFFAOYSA-N 433.530 2.376 10 20 IECD COc1ccc(N2CCN(c3nnc(-c4cnn(C)c4)n3C[C@H]3CCOC3)CC2)cc1F 802758104 LRLYGIGDKCCPKF-MRXNPFEDSA-N 441.511 2.189 10 20 IECD CCC(=O)c1ccc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(S(N)(=O)=O)c1 804365227 AKUGAVCBTUGACE-QGZVFWFLSA-N 444.557 2.241 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 804844981 LAAVOUHGRVJRPP-GOSISDBHSA-N 426.467 2.352 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 809232833 UBRJYDRRIYCNRM-VJGAQXRBSA-N 436.574 2.096 10 20 IECD O=C(N[C@@H]1COc2ccccc2[C@H]1O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 811573974 SDUZRPGJYWKZHP-DNVCBOLYSA-N 446.506 2.479 10 20 IECD CCOC(=O)N1CCC(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 915878865 PBSLZSQDOYAQOZ-UHFFFAOYSA-N 447.580 2.127 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)N(C)Cc1ccccc1O 916669205 WMLDHUJPGQVEKA-UHFFFAOYSA-N 435.502 2.086 10 20 IECD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917709050 PDERHCBHTQSQFR-NRFANRHFSA-N 442.470 2.197 10 20 IECD CS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918103447 CTQILRWAKGWFQN-UHFFFAOYSA-N 435.521 2.206 10 20 IECD Cc1ncsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794802856 KOILSYZJISTHRF-JJLQDPRZSA-N 437.905 2.033 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)c1cccs1 1802860557 QQYDKVNEIDBKLY-YIYPIFLZSA-N 437.612 2.350 10 20 IECD CC1(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CCC1 1814185226 NPJVJZINCOSTIA-MAUKXSAKSA-N 446.598 2.138 10 20 IECD C[C@@H](NC=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830330933 FNHNSKPJXGYDKY-DYVFJYSZSA-N 437.924 2.119 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCOC2)CC1 1832383855 MGAVUUSUDUDBCU-VUTZTEFLSA-N 444.528 2.473 10 20 IECD Cc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)n1 1837432417 DSBWFSOOOUGKQR-UHFFFAOYSA-N 440.500 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(C4CCCCC4)C3=O)CC2)cc1 4265778 KAIMNHSVACTLHT-HSZRJFAPSA-N 428.533 2.235 10 20 IECD O=C(Cn1nnc2ccccc2c1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565292 KRMVHZABSCSWGU-UHFFFAOYSA-N 429.427 2.178 10 20 IECD CCOCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 726723178 NSFTVGRKATZHIU-LJQANCHMSA-N 438.528 2.180 10 20 IECD Cc1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726975526 DTDTZHRGJOZHNW-UHFFFAOYSA-N 428.963 2.362 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc4c(c3)oc(=O)n4C)CC2)cc1 728392755 FQJIGNMITNKDGI-UHFFFAOYSA-N 439.516 2.474 10 20 IECD CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NCc3ccc(N(C)C)cc3)cc2)CC1 728393828 QWFFSYWOHCJZJK-UHFFFAOYSA-N 438.576 2.285 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cnc4onc(C)c4c3)cc2F)CC1 730269139 PKVPPDRELXAYCY-UHFFFAOYSA-N 433.509 2.291 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2CCS(=O)(=O)CC2)cc1 732114318 BZUDJZMZPAUJTE-UHFFFAOYSA-N 431.558 2.025 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3ccc(C(N)=O)s3)ccc21 732617226 YUUIPOZWHWLNMY-UHFFFAOYSA-N 435.527 2.184 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)c1 734073324 FZBIIYFWIZBETG-LBPRGKRZSA-N 426.429 2.487 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cnn(Cc2ccccc2)c1 746031879 KIABWNZSUDHWFV-UHFFFAOYSA-N 439.541 2.488 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)ccc1O 757658400 ZUPBCWAAYDDIEO-UHFFFAOYSA-N 434.195 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(Cl)n3)cc2F)C[C@@H](C)O1 758626373 ZAGVJWSKZNZCIR-BETUJISGSA-N 436.871 2.356 10 20 IECD Cc1c(NC(=O)[C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)c(=O)n(-c2ccccc2)n1C 759591200 ZZDQROJAASJPFZ-WQTVUKCASA-N 437.452 2.479 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)cc2F)C[C@@H](C)O1 760535921 XUVHTEUOZIHGSJ-IYBDPMFKSA-N 439.491 2.254 10 20 IECD CC(=O)OCCc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 764700096 KAAZAXHKZSDRHH-UHFFFAOYSA-N 445.541 2.349 10 20 IECD NC(=O)CCNC(=O)c1cccc(NC(=O)NCc2cccc(Br)c2O)c1 765277122 KZALIAYPDMFAQH-UHFFFAOYSA-N 435.278 2.082 10 20 IECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCc1cccc(Br)c1O 765731506 JIYPGVVXYYZRCI-KCQAQPDRSA-N 428.352 2.497 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)NCc2cccc(Br)c2O)c1 765747484 OOBPANHJBZEYHV-UHFFFAOYSA-N 443.319 2.009 10 20 IECD COC(=O)Cc1c(C(=O)OC)sc2nc(/C(Cl)=C\C3=S=CN=C3)nc(O)c12 767722400 QEKDQNIAHSWBQZ-YCRREMRBSA-N 425.875 2.228 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)S(=O)(=O)C1CCOCC1 768170181 GXWSYDMMVVQMFO-GFCCVEGCSA-N 434.352 2.486 10 20 IECD CC(C)(CCS(C)(=O)=O)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769918584 FDDAYNYSEKQWBI-UHFFFAOYSA-N 446.572 2.198 10 20 IECD CCc1nc(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)n[nH]1 770858728 ITWQUEAATDFBDW-UHFFFAOYSA-N 439.541 2.199 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 774668937 MXBQVJBOQOGNSO-MRXNPFEDSA-N 427.501 2.034 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3c(C)cccc3C)CC2)cc1 779219897 PFASPCRYXRLUPO-QFIPXVFZSA-N 440.588 2.365 10 20 IECD Cc1nn(CC(C)C)c(C)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 783828294 NXLGJHYCTGQQHI-UHFFFAOYSA-N 444.535 2.026 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)Cc3ccccc3C)CC2)cc1 786229523 ZLHICOCXQPBNHT-JOCHJYFZSA-N 440.588 2.419 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(N2CCNC(=O)C2)ccn1 787120690 KHPGZJMQRLEIML-UHFFFAOYSA-N 433.306 2.148 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1 788974782 HFLKGUOVPVDCSD-LJQANCHMSA-N 426.492 2.210 10 20 IECD C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789843779 CUIDKRJCIXHEEV-GOSISDBHSA-N 432.634 2.483 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)[C@@H](Cc4ccccc4)C3)CC2)cc1 792940955 LOLZXJURFLVAGC-LOSJGSFVSA-N 438.616 2.037 10 20 IECD Cc1ccc2c(c1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CC2 793731516 FJPQHMWSXSQYDG-UGKGYDQZSA-N 434.540 2.117 10 20 IECD COC(=O)c1ccc(Br)c(S(=O)(=O)NCc2ccc(OC)cc2O)c1 795357489 RIEDMTVHMPVAPQ-UHFFFAOYSA-N 430.276 2.428 10 20 IECD CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1nncn1C 796187734 RGQICAGWNIYZJG-MRUHUIDDSA-N 432.544 2.171 10 20 IECD COc1ccc(N2CCN(c3nnc(CNC(=O)c4cccs4)n3C)CC2)cc1F 800765367 XUBULEWTCZIHPD-UHFFFAOYSA-N 430.509 2.281 10 20 IECD CO[C@H](C)CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 800832516 WLSNKVMTPJVTIM-CYBMUJFWSA-N 442.515 2.035 10 20 IECD COCCn1c(-c2ccc[nH]2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802545130 BFFLIIFKRUAEFZ-UHFFFAOYSA-N 442.520 2.272 10 20 IECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308094 AFEXDSHRDPAGGH-IIBYNOLFSA-N 439.512 2.349 10 20 IECD O=C(NC[C@H]1CCCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806042476 USELCRWPGTUKAX-HUUCEWRRSA-N 431.505 2.381 10 20 IECD O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809494011 XZIWXQPZGWIFDK-FGSXEWAUSA-N 434.558 2.071 10 20 IECD NS(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 815260494 BCMDULRVLLYFKE-OAHLLOKOSA-N 445.501 2.499 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)nnn1CCOc1ccc(F)cc1 815329078 RQLIZSDSSKFALF-UHFFFAOYSA-N 440.479 2.126 10 20 IECD CC[C@H]1CN(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818977737 LLCKUQWLFOZICZ-HNNXBMFYSA-N 448.501 2.267 10 20 IECD O=C(CS(=O)(=O)CCCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 917708556 JCBDFFUAHHLKCR-UHFFFAOYSA-N 434.533 2.326 10 20 IECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920195405 RGGFRQOZJYBLSR-UHFFFAOYSA-N 440.500 2.371 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2c(F)cccc2Br)ccc1O 1324495664 HZRRSADBIIIUGP-UHFFFAOYSA-N 439.284 2.003 10 20 IECD O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602487 MTIUQXSPTPTZPH-BCDXTJNWSA-N 435.484 2.254 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccccc1Cl 1804335734 APYAPSYOOQBYHO-CLLJXQQHSA-N 437.974 2.452 10 20 IECD CCc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804990305 XMBCLYJCSVMKRP-OPAMFIHVSA-N 447.495 2.479 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)n2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994225 DTGFNPATYBHZBV-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnn2ccccc12 1818511858 DXPZGOJYJRNSQS-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(Cn1ccnn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1819701312 DVELDUHOGCVYSI-AWEZNQCLSA-N 445.867 2.072 10 20 IECD CC(C)/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823500508 BWMZHLYHRCFRQU-PSKZRQQASA-N 435.575 2.474 10 20 IECD CC1(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CCC1 1839432264 IUGINRDWDITIIM-NRFANRHFSA-N 438.908 2.011 10 20 IECD COc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(F)c1 1843929408 RPOBLQCBTFEGEZ-UHFFFAOYSA-N 429.448 2.090 10 20 IECD CC(C)N(CCc1noc(-c2ccc(NC(=O)C3=S=CC=C3)cc2)n1)S(C)(=O)=O 546347776 YGJQWEOSYRGMMV-UHFFFAOYSA-N 434.543 2.165 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NCCCS(=O)(=O)Cc1ccccc1 613681490 VVHRHEFJEHMAKF-UHFFFAOYSA-N 446.550 2.126 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1 729062896 GIQFNMKERPJWJC-ZNMIVQPWSA-N 428.489 2.225 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 731855933 GWNWYBCISVXWGG-LJQANCHMSA-N 448.541 2.138 10 20 IECD Cc1cc(C(=O)NCc2ccccc2S(=O)(=O)N(C)CCO)c(C)n1-c1ccccn1 733979699 CIPYCXACLSGPON-UHFFFAOYSA-N 442.541 2.032 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742804159 SWSOWNHEICKURD-OAHLLOKOSA-N 439.484 2.263 10 20 IECD CN(C)c1ccc(CNC(=O)NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1F 746978501 ULDFKFIHICQAJE-INIZCTEOSA-N 430.480 2.016 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnnn3Cc3cccs3)CC2)cc1 758200443 YUWBSIPBGGLEEI-QGZVFWFLSA-N 446.602 2.067 10 20 IECD O=C(Nc1ccn(CCc2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 759023447 XDWOIMGQGGLXGS-HXUWFJFHSA-N 449.511 2.373 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4ccc5c(c4)CCO5)C3=O)cc2)C1 761123862 PLNZTVAKVNDBPU-WIYYLYMNSA-N 434.496 2.116 10 20 IECD COc1cc(Cl)cc(CNc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)c1O 761217761 YFXYCWIOGPGVSG-UHFFFAOYSA-N 426.926 2.143 10 20 IECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)C[C@@H](C)O1 763279568 MLPQCCLCPVNGMA-OAGGEKHMSA-N 448.541 2.257 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCS[C@@H]4COCC[C@@H]43)cc2F)C[C@@H](C)O1 767904467 DUXZKIVKONFRIX-LXDRIQHSSA-N 437.581 2.262 10 20 IECD COC(=O)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1F 778342041 AMKKHUWYGCGHTH-MDZDMXLPSA-N 441.459 2.464 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)CC2)cc1 780248677 CTVVXAZMWNSMEU-HXUWFJFHSA-N 432.565 2.333 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)Cc3ccccc3)CC2)cc1 782920346 ZRNDQWABHVUBBD-NRFANRHFSA-N 426.561 2.110 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc2c(=O)n3ccccc3nc21 784412020 BWNQWKORNNYRBL-UHFFFAOYSA-N 445.523 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC([C@H]4CCCO4)CC3)CC2)cc1 784624255 KZCGTUKREYUJPZ-HYGBKTPJSA-N 427.545 2.318 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 784765908 CNWDZOLUSKKDIC-SFHVURJKSA-N 444.919 2.125 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1 785297415 RVFURZLXGQNEQZ-ZDUSSCGKSA-N 433.892 2.274 10 20 IECD Cc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C(=O)N1CCCC1 785305318 XAIBKLSZIKOXEG-OAHLLOKOSA-N 425.485 2.328 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)cc1 785424737 LXVQNRKLEMQGJP-UHFFFAOYSA-N 436.556 2.063 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811190 CXXMROXRHDJTEQ-UHFFFAOYSA-N 428.508 2.003 10 20 IECD CCOC(=O)CC1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789856320 SCISOHVOCHSFAM-UHFFFAOYSA-N 433.574 2.048 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)c(O)c1 797390592 ZPSWOZRVCDDOSE-UHFFFAOYSA-N 445.431 2.456 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccnc1OCC(F)F)c1ccc(N2CCOCC2)cc1 803307716 LACJXNQKWNNHRT-HNNXBMFYSA-N 448.470 2.056 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3c(F)cccc3F)N(C)C)ccc21 803688468 ZIWSZJPJYWKNBG-HXUWFJFHSA-N 430.499 2.383 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H](CCOC)C3)cc2F)CC1 805007632 OLXVTIBXORFVDG-IBGZPJMESA-N 448.583 2.249 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccccc1CN1CCC(O)CC1 806277661 HTZNBESGSFHYBC-UHFFFAOYSA-N 448.614 2.015 10 20 IECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)CC2 807292880 BCNZAIJKJPGJJB-UXHICEINSA-N 440.544 2.351 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1 807379774 ZMZVNQHGCLNOPL-UHFFFAOYSA-N 442.535 2.393 10 20 IECD C[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC(C)(C)O1 807768996 CTNQNRASYUDJME-GJZGRUSLSA-N 425.476 2.399 10 20 IECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Cc1ccc(F)cc1 807807784 IETGVTJARMKSJW-OAQYLSRUSA-N 443.519 2.287 10 20 IECD COc1cc(O)c(CNc2cccc(S(=O)(=O)N3CCC(CO)CC3)c2)cc1OC 809685020 WNBYJGVWLFZDMZ-UHFFFAOYSA-N 436.530 2.415 10 20 IECD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccn1 914613907 OGEMFCPGWFEXQS-OAHLLOKOSA-N 442.497 2.321 10 20 IECD COCCn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc1=O 917687060 MHWCMSBJCQMSML-UHFFFAOYSA-N 439.434 2.280 10 20 IECD O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 918211969 GWYPACNHEVFVFH-UHFFFAOYSA-N 441.551 2.284 10 20 IECD C[C@H]1Oc2ccccc2O[C@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919043543 XBYBCOKSECDCOX-IVZQSRNASA-N 444.459 2.050 10 20 IECD C[C@@H](OC(=O)c1ccn(C)c(=O)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919267365 OXGZESGYUXWSGY-CYBMUJFWSA-N 430.416 2.345 10 20 IECD C[C@H](NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F)c1ccc(N2CCOCC2)cc1 920890043 IHWWJPLGFJUYII-IFXJQAMLSA-N 426.439 2.274 10 20 IECD COc1ccc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 920890235 QHFFNRHCWRHQJP-HNNXBMFYSA-N 442.472 2.047 10 20 IECD C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 994184993 RBVHPRXLKUBWOJ-VSPBXKBYSA-N 425.489 2.097 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnn([C@@H]4CCOC4)c3)n2)cc1 1322899028 QEANQQFBRZZJBH-MRXNPFEDSA-N 447.542 2.405 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc2sccc2[nH]1 1804333820 YKXGUQBCBOKPJF-ZSBIGDGJSA-N 448.595 2.342 10 20 IECD CC(C)CCC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189983 NILLTWMZNBYNLA-JXFKEZNVSA-N 448.614 2.384 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cncn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293784 PHHXVCVULOWFDY-CQSZACIVSA-N 445.867 2.072 10 20 IECD CC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821973300 KSKHTAMNBUSRFN-ZUZCIYMTSA-N 449.895 2.305 10 20 IECD O=C(c1cnnc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427061 OHFGYEHVKGAEPO-INIZCTEOSA-N 445.907 2.483 10 20 IECD COc1cccc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1841991414 OOOHFWJSWFHJMH-UHFFFAOYSA-N 431.876 2.215 10 20 IECD Cc1ncccc1CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033753 BPALGGNGKSFGAA-JXMROGBWSA-N 437.496 2.356 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCn2nnc3ccccc3c2=O)cc1 105228427 ZSTJFQJUUAESJI-HXUWFJFHSA-N 435.528 2.455 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)cc1 726726460 QYRHSHIWAWDLSV-UHFFFAOYSA-N 438.484 2.376 10 20 IECD CN(C)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 728139277 ZNDAQAWLUVQVNW-UHFFFAOYSA-N 428.508 2.021 10 20 IECD Cc1nnc(SCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)n1CC(N)=O 728220087 RBJQGPQAWUQFLT-UHFFFAOYSA-N 441.513 2.226 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1 728839941 YERLPBXRLXYGLO-LJQANCHMSA-N 426.439 2.364 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1C(N)=O 729055776 APGDTGLWAKFINW-HUUCEWRRSA-N 442.491 2.102 10 20 IECD CCN(C)C(=O)c1cccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 729124410 BIAJCQWQAWCJBU-UHFFFAOYSA-N 439.512 2.293 10 20 IECD CN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)Nc1ccc(Br)cn1 729473238 SZMJIWXRBNRPNC-UHFFFAOYSA-N 434.338 2.097 10 20 IECD COc1ccc(N2CCN(C(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1 731050855 PXPIIMCPYNGZDU-UHFFFAOYSA-N 432.864 2.335 10 20 IECD CCN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 737137949 FLAPMHUXTOQBKV-LJQANCHMSA-N 449.555 2.026 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(N2CCNC2=O)ccc1Cl 742055888 RTQPLQZYRNEGRU-UHFFFAOYSA-N 448.932 2.357 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1-n1cnnn1 743193382 LYQANZBUHFHLLD-UHFFFAOYSA-N 441.467 2.093 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O)c1ccc(OC)cc1 746109515 RSVHWZJOIMUXIG-QFIPXVFZSA-N 426.473 2.029 10 20 IECD CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)=NN1c1ccccc1 750866891 ISSKBTCQGVHRFX-CVDCTZTESA-N 447.539 2.228 10 20 IECD O=c1ccc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2[nH]1 751238113 XGASTWJUCSWIFG-UHFFFAOYSA-N 427.526 2.215 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCc4c(Cl)cccc43)cc2)C1 757264516 YLXDGBFSZHIIQP-MRXNPFEDSA-N 440.931 2.247 10 20 IECD COc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1Cl 757856836 OEQLMLPLSZQULY-UHFFFAOYSA-N 437.949 2.318 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)C3CCCCC3)CC2)cc(OC)c1OC 759220971 LTSKJEBYEKZJII-UHFFFAOYSA-N 433.549 2.448 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)cc(OC)c1OC 759242382 YFOYUWZLKCUUBT-MRXNPFEDSA-N 431.533 2.152 10 20 IECD O=C1N[C@H]([C@H]2CCCOC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761094749 GQJKORMIFZKQNK-WMLDXEAASA-N 427.423 2.389 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(-c4cccnc4)s3)nc12 761614596 TWOPXVSPTHYYRC-UHFFFAOYSA-N 425.426 2.487 10 20 IECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1F 761651867 QBVJHUWOTVHORF-GFCCVEGCSA-N 433.436 2.283 10 20 IECD COC(=O)[C@H]1CCC[C@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771059015 XCYDCPFVRCTPBK-IRXDYDNUSA-N 442.516 2.416 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)cc1F 771548107 UAOHOVPFMQVUJE-INIZCTEOSA-N 440.475 2.098 10 20 IECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OC)c1 773756655 LVTAOYYYPVFTRZ-KDOFPFPSSA-N 428.485 2.467 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 773763560 RVGIFSDTHWDYBU-APWZRJJASA-N 432.542 2.387 10 20 IECD C[C@H](O)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 774246435 VQTKVTAPSXVTQC-RYRKJORJSA-N 437.968 2.191 10 20 IECD COCCN(C(=O)/C=C/c1cnn(C)c1)c1ccc(NC(=O)/C=C/c2cnn(C)c2)cc1 776966717 MLJWHPWFVLRYTR-ZVSIBQGLSA-N 434.500 2.498 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)nc(C(F)(F)F)n3)nc12 778384720 OAFLQUWJMIBQPR-UHFFFAOYSA-N 425.323 2.086 10 20 IECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1 784107849 BSLANGBNYFTEGV-UHFFFAOYSA-N 434.493 2.217 10 20 IECD Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785297643 QTKZKUIZVDNTPW-AWEZNQCLSA-N 426.448 2.476 10 20 IECD COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310174 JFAWIPPQKFPCMC-FQEVSTJZSA-N 437.540 2.384 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743042 QXVKJWGHZRUIIL-CVDCTZTESA-N 438.572 2.428 10 20 IECD O=C(COC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1)c1ccc(O)c(O)c1 801881643 SOAWYEUQNKIOHS-CALCHBBNSA-N 436.420 2.416 10 20 IECD CC[C@H](NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 803747377 PKDUYQBTONMXBV-QFIPXVFZSA-N 430.593 2.409 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)cs1 806279518 QUUOSAGNTUTKGW-UHFFFAOYSA-N 439.632 2.105 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cc4ccccc4n(C)c3=O)CC2)cc1 813611322 SPAXFKCULKTITF-UHFFFAOYSA-N 449.555 2.169 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C)c4nccn4c3)cc2F)CC1 815476448 YMIPPIRJLBJFAI-UHFFFAOYSA-N 438.507 2.179 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc(C(=O)O)cc(F)c1F 871792791 LYUIKWYDXINJAG-UHFFFAOYSA-N 426.441 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nc(-c4cccs4)no3)CC2)cc1 914530345 JCGOUYAFIWCOAD-PMERELPUSA-N 446.554 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 914804156 SIJJGNGKMSXOMA-GOSISDBHSA-N 443.544 2.068 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(C(=O)N(C)C)CC3)c2C)cc1 915217111 CDJXVZDIPUSXEY-UHFFFAOYSA-N 426.517 2.363 10 20 IECD Cn1cc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)ccc1=O 918369141 JPQUHUIWSHUVMW-UHFFFAOYSA-N 444.425 2.052 10 20 IECD Cc1cc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n([C@H]2CCS(=O)(=O)C2)n1 920873023 WIZMLCURXWEVRA-LPHOPBHVSA-N 447.561 2.270 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1)c1ccc(N2CCOCC2)cc1 920923234 OXWNTKJHUCOBGH-GOSISDBHSA-N 440.544 2.280 10 20 IECD Cc1cc(C(=O)COC(=O)c2cccc(CO)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 921228384 VUPADXOZMOPMFZ-UHFFFAOYSA-N 442.493 2.274 10 20 IECD CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1319931493 NEZKVLDATVTTJA-KRWDZBQOSA-N 444.511 2.433 10 20 IECD C[C@H]1C[C@]1(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221479 ABXOWNZMSGWYIU-BQWZEPDZSA-N 444.528 2.377 10 20 IECD CC[C@H](C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1784300373 GJPRJEWNGAIPTM-RWNQJQHJSA-N 432.517 2.233 10 20 IECD O=C(/C=C/c1cccnc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804634918 LJHRHAWVDPGVPW-AVMAXUKXSA-N 445.479 2.316 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccnn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293383 KKCVVDZCPMVYEM-AWEZNQCLSA-N 445.867 2.072 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 108432226 OLZOLMUZWSQFEY-GAJHUEQPSA-N 428.533 2.235 10 20 IECD COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NCc2c(C)c3ccccc3n2C)C1 472221899 GQHWNVKHNKNKMC-KRWDZBQOSA-N 436.578 2.069 10 20 IECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)Nc1nnc([C@H]2CCCO2)o1 727505368 XLVPVNPOCMZPNH-MRXNPFEDSA-N 447.403 2.492 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(N3CCN(C(C)=O)CC3)c([N+](=O)[O-])c2)c1 728985089 WBRTXOAHLQPKQK-AWEZNQCLSA-N 442.472 2.469 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCS(=O)(=O)N1CCSCC1 730673342 RCLULSLPMHQHPE-UHFFFAOYSA-N 440.635 2.197 10 20 IECD O=C(NCCCSc1nccs1)c1sccc1S(=O)(=O)N1CCOCC1 733883834 DHMGNBJFSGPJSV-UHFFFAOYSA-N 433.602 2.138 10 20 IECD Cc1nc(-c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2)n[nH]1 737118670 YTRRRFIJWTZIQL-UHFFFAOYSA-N 434.500 2.214 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(F)c1 737131067 KWPOJTQDQALCEV-UHFFFAOYSA-N 431.489 2.420 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc1 743363958 YRUBLIMIFFNAIK-KRWDZBQOSA-N 443.514 2.001 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)Cc1c(C)nc2nc(N)nn2c1C 743809180 OMJYVSPOTLKQIU-UHFFFAOYSA-N 433.310 2.383 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@@](C)(O)C3)c2C)c1 748831990 CLYQJZINHLVMAS-HSZRJFAPSA-N 428.485 2.307 10 20 IECD C[C@@H]1CN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C[C@@H]1C 752301248 PSHJYMVMAYZWQC-IUJSCWSOSA-N 447.582 2.321 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-c4ncco4)c3)cc2)C1 754490351 WAGMTYODFIGERP-SFHVURJKSA-N 447.495 2.298 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1Cc1ccccc1F 756767253 TYVNAONJYAMGSE-UHFFFAOYSA-N 437.475 2.162 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cncc(Cl)c3)CC2)cc(OC)c1OC 759099982 XWHZWVPKTNAIMO-UHFFFAOYSA-N 427.910 2.272 10 20 IECD COCCOc1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759200079 PDYSGQATROCFGV-UHFFFAOYSA-N 446.504 2.487 10 20 IECD C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 765329401 GQLAJVXWZSSAIV-DYESRHJHSA-N 425.529 2.498 10 20 IECD C[C@@H](NCC(=O)NCC(=O)Nc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 775259648 WODQOFTUPWZUFN-OAHLLOKOSA-N 432.471 2.207 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775647663 XLJDWYIEDKZARY-VXKWHMMOSA-N 427.637 2.061 10 20 IECD CN(C)C(=O)NCCN(C)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 775811456 PCAXTVUWCWVFCM-WYMLVPIESA-N 440.616 2.459 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CC(=O)c3ccco3)CC2)cc1 778326861 ZETUQIAXQYUBGK-FVNWOWOISA-N 425.485 2.271 10 20 IECD O=S(=O)([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCc2ccccc21 779869317 MARAQXYKJIJRQJ-UWJYYQICSA-N 430.526 2.175 10 20 IECD Cc1cc(C(=O)CN2CCN(CCO)C(C)(C)C2)c(C)n1-c1ccc2c(c1)OCCO2 781962542 MOGCJFNXPHDCIZ-UHFFFAOYSA-N 427.545 2.437 10 20 IECD CS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1Br 784486666 OGZVKGJDYYKXLR-UHFFFAOYSA-N 429.244 2.304 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(I)c1 785298539 VQRBWPPKEXWMMI-SNVBAGLBSA-N 440.237 2.388 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 785423816 HIXUNXAMGLKMOW-GOTSBHOMSA-N 438.572 2.165 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)[C@H]3C)nc12 786372086 SQEFYKCTCXNPSU-GXTWGEPZSA-N 448.476 2.300 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cnc(Br)c(OC)c3)CC2)cc1 788174773 TYXBBFKYFBHZLX-UHFFFAOYSA-N 449.349 2.413 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cnc1Br 788463112 AKGCKTKCFKUKBO-UHFFFAOYSA-N 447.333 2.451 10 20 IECD CCn1cccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1=O 790082584 HURCOWZIUVUEMU-UHFFFAOYSA-N 433.511 2.366 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(OC)cc1NS(=O)(=O)CC 790411667 LTUQXBRSYNKKDY-UHFFFAOYSA-N 430.504 2.362 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(CCO)Cc3cccnc3Cl)cc2)C1 792892738 DQLSGEQYMKJABT-GOSISDBHSA-N 445.951 2.141 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)N(C)C)cc1 793720291 NNYRAXVJFPHCAF-HSZRJFAPSA-N 438.572 2.209 10 20 IECD Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793754093 ANMGLECVCGREBZ-CYBMUJFWSA-N 435.475 2.292 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 793864184 KXMDOHMAODECGM-QGZVFWFLSA-N 441.528 2.077 10 20 IECD COc1ccc(CNC(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)c(O)c1 794381823 OTNSOCDPSXTWBC-QGZVFWFLSA-N 428.485 2.125 10 20 IECD CCN1C[C@H](CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)Oc2ccccc21 803685717 IVHWHTHXCQCQFU-FQEVSTJZSA-N 436.556 2.431 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCCC[C@H]3C(C)C)CC2)cc1 803747858 VGYPOWZGVDYBQR-VXKWHMMOSA-N 430.593 2.264 10 20 IECD CO[C@@H]1CCC[C@H]1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804108984 ASCJMCKKOPDCRM-RLFYNMQTSA-N 425.476 2.304 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1F 804852497 JDFKYKIJKCVEAJ-GOSISDBHSA-N 444.482 2.349 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(Oc3cnccn3)CC2)cc1F 804853184 MSHBZDDMYSPNPB-UHFFFAOYSA-N 429.496 2.148 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3[nH]cnc3C(=O)c3ccccc3)cc2)C1 806538941 ANPGFDNQAZYCTF-SFHVURJKSA-N 431.496 2.272 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1c(F)cccc1F 806853960 XUDNUJPSOPRFRI-HXUWFJFHSA-N 428.483 2.376 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CCN(C(=O)c2ccccc2)CC1 807289736 GRNDKQQZVOITCM-UHFFFAOYSA-N 446.551 2.442 10 20 IECD Cc1ccncc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807579507 QALOYXDZBMXLQC-LJQANCHMSA-N 435.572 2.416 10 20 IECD CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCN(C2CC2)C1 807769662 UXXVZWLAJKLYCZ-MAUKXSAKSA-N 436.503 2.068 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1O 809784072 GQDGWHMWEKRDMH-MRXNPFEDSA-N 436.509 2.436 10 20 IECD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c(C)n1-c1ccccn1 914906657 PIYKVXBDWFOXSU-OAHLLOKOSA-N 442.497 2.321 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 916485912 MBNNYBHSJISIOC-SFHVURJKSA-N 433.530 2.191 10 20 IECD CC(C)(C)CC(=O)NCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920543698 HWDMRHBUAXOXAJ-UHFFFAOYSA-N 436.464 2.496 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccccc3NS(C)(=O)=O)CC2)cc1 1317906113 OWWGKOFICJLDBJ-UHFFFAOYSA-N 432.546 2.489 10 20 IECD CC(C)c1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)co1 1777849716 YSHPFFZBGJOROR-OPAMFIHVSA-N 444.488 2.046 10 20 IECD C[C@H](Sc1cccs1)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1778809257 LFCBFLHARQCZQO-RNODOKPDSA-N 449.554 2.179 10 20 IECD Cc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787291952 JBLMRQGVCJCZQX-OWQGQXMQSA-N 445.903 2.362 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246047 HKYXTBYFDQFUFD-SITOJSDFSA-N 447.290 2.269 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cncnc2)cc1 1794823062 VPAYMXDDOBEONX-IUTQVRIDSA-N 445.523 2.401 10 20 IECD C[C@@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CC1(F)F 1804149945 LWARNGIBWGYODB-QRHKASNESA-N 430.455 2.463 10 20 IECD O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815606075 LUEQZJDVWUFAIV-LBPRGKRZSA-N 430.511 2.479 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CC2)c1cc(O)nc(O)c1 1816728564 IGVFMNIKWVCAKG-HKBFDHSMSA-N 430.511 2.050 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)c3cnoc3)sc2C1 1817464855 HTPXYLURCGSVBL-RDNKVPPGSA-N 442.453 2.187 10 20 IECD O=C(c1nn[nH]c1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501774 BZPIMAPCUHGIHA-UHFFFAOYSA-N 445.785 2.019 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc([N+](=O)[O-])o2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 21463270 KLSKHGYUMRGXTK-UHFFFAOYSA-N 447.425 2.282 10 20 IECD O=Cc1ccccc1OCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727309353 WOYCNJWFDVDZEN-UHFFFAOYSA-N 449.486 2.450 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)ccc1-n1cnnn1 731131997 XEMDNQQNWRTVIC-UHFFFAOYSA-N 433.516 2.462 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 733311089 CIWZWASIQZKIOL-UHFFFAOYSA-N 437.587 2.358 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)c1 734016784 GFEVBINOEOOFTL-UHFFFAOYSA-N 443.319 2.344 10 20 IECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 734124092 ZSMRFNWIERGPME-LJQANCHMSA-N 425.620 2.450 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(Cc4ccccn4)c3)cc2)C1 746728486 PFYLAOBKTUBXJQ-SFHVURJKSA-N 433.516 2.350 10 20 IECD CN(C)c1ccc(CNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1F 746864653 QDCTXYYPAIQELL-QGZVFWFLSA-N 435.521 2.279 10 20 IECD CN(C)c1ccc(CNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc1F 748462331 QBNVDUXVDIXXAL-UHFFFAOYSA-N 427.524 2.430 10 20 IECD Cc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C(=O)O 748673792 KYIMPCNFKAMKOQ-UHFFFAOYSA-N 438.527 2.037 10 20 IECD O=C(CN1CC[C@H]2[C@H](CCCN2C2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 749515634 NEYIBVOWROAJDD-KNQAVFIVSA-N 430.568 2.227 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(Cc4cccs4)CC3)CC2)cc1F 753856589 HQWGZMTYXKAXFK-UHFFFAOYSA-N 432.565 2.362 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](Cn3cccn3)c3ccccc3)CC2)cc1 754068838 SITQCKBQCAEFHH-ILBGXUMGSA-N 435.572 2.406 10 20 IECD COc1cc(N2CCN(CC(=O)NCCOc3ccc(F)cc3)CC2)cc(OC)c1OC 759878234 JKLORYBYGVFHSY-UHFFFAOYSA-N 447.507 2.169 10 20 IECD CCOc1ccc(O)c(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1 768201131 SGRKSCXPBLUZQI-UHFFFAOYSA-N 435.502 2.425 10 20 IECD CN1CCN(c2ccc(/C=C3\SC(=S)N(CCCN4CCOCC4)C3=O)cc2)CC1 771514610 RPEVYGUWWBOHKW-JZJYNLBNSA-N 446.642 2.362 10 20 IECD O=C(NC[C@@H](c1ccco1)N1CCCC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 774862014 AJUDXRKFLNCEJP-PMACEKPBSA-N 441.528 2.446 10 20 IECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 781440668 KSHPQGYJXDWXSD-HUUCEWRRSA-N 443.475 2.481 10 20 IECD Cc1cc(C(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1[N+](=O)[O-] 782709561 QBFJMRGCEMWIAM-UHFFFAOYSA-N 440.500 2.158 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1 784025698 IABLQJGHWKLMQR-UHFFFAOYSA-N 438.528 2.471 10 20 IECD Cc1ccc(Cn2cccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2=O)cc1 785297386 NVUNMWAMHTYUEB-MRXNPFEDSA-N 435.480 2.302 10 20 IECD Cc1cnccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818724 KNWQCHUFNDXJCR-CALCHBBNSA-N 428.508 2.118 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789818802 LCCTYOFVULLJTL-AVGNSLFASA-N 435.525 2.093 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCN2CCCC[C@@H]12 790271686 ADYZUDIRCGVUNL-LZQZEXGQSA-N 436.503 2.116 10 20 IECD CC(C)[C@@H](NCc1cccc(Br)c1O)C(=O)N(C)Cc1nnc2n1CCC2 793246455 HZVIGAHVTHTHFL-QGZVFWFLSA-N 436.354 2.465 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1 793480289 OOGHOSBJWVELGF-UHFFFAOYSA-N 445.585 2.352 10 20 IECD COc1ccc(CCCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 793761831 MMGDOLXGHLUPGU-UHFFFAOYSA-N 425.529 2.492 10 20 IECD CS(=O)(=O)CC1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 795230802 AGTQHEYJMUHGPR-UHFFFAOYSA-N 440.521 2.157 10 20 IECD CN(C)c1ccc([C@@H](CNS(=O)(=O)C[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795250266 ZLIGJYIBWWYCMX-MAUKXSAKSA-N 427.567 2.274 10 20 IECD Cc1cc(C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1ccc(Br)cc1 800550592 ZBPUQKYNDPUKMI-UHFFFAOYSA-N 442.335 2.052 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cnc(N(C)C)n3C)cc2Cl)C1 805566751 QNOADAWPGPQCLT-OAHLLOKOSA-N 446.983 2.308 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3c(C)c(C(F)(F)F)nn3C)CC2)cc1 806881873 DELFSJIJBPUZNG-UHFFFAOYSA-N 439.438 2.480 10 20 IECD O=C(NCC[C@@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807320454 JOEBWWLNOUYDJK-RDJZCZTQSA-N 425.476 2.448 10 20 IECD CN(C[C@@H]1CCCOC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769006 CUQFPJDNSVKISO-HOTGVXAUSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(C[S@](C)=O)c3)CC2)cc1 824766354 UIBKXXADRMVTGY-PMERELPUSA-N 430.526 2.079 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918293961 AEKCGPIFKPBBSP-GOSISDBHSA-N 446.525 2.332 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2o1 918440421 QXLDEQZKDBMKLA-UHFFFAOYSA-N 426.448 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3csc(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 918703479 ZWTSQXZLZZAZIG-TXEJJXNPSA-N 427.523 2.078 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H]4C[C@@H](O)C4)C3)C2)cc1 1778135763 IHMVTGAPTVSVOB-HOKHCIIBSA-N 437.540 2.309 10 20 IECD Cc1n[nH]cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781122176 SKXVSBQMXLGKJO-DYESRHJHSA-N 448.907 2.224 10 20 IECD CCOCCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792316250 XHGPLXCQNGBXPB-UHFFFAOYSA-N 435.571 2.407 10 20 IECD O=C(Cc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795218205 FROYXKPRKSWMCW-CWPLJXCYSA-N 430.888 2.197 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)Cc2cc[nH]n2)C3)cc1 1799622315 GKPZQGPJHADCHW-IRJINJETSA-N 447.539 2.263 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844067 ONMAUTNIYNNXBE-BBRMVZONSA-N 439.476 2.055 10 20 IECD Cn1cc(F)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818385145 NQHZBPNLXOPMBE-CQSZACIVSA-N 428.424 2.313 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)nc1C 1843441350 LWMMZLVGBUFRPZ-UHFFFAOYSA-N 431.496 2.308 10 20 IECD Cc1oc(CO)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 10725342 HTZSGNKMANEXRN-UHFFFAOYSA-N 446.481 2.175 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c([N+](=O)[O-])c1 740610294 WLJALNYBGZSYMB-UHFFFAOYSA-N 434.474 2.106 10 20 IECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 741181657 AOWIQARFCGEAQN-WOJBJXKFSA-N 443.592 2.082 10 20 IECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1F 746804116 UQBLTLUBWHKGIQ-HSRJRILOSA-N 438.503 2.311 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4ccccc4Cl)nn3)CC2)cc1 746847311 JPNBIAPXKNLJAY-UHFFFAOYSA-N 440.935 2.481 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)CC1 747010913 JNQXYDASAMDIBG-UHFFFAOYSA-N 427.524 2.289 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](c1ccccc1)N1CCOCC1 749131855 NJMGFYFJBHYDHA-HYBUGGRVSA-N 443.613 2.473 10 20 IECD C[C@H](C(=O)N1CCCC1)N1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 755939637 TWEFLIRFQQTUFD-GOSISDBHSA-N 437.540 2.457 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c(OC)c1 761290315 NWWOAWAPJPRADT-LBPRGKRZSA-N 444.531 2.211 10 20 IECD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1cccc(Br)c1O 765726481 HAYRYLZOQRBLSN-UHFFFAOYSA-N 430.258 2.042 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)cc1F 768055963 XHNVAMOJAZNWPB-UHFFFAOYSA-N 449.552 2.295 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1OCC(=O)N(C)C 769710580 CFDSEKDVJGCVHS-QGZVFWFLSA-N 449.529 2.112 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCS(=O)(=O)c3ccccc3C2)c1 774691355 BBRMNGVAFBDFJC-UHFFFAOYSA-N 444.553 2.217 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407071 FDGKHPDAAVCLBM-UHFFFAOYSA-N 435.477 2.082 10 20 IECD COc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1[N+](=O)[O-] 782782923 ZCLWOZARLOREIN-MRXNPFEDSA-N 429.429 2.455 10 20 IECD Cc1nc(COc2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2)no1 785304579 QDSKRHSRCJDUBK-LBPRGKRZSA-N 426.429 2.054 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1 788974781 HFLKGUOVPVDCSD-IBGZPJMESA-N 426.492 2.210 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CSCCS3)cc2F)C[C@@H](C)O1 789817178 GQKGNPQEAVQTQI-FMKPAKJESA-N 441.594 2.020 10 20 IECD Cc1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789821780 UNYOOVWXLRECTI-ZIAGYGMSSA-N 434.537 2.479 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1c1ccccc1 793732565 IPVYWTRIIXGQMN-AGHHOFFYSA-N 434.540 2.224 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1 797636301 ZRFVGEXRIUFOLO-GFCCVEGCSA-N 448.907 2.322 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1 800903929 OLXWHJLFTNXZHJ-UHFFFAOYSA-N 443.566 2.401 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)ccc1F 807006978 XDIQRGWTRGKNQJ-UHFFFAOYSA-N 448.520 2.478 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1ccccc1F 807636125 XPZGCKPNGNXGME-KRWDZBQOSA-N 429.492 2.204 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccnn2Cc2ccc(N(C)C)cc2)C(=O)NC1=S 814316297 IXJHAXGEQUMYDQ-GZTJUZNOSA-N 426.546 2.193 10 20 IECD NC(=O)CC1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916571315 ABLDEEUMROOOFG-UHFFFAOYSA-N 428.455 2.339 10 20 IECD CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676837 VSSQUTKFKGUKOF-LJQANCHMSA-N 449.598 2.054 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)cc1 917371521 BENSOMDDUBHFHS-UHFFFAOYSA-N 448.541 2.256 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(Cl)ccc3F)cc2)C1 918463193 IJYNGBTYYLWSDI-CQSZACIVSA-N 432.883 2.436 10 20 IECD COc1cccc(C(=O)N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)c1 919791621 AIUVKVRJFWBPPO-UHFFFAOYSA-N 438.528 2.199 10 20 IECD C[C@H](NC(=O)c1nc(S(C)(=O)=O)n2ccccc12)c1ccc(N2CCOCC2)cc1 921166206 LGCDZGRNIWLIET-HNNXBMFYSA-N 428.514 2.065 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)C(=O)c1ccccc1 1796932682 RIWYBFRXXGDBEM-FNLKRUPLSA-N 444.491 2.300 10 20 IECD Cc1cc(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804335795 LNDJCCCWTQAJIW-BJWYYQGGSA-N 431.583 2.416 10 20 IECD O=C(CCc1ccccn1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804708237 UTHXITIDCPSRNF-UZUQRXQVSA-N 447.495 2.235 10 20 IECD CCC(=O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811808496 CKDIZKQORKAVHJ-ACJLOTCBSA-N 431.876 2.445 10 20 IECD COc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816727421 UHDXJBFIMULROB-CYBMUJFWSA-N 440.481 2.498 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1cc(O)nc(O)c1 1817847238 PPPKVKFTNRHFTI-MRXNPFEDSA-N 437.456 2.470 10 20 IECD Nc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cs1 1827425832 ANLOAUCOTPAZBU-OAHLLOKOSA-N 431.518 2.079 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428156 KFHSYVSSCFUEBC-QAPCUYQASA-N 446.548 2.031 10 20 IECD CCCOc1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056262 XRALEUZVNBLXMB-UHFFFAOYSA-N 447.582 2.153 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)Nc3cccnc3N3CCCC3)nnc2n1 108865620 PKTXUCVIRHWQTA-UHFFFAOYSA-N 442.553 2.109 10 20 IECD O=C(Cn1c(=O)nc(O)c2ccccc21)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726626106 XNTGXVJKINJROM-UHFFFAOYSA-N 444.438 2.489 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727991003 DGXOQQQAOSDJNY-KAKWSUSISA-N 444.601 2.262 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1C(N)=O 729055775 APGDTGLWAKFINW-GJZGRUSLSA-N 442.491 2.102 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)Sc3nnnn3C3CC3)cc2F)CC1 730235174 MEIFVMSWIUCRRU-AWEZNQCLSA-N 433.557 2.086 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 737099048 CGGYURJALJGXHQ-UHFFFAOYSA-N 437.544 2.432 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)NC(=O)OC(C)(C)C)cc1 742754226 NZAZDHMTUXNJMW-MRXNPFEDSA-N 432.481 2.240 10 20 IECD COc1cc(N(C)CC(=O)NCC(=O)N[C@H](C)c2ccc(F)cc2)cc(OC)c1OC 744405832 XRFRQSAGNPWILR-CQSZACIVSA-N 433.480 2.281 10 20 IECD C[C@@H](N1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1)C(F)(F)F 749555579 QGEWFWWFAGHGSF-NVXWUHKLSA-N 441.498 2.166 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 752005537 UJWHVMSFFCCLAU-GASCZTMLSA-N 427.542 2.063 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3nc(CN4CCOCC4)cs3)CC2)cc1F 753838502 FFBBJVNCEBLLDZ-UHFFFAOYSA-N 435.525 2.477 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(Cn4cncn4)cc3)CC2)cc(OC)c1OC 759226156 VUEKTVPKURCJGH-UHFFFAOYSA-N 437.500 2.315 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCCN3Cc3ccccn3)CC2)cc(OC)c1OC 760084061 IYCVXZZFODOTNI-HXUWFJFHSA-N 440.544 2.421 10 20 IECD CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NCc3ccc(N(C)C)cc3)ccc21 760212545 XEMMHOGNHRIHFR-UHFFFAOYSA-N 438.532 2.339 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 761062688 YBGYSGJSMSSMLU-UHFFFAOYSA-N 436.512 2.389 10 20 IECD CC(C)OC(=O)C[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 766924051 MYFIOUYNJJHPMG-IBGZPJMESA-N 435.540 2.332 10 20 IECD C[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CCOCC1 771060174 WNZJCIFFYRRAKO-RHSMWYFYSA-N 444.981 2.109 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4cc(OC)c(OC)cc4C3)CC2)cc1 779219617 VUUMCWOLJZGBOG-JOCHJYFZSA-N 441.572 2.254 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1 785296821 IOSOOXFXCVECCV-OAHLLOKOSA-N 448.479 2.109 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 786655135 DRNIAGCKQNQTJF-NQIIRXRSSA-N 428.577 2.256 10 20 IECD COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 786765244 AVLMKGPBHSSYNM-HNNXBMFYSA-N 429.492 2.289 10 20 IECD CCc1nc(NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)sc1C 789355150 AVMMDWKLUNRKGD-UHFFFAOYSA-N 445.589 2.290 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789845928 WXTBPIGDAPQVHT-UHFFFAOYSA-N 429.492 2.070 10 20 IECD CN(C)c1ccc([C@H](CNS(=O)(=O)C[C@H]2CCCO2)NC(=O)OC(C)(C)C)cc1 795248650 ITALETORSIKDHY-MSOLQXFVSA-N 427.567 2.417 10 20 IECD C[C@@H](NC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 803299400 KLFFOHQSQOYWHC-LJQANCHMSA-N 447.539 2.245 10 20 IECD CC(C)N[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451521 OBMQSXOKKZKBJR-KRWDZBQOSA-N 438.519 2.362 10 20 IECD O=C(NC[C@@H]1CCCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806042475 USELCRWPGTUKAX-GJZGRUSLSA-N 431.505 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3COc4ccc(OC)cc4C3)CC2)cc1 914827459 IFJCEGPAIYVYCN-GOSISDBHSA-N 440.496 2.147 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCC3(N4CCOCC4)CCCCC3)CC2)cc1 917090036 WMAQSUQWYZBRRG-UHFFFAOYSA-N 444.620 2.359 10 20 IECD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)o1 919969778 GZLXDOTUXZHNCE-UHFFFAOYSA-N 449.573 2.495 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 920939469 HZFBXOSZHDYEIZ-UHFFFAOYSA-N 431.514 2.338 10 20 IECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1C 1116523526 CCVOHHKMPCGZRR-GJZGRUSLSA-N 432.496 2.208 10 20 IECD CCOC(=O)C1=S=c2nc(/C(Cl)=C/c3ccnn3CCCOC)nc(O)c2=C1C 1256727647 BLKATPZBHIZPSK-RAXLEYEMSA-N 436.921 2.056 10 20 IECD CC(C)(C)OC(=O)CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1793163412 ICYLTXDDBVUEMA-MUJYYYPQSA-N 433.505 2.257 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1F 1804336208 ZZUJNTOGJPMWNL-QDMKHBRRSA-N 435.546 2.246 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cnccc2F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992939 FBGIWSJFJYGLMM-XOBRGWDASA-N 437.431 2.055 10 20 IECD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)ccn1 1816725798 MCBQDFLRSIJGSQ-CYBMUJFWSA-N 425.470 2.192 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821687090 JFSSZUHEMOAWAA-SMDDNHRTSA-N 447.448 2.083 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)o1 1823497620 XOWDULOOZMLEBG-ZDUSSCGKSA-N 447.542 2.477 10 20 IECD CC/C=C(\C)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828250499 UDYCVFZWQHOSRF-LLMHMKPQSA-N 438.600 2.272 10 20 IECD Cc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1Cc1ccco1 727177011 AOMHMYHGZAPMHT-YBEGLDIGSA-N 439.584 2.497 10 20 IECD COCCN(C(=O)/C=C\c1cnc(C)s1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 732727234 GZXWVQDVYUBRHS-HJWRWDBZSA-N 441.513 2.037 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC3CCN(CC(F)(F)F)CC3)cc2)C1 742770251 MYHXPDFHZHNBRW-INIZCTEOSA-N 441.498 2.214 10 20 IECD O=C(CN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 749515632 NEYIBVOWROAJDD-DENIHFKCSA-N 430.568 2.227 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 751097195 HYBKDIZHLGDYRA-SXLOBPIMSA-N 428.577 2.289 10 20 IECD O=C(c1cnc2c(c1)c(O)nc(=O)n2C1CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 752152380 XKKFQRNYDKMPTN-KRWDZBQOSA-N 436.468 2.359 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)CC2)cc1F 753290115 NFPNXSCYLFOSGG-FQEVSTJZSA-N 441.507 2.252 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccc(OC)c(F)c4)CC3)CC2)cc1 753857084 JJNJWOMGSGLTQO-UHFFFAOYSA-N 442.535 2.314 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(F)c2I)c1O 759014127 YNRYMAIXPCUCHC-UHFFFAOYSA-N 444.200 2.399 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)c1 769915942 CYCKQHURSPSRQG-HNNXBMFYSA-N 437.905 2.343 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCOC[C@H]1C1CC1 770145126 OZZQVPQLWCCRFS-SFHVURJKSA-N 447.469 2.352 10 20 IECD CN1CCN(c2ccc(CN(C)CCN3CCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 775677171 IWVHOAQGQQQTEG-UHFFFAOYSA-N 431.625 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@H]3c3noc(C)n3)CC2)cc1 778287327 MSJFDQNRZGWISO-PISNEZEASA-N 439.516 2.345 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1Br 778913993 GHVFMWBCONYSGK-UHFFFAOYSA-N 429.292 2.041 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1 779709566 WLDYJPVAEOXXCM-ZUURVNMSSA-N 435.524 2.446 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)cc(F)c3C)c2)CC1 780407555 LEQUXTWWIQHBDD-UHFFFAOYSA-N 435.477 2.302 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3csc(C(C)(C)C)n3)CC2)cc1 785440347 YSYHZKSLMDFFDU-UHFFFAOYSA-N 443.617 2.467 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)CC(C)(C)C3)CC2)cc1 785526547 FJWJZMXDZKSQJG-LJQANCHMSA-N 430.593 2.218 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 787704846 HCPSAHOWXCTBFJ-KDURUIRLSA-N 432.634 2.340 10 20 IECD CCC(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCCC1 788318944 AGJILJAPYXIWPH-JOCHJYFZSA-N 430.593 2.156 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 788318986 JTWFCKAXGUBQGH-OAQYLSRUSA-N 445.466 2.018 10 20 IECD CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cccc21 789389334 RKKPSNVPINXEML-NRFANRHFSA-N 438.528 2.163 10 20 IECD COc1cc(OC2CC2)ccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 790365377 CEPXFYZUIZZZFE-UHFFFAOYSA-N 430.526 2.401 10 20 IECD CC(C)Oc1ncccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 792842031 QIBHJKBCGUZVKS-UHFFFAOYSA-N 431.464 2.318 10 20 IECD CCC[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793731394 DMPWGRUMCDVJNR-NTKDMRAZSA-N 428.577 2.433 10 20 IECD COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c(O)c1 794381364 PDPYHWPADMBGCQ-UHFFFAOYSA-N 440.905 2.005 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@@H](CC(C)C)C3)cc2F)CC1 805006811 GYUHGOBXOYIYHK-UXHICEINSA-N 448.583 2.294 10 20 IECD COC[C@@]1(CNC(=O)NCc2ccc(N3CCOCC3)cc2)OCCc2ccccc21 811866511 LZQAPDPWFWFKGO-XMMPIXPASA-N 425.529 2.437 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(c4ccccc4)C3=O)cc2)C1 814587906 DCWLZNYLQZOJAC-UGKGYDQZSA-N 434.540 2.448 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 914791375 OPSXZKGSVRNPGZ-UHFFFAOYSA-N 448.545 2.235 10 20 IECD CCN1C[C@@H](C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914912239 VDRCMASIYFPGLY-KBPBESRZSA-N 434.448 2.201 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 919840908 SRSKKLJAYISMQM-UHFFFAOYSA-N 441.469 2.268 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 920213498 ABMYPHSBYOLCMD-UHFFFAOYSA-N 428.558 2.427 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccn2n1 1797352299 QGXBZDKBZLAGEU-ZBTRPWJCSA-N 448.479 2.416 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992823 DJXKBAHFQOMDJR-ZHRRBRCNSA-N 435.484 2.168 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994030 DQYLORLSDKXZSX-HRAATJIYSA-N 434.452 2.227 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994271 FITHCQIQRQTKCJ-VBKZILBWSA-N 437.431 2.055 10 20 IECD C[C@H](Nc1nccs1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551374 ITKNXPWSQFWGIR-AWEZNQCLSA-N 445.545 2.295 10 20 IECD Cn1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)n1 1821291254 XGXLJZRFJWGDED-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD O=C(c1cn[nH]c1)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1838132225 CPTMIEDBWMGRIX-UHFFFAOYSA-N 448.907 2.400 10 20 IECD Cc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054321 HTHCGWDNALJECJ-UHFFFAOYSA-N 437.974 2.326 10 20 IECD CCN1CCC[C@H]1CN1C[C@@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 729626736 DFIJJDGDRFRKSU-FPOVZHCZSA-N 428.577 2.067 10 20 IECD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2=O 731856868 UTZWRHPXKVINAH-QSAZIKIQSA-N 429.517 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nccn3CC(F)(F)F)CC2)cc1 742440982 WMORSFOTIMMWIR-PMERELPUSA-N 444.479 2.052 10 20 IECD Cc1cc(-c2nnn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2)ccc1F 743822886 YLZWASYCAPYVBM-UHFFFAOYSA-N 428.443 2.080 10 20 IECD CN1CCN(Cc2cccc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)CC1 746134415 NXXYPVUNSWHPEQ-UHFFFAOYSA-N 426.536 2.340 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(NC(N)=O)cc1 749343742 HDFIAVKJBHTGPU-CRAIPNDOSA-N 438.532 2.439 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)cc1 751407229 UAIZWEDZRVXOLZ-SFHVURJKSA-N 434.562 2.152 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)(C)[C@@H]3[C@@H]3CCCO3)CC2)cc1 752974217 BZHDNTZAZKFQPG-IPKBKZEBSA-N 427.545 2.316 10 20 IECD COCCN(C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 757321705 DCFSILQVGLUIBT-UHFFFAOYSA-N 444.351 2.409 10 20 IECD CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 762615884 DXIQQZAHTKLBFE-SFHVURJKSA-N 445.564 2.054 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1NC(=O)c1ccncc1 774363767 WVZXMYAGXPAPTP-UHFFFAOYSA-N 434.452 2.351 10 20 IECD Cc1cc(I)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774363932 ZOJKJNJOIOFAPX-UHFFFAOYSA-N 440.237 2.308 10 20 IECD C[C@@H](NC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 775710333 WNUIQNOYXLSLQA-QRWLVFNGSA-N 437.500 2.156 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1 778287929 BQPKRYLDOSAAJP-RZCHSZKVSA-N 427.545 2.220 10 20 IECD O=S(=O)([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCc2ccccc21 779869309 MARAQXYKJIJRQJ-LAUBAEHRSA-N 430.526 2.175 10 20 IECD O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 779896273 LYYOZRHMDCWVPK-UHFFFAOYSA-N 437.493 2.357 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1Cn1cncn1 781401198 LDCGUIHWASMQEF-UHFFFAOYSA-N 441.557 2.014 10 20 IECD Cc1cc(=O)n(C)cc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 781971841 YCIHWCOYFVGBRU-AWEZNQCLSA-N 434.443 2.019 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 784024086 KNVCZRMWBSIHKV-UHFFFAOYSA-N 431.514 2.309 10 20 IECD CCN1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1=O 786707246 HTSPXPQMDVZVLL-UHFFFAOYSA-N 428.455 2.306 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 788318877 ADGOYCPSJGEJSA-UHFFFAOYSA-N 438.484 2.239 10 20 IECD Cc1cc(C)n(-c2ccccc2CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788318961 AHMALFHNXMNBEG-UHFFFAOYSA-N 447.539 2.258 10 20 IECD COCn1nc(C)c(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 790012769 IZDFUQNTMGDBMW-OKILXGFUSA-N 440.541 2.335 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(F)c(Br)c2)ccc1O 790408442 ZJQJPZOMWQDABU-UHFFFAOYSA-N 439.284 2.003 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2)CC1 793466117 LAVWYNUMOLOIHK-HSZRJFAPSA-N 442.560 2.155 10 20 IECD CN1CCN(S(=O)(=O)c2cccc(NCc3ccc(N4CCOCC4)c(F)c3)c2)CC1 796433285 WWDBSNWFXBRBQG-UHFFFAOYSA-N 448.564 2.211 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(NC(=O)c2ccccc2)CC1 806276929 NVDVGOFTRXAEDG-UHFFFAOYSA-N 432.571 2.163 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290147 QVUFOOHMSQVSMU-XLIONFOSSA-N 442.560 2.441 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccccc1Cn1cncn1 807387568 OGLGCLAXKWRXKS-UHFFFAOYSA-N 430.262 2.049 10 20 IECD COC(=O)C[C@@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 808295264 RZZPGJLEWKLMEQ-INIZCTEOSA-N 429.496 2.148 10 20 IECD C[C@@H](COC1CCCC1)CS(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 814996328 XCLGYPGIQHTOKG-HKUYNNGSSA-N 437.606 2.403 10 20 IECD CC(=O)Nc1cccc(-n2nnnc2SCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 913125539 QNFJIUACRWUMQK-UHFFFAOYSA-N 439.545 2.437 10 20 IECD CCN(C(=O)[C@@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 914613214 KZJOZDZGYOYBGK-SJORKVTESA-N 433.530 2.070 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(N4CCOC4=O)cc3)CC2)cc1 915508658 BRYLFHGKXFHTHM-UHFFFAOYSA-N 439.468 2.157 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(C(=O)N2CCOCC2)c1 916681714 ZZVCCNKHHQUQPA-UHFFFAOYSA-N 442.491 2.456 10 20 IECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 917365118 VIPIJFXMNGPRIS-OAHLLOKOSA-N 439.424 2.104 10 20 IECD COc1ccc(C(=O)NCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918222250 TUKQRXATSFVFFT-UHFFFAOYSA-N 426.517 2.103 10 20 IECD COc1ccccc1[C@H](C)N(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637422 DIMHXMWREGUMTC-ZDUSSCGKSA-N 436.486 2.149 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CCc3cccnc3)C2=O)cc1OCC(N)=O 1115973516 RCOQAUGKTKPUBD-YVLHZVERSA-N 429.523 2.398 10 20 IECD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603211 DSDRBPWHQQYULQ-MUJYYYPQSA-N 444.419 2.035 10 20 IECD O=C1NCc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)c(O)c(Cl)c4)C3)ccc21 1845501467 RNBSXZUFSQGJTH-UHFFFAOYSA-N 441.871 2.125 10 20 IECD CC(C)(C)c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)cn1 1847192731 PXEAEHMSNMXECQ-GJZGRUSLSA-N 446.598 2.055 10 20 IECD CC1=c2c(nc3n(c2=O)CCCCC3)=S=C1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 469037412 ODNHOGBKCRUIHX-UHFFFAOYSA-N 449.492 2.405 10 20 IECD COCCCS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 560415096 MGPIAOKCFKAIGD-UHFFFAOYSA-N 427.529 2.302 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1 726196423 PGYBOYZDNJQWTM-UHFFFAOYSA-N 435.477 2.394 10 20 IECD COCCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 727612793 SXTAENUIIGPHMP-UHFFFAOYSA-N 449.454 2.082 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C3CCN(c4cnccn4)CC3)cc2F)CC1 730194970 UESMPEOHNJFUOW-UHFFFAOYSA-N 426.540 2.290 10 20 IECD COc1ccc(O)c(CNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1 734068471 FSDZCEIOFIOAJC-UHFFFAOYSA-N 432.908 2.202 10 20 IECD C[S@@](=O)Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 734694120 MTVZZMWQIZOOPS-SSEXGKCCSA-N 449.960 2.310 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)cc2F)CC1 736392538 RFKDONUPMXKSQH-FQEVSTJZSA-N 447.599 2.268 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1F 737172741 CKXWCLIOAGGTAP-UHFFFAOYSA-N 429.448 2.345 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ncn(Cc4ccccc4)n3)CC2)cc1 737172753 CQNJNQPUAZSTJA-UHFFFAOYSA-N 434.500 2.059 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3cc4c(cc3F)NC(=O)CC4)c2)CC1 740610212 TXNXBCYNBSIDEN-UHFFFAOYSA-N 446.504 2.213 10 20 IECD CCN1CCCC[C@@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 745084962 XEDBOAWVHDUJHH-HXUWFJFHSA-N 447.557 2.342 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)c(F)cc1O 756706444 QWTCVQJOYIHRFB-VXGBXAGGSA-N 439.347 2.433 10 20 IECD C[C@@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)c1ccc(N2CCOCC2)cc1 764276453 FQFZIGZIMJNRCP-HXUWFJFHSA-N 429.609 2.253 10 20 IECD Fc1cc(CNC2CCN(c3cnccn3)CC2)ccc1N1CCN(c2ncccn2)CC1 765278672 AOLFTMQQYXNWKH-UHFFFAOYSA-N 448.550 2.491 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 769660525 NQPOORFBAAXRLR-ZDUSSCGKSA-N 441.456 2.417 10 20 IECD Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 769974067 SJXNTNUWMOPVJL-XLIONFOSSA-N 431.512 2.051 10 20 IECD C[C@H](NCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc(N2CCOCC2)cc1 775258536 DGXOTDKYFGJBLE-AVRDEDQJSA-N 449.617 2.132 10 20 IECD C[C@H](NC(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1ccc(N(C)C)cc1 775617214 JNNLUHDSFCTYCC-INIZCTEOSA-N 446.577 2.112 10 20 IECD CC(C)CN1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1=O 778128304 BLDDENRTZULKBQ-UHFFFAOYSA-N 435.436 2.311 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccccc3[N+](=O)[O-])CC2)cc1 778237125 KJUMCDDJNWQEGP-QXMHVHEDSA-N 438.484 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3CCN(C(C)(C)C)CC3)CC2)cc1 778245348 FUDUPCFMULGUHG-KTKRTIGZSA-N 428.577 2.279 10 20 IECD CCO[C@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 780417902 YTTTUPVIRRIHFQ-REWPJTCUSA-N 436.572 2.333 10 20 IECD COC(=O)[C@@H]1[C@H](O)CCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 781959315 UTJBNEFWQYSINA-GCJKJVERSA-N 428.485 2.046 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)c1=O 784057893 GTVSXQBVPJVNCA-UHFFFAOYSA-N 440.500 2.298 10 20 IECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)ccc21 785293245 FPBHUBMIFCKTTA-AWEZNQCLSA-N 425.485 2.473 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F 785296815 IMMLNBKSDCIMGH-NSHDSACASA-N 449.389 2.383 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787319684 OHKZBXHJNWXKFB-UHFFFAOYSA-N 444.557 2.047 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccsc3)N(C)C)CC2)cc1 787656919 WAGPNVQKBMDGGT-FQEVSTJZSA-N 430.574 2.215 10 20 IECD CC(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 789383329 WTYPVLJUZMYZPA-HNNXBMFYSA-N 443.573 2.397 10 20 IECD CC(C)n1cnnc1CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 795626371 TUXJGVLDFOGSBQ-IRXDYDNUSA-N 432.544 2.360 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1 797431888 APJALNIHIRRDCI-UHFFFAOYSA-N 431.364 2.059 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCOc4cc(OC)ccc4C3)CC2)cc1 801747601 SOXKZFHLQWUSCM-UHFFFAOYSA-N 440.544 2.430 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803298332 BDRVVEOLPLKQHG-KOSHJBKYSA-N 445.560 2.138 10 20 IECD CO[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC[C@H]1C 803448615 UUEQDOHJTNREIR-KDOFPFPSSA-N 425.476 2.256 10 20 IECD CN(C[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)OC(C)(C)C 803663123 KAMVYTQDMRWAGU-INIZCTEOSA-N 436.528 2.366 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(CCCN4CCOCC4)CC3)ccc21 803686666 OLKFISBGXJVSPC-UHFFFAOYSA-N 442.604 2.036 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCOC[C@H]3CCOC3)cc2Cl)C1 804931905 VQCKCXRLTPDDSI-WMZOPIPTSA-N 437.968 2.362 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(CCCN2CCOCC2)CC1)c1ccc(N(C)C)cc1 807674058 FMNDYVUDPFHIQD-IBGZPJMESA-N 430.593 2.281 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 807770947 QCQBSTCSLZFOAV-HLLBOEOZSA-N 425.476 2.399 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 809675318 JJUMLPKEPJOGAY-OAQYLSRUSA-N 445.560 2.064 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc4c(cc3Cl)NC(=O)CO4)CC2)cc1 914786983 FEPATRLAKJAJPZ-UHFFFAOYSA-N 430.892 2.440 10 20 IECD FC(F)(F)c1cc(N2CCOCC2)ccc1CNC(=S)NCCCN1CCOCC1 916025564 DLNOWAMNOKTQGG-UHFFFAOYSA-N 446.539 2.228 10 20 IECD COCCOc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 918035672 YZIDQGVEPZJXQI-KRWDZBQOSA-N 427.505 2.130 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N2C[C@@H](C(=O)OC)Oc3ccccc32)cc1 918308699 BTYOHOPDQARZCB-NRFANRHFSA-N 439.512 2.458 10 20 IECD O=C(Nc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1)NC1CC1 919839629 LCGSNFBAWJGBLN-UHFFFAOYSA-N 428.514 2.458 10 20 IECD C[C@@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 920866746 KTPZEJPZESWYSA-GOSISDBHSA-N 431.558 2.498 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3cccc(F)c3)CC2)cc1 921118615 HPMYUPYFGASUJU-QFIPXVFZSA-N 430.524 2.379 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2 1782007206 DREJTSMWAZJDNF-RNODOKPDSA-N 440.949 2.338 10 20 IECD Cc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)o1 1784667133 AKWYTHNLKUUOQY-OAQYLSRUSA-N 434.876 2.339 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1Cl 1789450040 KXBFSTPSWUJLRX-NUTKFTJISA-N 431.876 2.053 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccnc1)C2)c1cc(O)c(O)c(Cl)c1 1799767459 SHJNOSASGWHSES-MEXLWANDSA-N 443.887 2.063 10 20 IECD CC[C@H](C)[C@@H](N)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809714195 XYSHDRRPBZUSSW-AKTGSIICSA-N 445.560 2.421 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1 1814191070 GSKGHAIBFFMHEW-OXQOHEQNSA-N 446.598 2.138 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1coc(Cl)n1)CC2)c1cc(O)nc(O)c1 1816720808 AAXKOFSSYUKHQN-MRVPVSSYSA-N 435.849 2.130 10 20 IECD CO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878244 HNYIJFCHGIVXOW-AWOXUWAMSA-N 432.517 2.471 10 20 IECD Cc1ccn2ncc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)c2c1 1843307783 VTZFJJVKUKVHMN-GQCTYLIASA-N 448.479 2.290 10 20 IECD O=C(c1cc(C2CC2)on1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440887 QVPOJDWEJQMDHV-UHFFFAOYSA-N 433.468 2.162 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCc3cccc(C(N)=O)c3)cc2F)CC1 730126601 BUKFXOGQTVROOB-UHFFFAOYSA-N 427.524 2.108 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@@H](C(F)(F)F)NC3=O)cc2F)CC1 730235624 IYEGEOFHFMVCKW-YOEHRIQHSA-N 430.446 2.041 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CS(C)(=O)=O)cc2)cc1C 734807079 SSJBEZSBULUGSL-UHFFFAOYSA-N 446.572 2.102 10 20 IECD CN(C)c1ccc(CNC(=O)Cn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)cc1 734982286 QUXCASICODIDDE-UHFFFAOYSA-N 447.543 2.255 10 20 IECD CCO[C@@H](C)c1noc(CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)n1 745786686 NKNUTDVEHLRQBK-HNNXBMFYSA-N 434.516 2.400 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccnn3CC3CC3)cc2F)C[C@@H](C)O1 746354736 KHYMUXWIZAJTRO-HUUCEWRRSA-N 429.496 2.301 10 20 IECD CCOC(=O)C1CCN(C(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751938381 ZMWUDLMJHFRAGC-UHFFFAOYSA-N 431.514 2.275 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3cc(C)no3)CC2)c1 754209119 TZCWINGIWIOBRB-UHFFFAOYSA-N 428.533 2.041 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](c3ccco3)N3CCCC3)CC2)cc1 758186828 SBNXYZYUSJFQGJ-GMAHTHKFSA-N 428.577 2.198 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](S(C)(=O)=O)C1 763910303 CXOAHQFDNJYNBM-GOEBONIOSA-N 440.521 2.298 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(N4CCCCC4=O)CC3)cc2)C1 764356576 HVASUNOLPMXGDI-IBGZPJMESA-N 441.576 2.075 10 20 IECD COC(=O)[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cc(OC)cc(OC)c1 764631224 XLTKHKRDZOQRNQ-JTSKRJEESA-N 441.528 2.409 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(CCNC(C)=O)cc3)c2)CC1 769846660 BDCQILDGPVUWLM-UHFFFAOYSA-N 430.574 2.308 10 20 IECD COc1ccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N(C)C)cc1OC 774857467 FOYWVFCSQWPHOF-OXJNMPFZSA-N 442.560 2.366 10 20 IECD CN1CC=C(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 775960643 WLBZOEQRIGMNSJ-UHFFFAOYSA-N 446.485 2.093 10 20 IECD 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CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1cccc(OCCS(C)(=O)=O)c1 750766647 QTTJPCIZDWLLRM-UHFFFAOYSA-N 448.522 2.067 10 20 IECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)N3CCN(c4ccc(OC)cc4)CC3)ccc2O1 751966291 IKVVMUWHIBQBRL-NRFANRHFSA-N 446.525 2.073 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@H](CNC(=O)OC(C)(C)C)C3CC3)CC2)cc1 754401409 LHFOWCUVIOTAJC-HXUWFJFHSA-N 432.565 2.237 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCC[C@H]3CO)c2C)c1 754649164 BCWHGSPOZPFCPI-SFHVURJKSA-N 428.485 2.307 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3ccn4cc(Br)cc4c3=O)CC2)cc1 757705807 YMHQTIMNHXDXPX-UHFFFAOYSA-N 445.317 2.221 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc(OC)c1OC 759406487 SXCPHGZUGJHPTD-UHFFFAOYSA-N 449.529 2.046 10 20 IECD CCc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc12 762537332 OQFIKYJHALYHFX-UHFFFAOYSA-N 430.530 2.472 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 775259428 SPSDTTHCTQQZRD-KRWDZBQOSA-N 446.573 2.077 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1c(=O)nc(O)c2ccccc21 777828573 LMMINKAGVGCDJP-UHFFFAOYSA-N 445.859 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 778328505 OBUNGUDMFQYGLB-KTKRTIGZSA-N 448.523 2.167 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)c1 778995606 ZWEYQSDWDPHJBQ-UHFFFAOYSA-N 432.424 2.456 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)NC(C)C)cc3)c2)CC1 781045858 TVYRNBMPGXKAQQ-UHFFFAOYSA-N 444.557 2.294 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782482340 JCNREPCMASIPJA-UHFFFAOYSA-N 449.481 2.127 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1 784356265 YKSHKBLGKVOBMW-NHCUHLMSSA-N 429.586 2.297 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1 784560330 LGVWGIJAGQYQAQ-UHFFFAOYSA-N 431.514 2.353 10 20 IECD CC[C@@H]1CCCN(C(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 785526997 HUJVFYASPIADJL-HXUWFJFHSA-N 430.593 2.362 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C)c1ccc(N2CCOCC2)cc1 785596926 CAFGLCJMAACPKX-PGRDOPGGSA-N 447.539 2.340 10 20 IECD Cc1cnc(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)s1 787018291 NHNXIZOHPPUKDS-UHFFFAOYSA-N 447.538 2.475 10 20 IECD CC(C)CC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793717228 DQTWDUZGBMBZMV-PZJWPPBQSA-N 428.577 2.432 10 20 IECD O=C(NCc1cccc2c1OCO2)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793736589 FLKRSNRESXBZHQ-UHFFFAOYSA-N 447.438 2.418 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C)c(OC)c3)cc2F)CC1 793868107 LKCBZRKRGDVVNT-UHFFFAOYSA-N 442.535 2.217 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccc(N2CCOCC2)cc1 803301583 UIMPPULMYVDELQ-VRXWPRPYSA-N 427.545 2.164 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@@]2(CCOC2)O1 803677153 HDURNLIRJBWYBT-HOYKHHGWSA-N 429.561 2.478 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)cc1F 804853433 XSEGJMHRAJOKNS-PZJWPPBQSA-N 434.556 2.048 10 20 IECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCCCSc2nccs2)C2CC2)cc1 806276472 FHJKZAOWUONIMD-UHFFFAOYSA-N 432.571 2.292 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3C[C@@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 806901270 HMSUOHURFPJCRH-FVQHAEBGSA-N 433.549 2.302 10 20 IECD COc1cccc(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)c1O 807546101 PIAHMMHNQQRMOW-UHFFFAOYSA-N 427.910 2.140 10 20 IECD C[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC(C)(C)O1 807768998 CTNQNRASYUDJME-LSDHHAIUSA-N 425.476 2.399 10 20 IECD CO[C@@H](C)c1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 809331703 JLYWAWUSDVTILK-YOEHRIQHSA-N 433.530 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)CCOc3ccccc3C(C)=O)CC2)cc1 912939528 NPPAYOXPBUUVDS-HKBQPEDESA-N 444.553 2.374 10 20 IECD CN(C)c1ccc(CN(C(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)C2CC2)cc1 914724676 RYIPGPLROFRLRI-UHFFFAOYSA-N 433.530 2.171 10 20 IECD CCN1C[C@H](C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914910192 AVVOERGRSGCLBX-ZIAGYGMSSA-N 434.448 2.201 10 20 IECD CC(C)(C)C(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918008346 JSKMYGNMOOWFFF-SFHVURJKSA-N 443.592 2.225 10 20 IECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)cc1 918549291 GEVLJVKLEDSNDO-GOSISDBHSA-N 443.525 2.006 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1C(=O)c1cccs1 1116592003 MQLRUHMSHXXNPZ-JKSUJKDBSA-N 446.525 2.445 10 20 IECD Cc1ccn(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1789386832 QXYLMBBSIPOKEK-YEWWUXTCSA-N 447.919 2.305 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2[C@H]1O)c1cc(O)nc(O)c1 1793181601 YQFTYKGGDPWEAK-FWPOJJEQSA-N 437.496 2.041 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CCCCC1)C2 1804333178 GXIRMKVLTMODGZ-BTTYYORXSA-N 427.567 2.157 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C2)CC1 1805363887 TYGLQRWNVSINPO-HZPDHXFCSA-N 435.615 2.124 10 20 IECD O=C(C1CCSCC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442967 GZSGLSCBTZZUPK-UHFFFAOYSA-N 426.542 2.126 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(N2CCCS2(=O)=O)c1 117528579 QKQFXZRRMQSMDV-UHFFFAOYSA-N 433.505 2.132 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)OCCO4)cc2F)CC1 730269164 QNEPSELYJUXVMG-UHFFFAOYSA-N 435.521 2.217 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1C 736329995 PVRQZGIDJPQUOB-GOSISDBHSA-N 444.557 2.134 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC3(SC)CCOCC3)CC2)cc1 745348970 FXZLBWYAVLAGNW-UHFFFAOYSA-N 436.622 2.419 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O 745833128 VVDRCPARXJRQBU-HNNXBMFYSA-N 436.310 2.225 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCNS(=O)(=O)c1cccnc1 746326920 VELLPMMLHBTNJD-UHFFFAOYSA-N 431.562 2.192 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1S(=O)(=O)N(CC)CC 748485201 DRZUFXWTFBXBDZ-UHFFFAOYSA-N 449.529 2.076 10 20 IECD COC(=O)[C@H](C)[C@@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 751034247 YWEYERUHEQZKNA-WZONZLPQSA-N 425.529 2.484 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCN(c2cnccn2)CC1 751064402 KCWXSDXCVWUDJA-UHFFFAOYSA-N 445.526 2.007 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNCc3cc(Cl)c4c(c3)OCCO4)CC2)cc1 758209710 KEDRVXNICLTICT-LJQANCHMSA-N 447.963 2.393 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCN(CC(F)F)CC3)cc2F)C[C@@H](C)O1 767119599 LXNSOGKPGZWLCZ-IAGOWNOFSA-N 442.526 2.328 10 20 IECD O=C(c1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1)N1CCOCC1 771882561 XTZDWBWULDYBAR-UHFFFAOYSA-N 429.860 2.487 10 20 IECD CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1Cl 774294293 FNFPFYYWMTUJHB-UHFFFAOYSA-N 448.979 2.405 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H](c3ccco3)N(C)C)cc2F)C[C@@H](C)O1 774840950 GWFCZGBCKQSRCU-GQIGUUNPSA-N 446.523 2.068 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3cccs3)N(C)C)CC2)cc1 774857943 OVNPWHBKPCOJNT-LJQANCHMSA-N 430.574 2.261 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3ccnn3[C@@H]3CCS(=O)(=O)C3)CC2)cc1 776060311 VOMANDUQAXHGIK-QGZVFWFLSA-N 433.534 2.042 10 20 IECD CSCC[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 782187649 RMLXYEMHNKIJAU-SOUVJXGZSA-N 435.498 2.121 10 20 IECD Cn1ncc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C(F)F 784768370 WVZQKKQTNMGYFI-ZDUSSCGKSA-N 441.866 2.436 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@H]3c3ccc[nH]3)CC2)cc1 785527825 FYSCTOOXJKBDNN-QFIPXVFZSA-N 439.560 2.015 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3c(F)cccc3Cl)cc2)C1 786930246 DYIJLLNJIAZQAD-HNNXBMFYSA-N 446.910 2.113 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1C(=O)N1CCOCC1 787558527 IVXNLWSXKWSKGM-KRWDZBQOSA-N 438.528 2.349 10 20 IECD Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789821834 USQHLNIHTJLGGI-GASCZTMLSA-N 446.523 2.409 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC4(CCCC4)C3)cc2F)C[C@@H](C)O1 789821954 VCCFUJPSGIXQRT-IAGOWNOFSA-N 433.524 2.227 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)cc2F)C[C@H](C)O1 789822337 AEIOJOQUXOGEPR-ROUUACIJSA-N 448.583 2.388 10 20 IECD O=C(COC(=O)c1c[nH]c(C(F)(F)F)c1)NCc1ccc(N2CCOCC2)c(F)c1 796301332 SEILUNTXDVOMKR-UHFFFAOYSA-N 429.370 2.482 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21 803133629 BJEZFPZMMYERFH-GOSISDBHSA-N 444.576 2.449 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803298333 BDRVVEOLPLKQHG-MHECFPHRSA-N 445.560 2.138 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)N(C)Cc3ccccc3)CC2)cc1 805940560 TZIXOABESUDFPQ-FQEVSTJZSA-N 438.572 2.371 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 806276458 DWKHSRWUOGAYRM-LBPRGKRZSA-N 426.514 2.415 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 807290140 QPYIIVNBMBFZKJ-OAQYLSRUSA-N 446.551 2.348 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808771322 WWNQXTWTPMXSBQ-QFBILLFUSA-N 432.565 2.473 10 20 IECD O=C(CNc1cc(Cl)cc2c1OCC(=O)N2)NCc1ccc(N2CCOCC2)c(F)c1 809191595 AXASYIKKOUOZMO-UHFFFAOYSA-N 448.882 2.375 10 20 IECD O=C(N[C@@H]1CCOC2(CCSCC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809459452 YBUWFAKUZZMTLI-RTBURBONSA-N 448.585 2.461 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2N1 815835429 TUDCJWPJGKNSOY-INIZCTEOSA-N 442.903 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 897671916 CMOGTHBEKLSRGM-SFHVURJKSA-N 445.585 2.440 10 20 IECD COc1ccc(C(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC 917364680 MSIORJYFCXGZPF-GOSISDBHSA-N 428.485 2.347 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)cc2)C1 917833568 BEMUSDLYSINPQZ-QGZVFWFLSA-N 448.483 2.412 10 20 IECD COCCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918121854 ILMXKPFXIXIDBE-IBGZPJMESA-N 425.533 2.142 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1 918307574 ZFIXEJAUMGJGQQ-UHFFFAOYSA-N 426.517 2.207 10 20 IECD CN1CCN(C(=O)CCNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 919657037 OWYUTMIHFHHRNL-UHFFFAOYSA-N 427.549 2.222 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12CCC(=O)N1c1ccccc1S2 1254761681 RHOOLPRMZJLBEV-FPTDNZKUSA-N 442.493 2.317 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1F 1320989642 OSGWKSNXBOWLKJ-UHFFFAOYSA-N 434.493 2.253 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCO1)C2)c1cc(O)c(O)c(Cl)c1 1781122847 VDXDRDPGLHGNMY-CBGDNZLLSA-N 438.908 2.058 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792219114 KDMCEJVMFKBVDQ-BEODPJQWSA-N 444.528 2.233 10 20 IECD CN1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314766 UVDYLPKDXIOODT-INIZCTEOSA-N 446.598 2.075 10 20 IECD CC1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1793394734 BLBFRMSCCAILEK-AHAITQMDSA-N 443.544 2.187 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc[nH]n2)cc1 1793506179 IAEMGYCESUZRCQ-HATOLVCRSA-N 433.512 2.334 10 20 IECD C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CC1(F)F 1814073816 JESGIXGXUOTLJA-QKMWGZLOSA-N 432.427 2.253 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(O)C1)CC2)c1cc(O)c(O)c(Cl)c1 1823708115 MHLUAVUGOYMOOR-JZQLECPJSA-N 437.905 2.204 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCOC1)CC2)c1cc(O)c(O)c(Cl)c1 1823713705 QGUOFJHWXHOXRU-MWLCHTKSSA-N 437.905 2.470 10 20 IECD CO/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1828801507 YURGFGQYCCBCKZ-WCRPCQDQSA-N 439.603 2.017 10 20 IECD Cc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829438157 HCGYZNLKZTUXIU-QGZVFWFLSA-N 425.489 2.138 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1 1838031847 RCPNABDUBRWUQI-FOIQADDNSA-N 441.887 2.030 10 20 IECD Cc1cncc(CCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1842038550 LLNRFEZUBHSMHC-VMPITWQZSA-N 437.496 2.356 10 20 IECD Cc1nnnn1/C(=C/c1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 206995094 DKWSTDBWPXMCJR-KGENOOAVSA-N 434.500 2.247 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(CN3CCOCC3)cc2)n(C)c2ccccc12 555754053 JXMGCQMRLMPAMY-UHFFFAOYSA-N 434.540 2.252 10 20 IECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)C1CCCCC1 727308541 OJAKCRNUNVRIDM-PXNSSMCTSA-N 428.577 2.480 10 20 IECD O=C(CCNC(=O)c1n[nH]c2ccccc12)NCc1ccc(N2CCC(CO)CC2)cc1 728068519 QMGYLUKLJSIEPR-UHFFFAOYSA-N 435.528 2.208 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@H]3CCN(CCN4CCOCC4)C3)cc2)CC1 734669034 OKUWQXYFJOCKJV-QFIPXVFZSA-N 429.609 2.129 10 20 IECD C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 736374639 CHEWHMKPSNUPCA-ZIAGYGMSSA-N 449.495 2.259 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3CNC(=O)c3ccccc3)nc12 746678076 VUTDIZWHGORPJK-GOSISDBHSA-N 437.500 2.396 10 20 IECD O=C(NC[C@@H]1CCC[C@H](O)C1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748320963 QHOYYRYUDPNHTJ-CJNGLKHVSA-N 449.485 2.382 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cc(C(=O)OC)oc3C)n2)c[nH]1 754692800 CPZMHOYEDAWSRY-UHFFFAOYSA-N 425.444 2.414 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3CCS(=O)(=O)CC3)cc2F)C[C@@H](C)O1 756059761 XVOWUMCNNPYRJE-GASCZTMLSA-N 427.542 2.063 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 774990843 ZEMMVWCOMMDXFL-UHFFFAOYSA-N 442.535 2.046 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCO[C@@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776422328 YTNVBBHCYSYOPM-GOEBONIOSA-N 434.514 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)CN3CCCCC3)CC2)cc1 778248278 UTJKGPJSESZKLF-PISNEZEASA-N 428.577 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3[C@@H]3CCCC3=O)CC2)cc1 778404420 AYMRVEOCLMLTQQ-AMRGAXONSA-N 425.529 2.260 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)CCCN3CCN(C)CC3)cc2F)C[C@@H](C)O1 779333632 YYVHYPUPWVDABS-RTBURBONSA-N 435.588 2.218 10 20 IECD O=S(=O)(NC1CCCC1)[C@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 781919555 DETMKTNUUQWSNL-IBGZPJMESA-N 425.570 2.489 10 20 IECD CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 787829745 JIUQQDBGIXHDFU-HNNXBMFYSA-N 428.508 2.353 10 20 IECD O=C(NCCCCn1cc(Br)cn1)C(=O)NCc1ccc(N2CCCC2)cc1 788910910 GUURUVRBVVNOCE-UHFFFAOYSA-N 448.365 2.459 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCCCSc1nccs1 799255225 FDFDXRZKQRUHNF-INIZCTEOSA-N 448.570 2.298 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1F 803662292 AQHXVQZZQPAKTB-UHFFFAOYSA-N 446.910 2.146 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)OC(C)C)c2)cc1 808111127 HXSVYQUJUJUPIP-UHFFFAOYSA-N 441.531 2.237 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@@H]1CCCCS1 808854028 OFZOPEYXZBWNNT-NRFANRHFSA-N 430.618 2.237 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCCC3)cc2)cc1 810245736 GOSZSZWWJQLUEU-UHFFFAOYSA-N 444.557 2.230 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@](CO)(c4ccccc4)C3)CC2)cc1 813050708 NYHFAWIEYNDCEY-RUZDIDTESA-N 438.572 2.163 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccsc4)CC3)cc2)C1 918117187 ATIQUIXJMGWCEP-HXUWFJFHSA-N 441.601 2.477 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1 919811588 KTNFWWXAJAZHJU-UHFFFAOYSA-N 437.905 2.015 10 20 IECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1C 1116523527 CCVOHHKMPCGZRR-HUUCEWRRSA-N 432.496 2.208 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 1321269270 ZDBXEYWHHSTUSE-SWLSCSKDSA-N 434.518 2.284 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2ccc(F)cc2)cc1O 1323860324 SKVFQJPSNVPWLN-HNNXBMFYSA-N 429.404 2.032 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H]4C=CCN4)[C@H]3C2)cc1 1787403002 ZVKIGYYWSQLQFV-BIHRQFPBSA-N 448.567 2.215 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc(F)ccc1Cl 1790094258 WHCSBPDMGRECHF-KCTSRDHCSA-N 449.866 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)cc1)C1=NN(c2ccccc2)C(=O)C1 1799693592 LMHMLANILLKHLT-GGPHIMKMSA-N 432.480 2.437 10 20 IECD CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n[nH]1 1810547403 ZLCXHHIGEFWNRG-UHFFFAOYSA-N 427.505 2.498 10 20 IECD C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832221899 OOTUQCJNLIFJHM-APWZRJJASA-N 441.532 2.259 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3CN2)C1 1843342255 NZEKARIOYUOAGC-SFHVURJKSA-N 441.915 2.283 10 20 IECD CC(C)(C)n1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cn1 1847033835 ISKBUNGTWYABOW-SOFGYWHQSA-N 440.500 2.285 10 20 IECD COC(=O)[C@@H](C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 726843437 DYTLRPQVROOCMF-YESZJQIVSA-N 435.540 2.329 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740609970 QCBPCTPFFOMPBO-UHFFFAOYSA-N 435.477 2.115 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 740920372 VSTLBKUZLBTATK-UHFFFAOYSA-N 440.569 2.420 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)NC(=O)c3ccc(Cl)cc3)CC2)cc1 742917494 YGNFTSQDRIDFEP-KRWDZBQOSA-N 444.963 2.405 10 20 IECD CCN1CCC[C@@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738717 XWVQBFQVVPVHJD-LJQANCHMSA-N 441.555 2.226 10 20 IECD O=C(NCc1ccccc1O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1 748353160 MSNZBSKLYZDTAQ-UHFFFAOYSA-N 439.453 2.105 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751136966 OFLKHJKMLLCDIK-QGZVFWFLSA-N 439.555 2.474 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)o1 751354075 NQIHQNRISVPIML-CHWSQXEVSA-N 439.509 2.179 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 756483779 QEQSRZJWFXNWQY-QAPCUYQASA-N 448.541 2.487 10 20 IECD O=C(CN1CCn2c(nnc2C(F)F)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 761104266 FHRLOGNNGJUCTP-UHFFFAOYSA-N 437.406 2.445 10 20 IECD C[C@]1(CCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCC(=O)N1 769088861 VHTSKFKOHHAVNG-XMMPIXPASA-N 434.448 2.393 10 20 IECD COC(=O)c1ccnc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 770681415 KJAQSKMEYROXOX-UHFFFAOYSA-N 430.461 2.248 10 20 IECD C/C=C\C[C@@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771621305 PSGLCWRGWQOLIT-SFAKSCPVSA-N 435.458 2.158 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773987782 HKZWNYJZPYTOEX-INIZCTEOSA-N 447.557 2.273 10 20 IECD Cc1nc2ccccc2n1CCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 775103018 BXPJBGFAHRECBF-UHFFFAOYSA-N 449.555 2.346 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc([C@H](C)N2CCOCC2)c1 785295617 XMMXRZMUDZVVNK-HOTGVXAUSA-N 427.501 2.177 10 20 IECD CC(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 787342699 QJVIFDOSHGMMRU-NRFANRHFSA-N 436.556 2.444 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1 787850918 HPTLOEIVHKVQMB-UHFFFAOYSA-N 438.572 2.459 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@H](Cc2ccccc2)C1 789800772 PNMQFEYTNNAKAI-HXUWFJFHSA-N 425.504 2.370 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CN1CC1CC1 789830602 VFQGPDBAPGNPMU-UHFFFAOYSA-N 426.439 2.263 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848107 ZKMPXDSQZAWADQ-GOSISDBHSA-N 447.601 2.294 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CCOCC1 789949931 LGMJLSFUDBYQIO-CQSZACIVSA-N 443.466 2.090 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)cc1C(=O)O 790052706 IFLALGRJGLGESZ-UHFFFAOYSA-N 440.833 2.489 10 20 IECD CCN1CCC(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 793814179 MKXJQVGFWMWHMO-KRWDZBQOSA-N 438.519 2.221 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCC(=O)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796250887 MXGQQHRQESQNCI-GOEBONIOSA-N 446.525 2.473 10 20 IECD COc1ccc(CNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c(O)c1 797621019 UHQGAVMINMNISX-UHFFFAOYSA-N 425.489 2.176 10 20 IECD C[C@@](O)(CCc1ccccc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 801491039 DRTYSHSEFXPMJL-XMMPIXPASA-N 444.503 2.206 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cc1F 803663624 VFAXEMHTCBULNE-INIZCTEOSA-N 432.883 2.083 10 20 IECD CCc1ccc([C@H](O)CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 804149367 LRIJPALSFSZDEN-WHIOSMTNSA-N 437.540 2.312 10 20 IECD CS[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807759823 MJCGOUGZHXSMQH-CTNGQTDRSA-N 430.618 2.235 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 807842047 NRTMCWHWKFKEKG-HXUWFJFHSA-N 428.577 2.397 10 20 IECD Cn1c(=O)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc2ccccc21 813594109 GCLJJNKWQVOMFZ-LJQANCHMSA-N 447.539 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)CC2)cc1 813772617 MUXWSBBRNLFNRY-MXUWBQBISA-N 439.556 2.100 10 20 IECD COC(=O)C12CCC(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)(CC1)CC2 816379137 IBAZRVMJVQIQNG-UHFFFAOYSA-N 427.545 2.485 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(N)(=O)=O)cnc1C 816941040 UOFYJXPLGDIDTA-UHFFFAOYSA-N 428.308 2.168 10 20 IECD Cc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2=O)cc1 917832272 RAEKBKIHFPIWEX-YADHBBJMSA-N 448.567 2.362 10 20 IECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C(=O)O 917929527 GTAQEGXNFMZSDV-QGZVFWFLSA-N 445.541 2.182 10 20 IECD O=C(O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Cl 926496504 GEWDXGUBFOORRU-UHFFFAOYSA-N 428.869 2.492 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 1320437060 RQNDWTFOJNFGEA-STCOUPBVSA-N 432.517 2.115 10 20 IECD Cc1ccc(F)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777852818 WPPLCBGILVAISK-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CC(F)(F)C1 1802634647 NOXDZEAQBUQTSJ-ACJLOTCBSA-N 432.427 2.253 10 20 IECD CCc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)co1 1807996176 ZCZZWESUGBYIMW-VBKZILBWSA-N 437.456 2.072 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1coc(Cl)n1)CC2)c1cc(O)nc(O)c1 1816720809 AAXKOFSSYUKHQN-QMMMGPOBSA-N 435.849 2.130 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](N)CN)n[nH]2)cc1 1818016819 PVIRHISQZNUUTD-FPOVZHCZSA-N 449.559 2.409 10 20 IECD CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827426399 SNZYUTWWFVMGLC-GOSISDBHSA-N 427.505 2.325 10 20 IECD O=C(CCC(F)(F)F)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834593265 FYXMNXWUZSVDNU-UHFFFAOYSA-N 444.454 2.021 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)CC2)cc1 109033158 YQEWLFXPUMZPJV-UHFFFAOYSA-N 433.486 2.359 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)cc1F 734529346 JYFQTEHKGRHUGY-UHFFFAOYSA-N 426.489 2.458 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccn1 734971227 BULHTCAFWXVUJJ-UHFFFAOYSA-N 433.511 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCCc3nc(C4CC4)no3)CC2)cc1 740309397 YXRAZPBDSZISNC-UHFFFAOYSA-N 428.489 2.170 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCNc3ccccc3[N+](=O)[O-])CC2)cc1 742939988 OGBMNEPXCCBPIL-UHFFFAOYSA-N 442.520 2.137 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc(OC)c3OC)CC2)cc1 742940401 SKBTULNMVPBFCQ-UHFFFAOYSA-N 428.533 2.334 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccc(OC)c(C(N)=O)c1 751467176 QGODKVXDCDKSCF-UHFFFAOYSA-N 443.319 2.473 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3c(C)nc4sccn34)CC2)cc1 754071466 LSUFRPHXQODPCO-LJQANCHMSA-N 429.590 2.328 10 20 IECD COC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)c1 754181613 YHYVSHYJSXFKPL-GOSISDBHSA-N 448.491 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3scnc3Br)CC2)cc1 754962805 ZPYSLUODMUBQBL-UHFFFAOYSA-N 440.319 2.420 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncccc3OCC(F)(F)F)nc12 756464153 OBIPDOXKBGMDAE-UHFFFAOYSA-N 440.334 2.305 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(N4CCNC4=O)cc3)CC2)cc(OC)c1OC 759220977 LXTROGBBHGZTGV-UHFFFAOYSA-N 440.500 2.204 10 20 IECD O=C1N[C@@H]([C@@H]2CCCOC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761094744 GQJKORMIFZKQNK-PBHICJAKSA-N 427.423 2.389 10 20 IECD C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 766966677 OENQYSSNIDZOKV-LLVKDONJSA-N 448.391 2.288 10 20 IECD COC(=O)[C@H](COC(C)C)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767115609 LZEPTUFBWSZUST-IBGZPJMESA-N 438.480 2.299 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC([C@@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904709 GEPALKLRDJJNLH-PZJWPPBQSA-N 445.526 2.203 10 20 IECD COc1ccc(N2CCC(NC(=O)c3nccc4c(S(N)(=O)=O)cccc34)CC2)cc1 768478001 GAXVJFIRLVNWDP-UHFFFAOYSA-N 440.525 2.290 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 773741024 RYRXOOGNZHKDAQ-AWEZNQCLSA-N 443.525 2.006 10 20 IECD CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1 776433204 OHYXVFHVCGWLCM-UHFFFAOYSA-N 428.488 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](CN4CCCCC4)C3)CC2)cc1 778294585 LQYHAXITFZCLPH-YUQDSPFASA-N 440.588 2.234 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)O2 782003798 IFIRGBFIBXBWKE-AWEZNQCLSA-N 433.464 2.363 10 20 IECD O=C(NCCSc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785423738 ACASVHNEJNSPDI-UHFFFAOYSA-N 431.533 2.312 10 20 IECD C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785898079 RWRDYFAOTOLYGG-INIZCTEOSA-N 429.492 2.122 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C1 788272327 NBJVFTDUIZVLDQ-CYBMUJFWSA-N 428.580 2.257 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(C[C@H](O)c1ccc(F)cc1)C1CC1 788318532 DIVBUPGJLHJHHL-QFIPXVFZSA-N 441.503 2.003 10 20 IECD CCOC(=O)C1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCC1 791833832 MQUVMYIHGOIZLY-KHPPLWFESA-N 443.544 2.140 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCCN3CCCS3(=O)=O)cc2Cl)C1 799905250 UKJFHIJQVXPFOS-OAHLLOKOSA-N 428.986 2.411 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)c1cccc(S(=O)(=O)NC)c1 804389170 NSBPXHKNGSWUCG-MRXNPFEDSA-N 447.557 2.306 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@@H]3[C@H]5OC)CC2)cc1 806332835 BGALOTRPHNRRMY-YMTGICSTSA-N 428.577 2.272 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)n1 807287579 KQHQSXNEVDHBCD-HXUWFJFHSA-N 447.539 2.260 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1 807287670 LXKMNDZBRSDSCB-UHFFFAOYSA-N 448.523 2.160 10 20 IECD Cc1occc1C(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292044 SVCCJWURQDZYTB-UHFFFAOYSA-N 436.512 2.001 10 20 IECD CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807513016 PAURZDULICAIGA-UHFFFAOYSA-N 431.297 2.499 10 20 IECD C[C@@H]1SCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@H]1C 808854960 ORKYOFRXRRDBLA-ROUUACIJSA-N 430.618 2.187 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](n4cc(Cl)cn4)C3)cc2)C1 812009324 FTJCFDAINKHVNQ-APWZRJJASA-N 430.940 2.395 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)CC2)cc1 817020989 PCGAXNIFCPSTTQ-JPMGXVIASA-N 440.588 2.233 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918206038 VLDUTWKDNKRVAZ-UHFFFAOYSA-N 444.507 2.371 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 920193951 KPFPFTVUUKXIPR-UHFFFAOYSA-N 427.501 2.398 10 20 IECD C[C@H](NC(=O)CCNS(=O)(=O)c1ccccc1F)c1ccc(N2CCOCC2)cc1 920880704 HMYXUQLKLCQBEZ-INIZCTEOSA-N 435.521 2.208 10 20 IECD COc1ccc([C@@H](CN/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)cc1 920979847 KCJCWRKRVIPTNO-XLXASQRYSA-N 430.574 2.205 10 20 IECD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cccs1 1782473660 READKNMVTJGITP-WTBBCNCBSA-N 445.541 2.486 10 20 IECD Cc1ccsc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785508640 IIVGRFUTZAQIAG-YXMLYAQVSA-N 444.509 2.330 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccnc1)c1cc(O)c(O)c(Cl)c1 1794202332 ZQLHQUUPFIUEJL-QDMKHBRRSA-N 431.876 2.477 10 20 IECD O=C(/C=C/c1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804634917 LJHRHAWVDPGVPW-AVIWDUSBSA-N 445.479 2.316 10 20 IECD COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1816268852 OOYGBBWCNUQCDQ-HNNXBMFYSA-N 438.444 2.239 10 20 IECD COc1ccc(N2CCN(C(=O)c3nn(-c4ccccc4[N+](=O)[O-])c(C)cc3=O)CC2)cc1 69753234 KWMSTMCHZUEJKE-UHFFFAOYSA-N 449.467 2.420 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H]3C(=O)N3CCN(C)CC3)ccc21 482933237 OYXQTVBMQQHHJB-QFIPXVFZSA-N 426.561 2.283 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1)c1ccc(N2CCOCC2)cc1 731405647 GWPJYHIRHCQHLP-OAHLLOKOSA-N 437.500 2.083 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C2CCN(S(N)(=O)=O)CC2)cc1 732114312 BHAKKNYIGCOXLF-UHFFFAOYSA-N 446.573 2.210 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 734702588 AGNSWORVYVKTOS-UHFFFAOYSA-N 425.457 2.312 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741100089 RZKUEIRXTWTGBT-UHFFFAOYSA-N 427.526 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnn(C)c4)CC3)cc2F)C[C@@H](C)O1 746414554 FPXJFMOWQUPUEV-CALCHBBNSA-N 430.528 2.205 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 754026767 YAMKNAIEXZDCGO-CTNGQTDRSA-N 448.608 2.025 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1 754425604 XMOGBNAJKIGMTP-VLIAUNLRSA-N 438.484 2.128 10 20 IECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc(S(C)(=O)=O)c1 758642453 GQLLGAXFPWXPHE-UHFFFAOYSA-N 447.513 2.035 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)c(OC)c1 766201280 QKGHMENJJQTLOB-UHFFFAOYSA-N 430.276 2.428 10 20 IECD Cc1ccc(F)c(OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 767529492 PZYRPPMZTKGGFB-UHFFFAOYSA-N 434.439 2.348 10 20 IECD CC[C@@]1(C(C)C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768517804 VCQRPBKVJTUOMD-PXAQALGRSA-N 448.539 2.412 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H]2CCCC[C@@H]2N1 769025658 WUTYWKFSRGGMEX-ZWKOTPCHSA-N 440.466 2.495 10 20 IECD COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769814289 XQDRVNHMSKPDTF-UHFFFAOYSA-N 442.440 2.247 10 20 IECD CC(C)n1cnnc1[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772222068 WCOBFRXYFVTSHF-IBGZPJMESA-N 444.555 2.331 10 20 IECD Cc1c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc(Br)cc1S(N)(=O)=O 773747751 HJKGKODSWKSRQK-SECBINFHSA-N 443.319 2.177 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 776823608 ROAONFBFJNYLHI-RBUKOAKNSA-N 432.565 2.190 10 20 IECD CCN(CC)C(=O)C1(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 779222045 GKJFQPWPBDRRES-QFIPXVFZSA-N 446.636 2.339 10 20 IECD Cc1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 780822037 WLIQMHOMXYDDPK-KSMMKXTCSA-N 433.484 2.414 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2ccc(-n3cncn3)nc2)cc1 782429186 NGZNYPSYGHCYFC-UHFFFAOYSA-N 445.483 2.489 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccccc3-c3ccno3)CC2)cc1 782438992 WOTOUFPLRAGSTQ-UHFFFAOYSA-N 442.541 2.451 10 20 IECD C[C@H]1CN(Cc2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 785428853 TZLNIMZTSRFPKT-KDURUIRLSA-N 438.572 2.294 10 20 IECD COc1ccc(C)cc1CCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785525506 WFRUYKKFXUWUEJ-UHFFFAOYSA-N 443.519 2.079 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCOc3ccccc3)cc2F)CC1 785586248 BVHILYUNQZMZQN-UHFFFAOYSA-N 442.535 2.169 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1C 786119668 BJEXZWZIQRBQJT-UHFFFAOYSA-N 431.558 2.459 10 20 IECD Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787456465 ZYIVJEALUOTZRM-UHFFFAOYSA-N 443.504 2.379 10 20 IECD C[C@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787903108 JNOBLDANPZKJPV-SFHVURJKSA-N 434.556 2.049 10 20 IECD C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309207 CWWQNGSLLDIIEL-MYGHRHJXSA-N 443.569 2.096 10 20 IECD C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799728 PTJIYEIJDIZZPZ-HRAATJIYSA-N 426.492 2.283 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(COC)cc(C(=O)OC)c2)cc1 793362645 BXDAOUITJUTWMA-UHFFFAOYSA-N 442.515 2.182 10 20 IECD CCCC1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793716642 DGYVVESHYLNAPW-SKINQDTJSA-N 428.577 2.480 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061653 OAZMPCQHZXFFBI-HKUYNNGSSA-N 431.499 2.220 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC(=O)NCC(F)F 797360060 HWPXXEITQSVKBI-XFFZJAGNSA-N 433.527 2.227 10 20 IECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCCN(c2ccccc2)C1=O 806279825 ATMNPZQDGSNUQS-MRXNPFEDSA-N 432.571 2.396 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C(F)(F)F)[C@@H](CO)C3)CC2)cc1 806620323 SFVSTHIKFKGZLR-VQIMIIECSA-N 444.498 2.020 10 20 IECD O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NCc1cc(Cl)cc(Cl)c1O 807841280 WWYLBLODNJXHBB-UHFFFAOYSA-N 431.297 2.324 10 20 IECD O=C(NCC1=CCCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 807850781 SBXHSDLCIKPEAP-UHFFFAOYSA-N 433.442 2.178 10 20 IECD Cc1nc2n(n1)CCN(C(=O)C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 807955342 ULDLNWWDRRPNLL-AWEZNQCLSA-N 430.940 2.135 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(c2cc(C)nc(C)n2)CC1 808410901 OHSKZMRXRMSGAK-UHFFFAOYSA-N 438.576 2.293 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCc4nc(C)ncc4C3)CC2)cc1 916197147 VPYVVDOBEXACQQ-HXUWFJFHSA-N 438.576 2.162 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(OC)c1OC 917833847 UFAFZFYRQLCSOE-MRXNPFEDSA-N 427.501 2.344 10 20 IECD C[C@@H](NC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1)c1ccc(N2CCOCC2)cc1 920870701 AMJYYBRHIKBGMK-MRXNPFEDSA-N 437.500 2.458 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3nnc(-c4ccncc4)s3)C=C2)CC1 1333819430 OBORHVQXUOBDDE-UHFFFAOYSA-N 449.583 2.206 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2 1782008606 FQRCAZKZDMIBHP-VHICIVCISA-N 436.917 2.070 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCSC3)C2)C1 1785478408 XYBDYNQLIRZTJU-XCLFUZPHSA-N 440.949 2.338 10 20 IECD COC1(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)CCC1 1796935451 KVZICSXEWGDNHJ-GGPHIMKMSA-N 438.528 2.377 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993919 RBRBPZUISBETES-AOMKIAJQSA-N 436.468 2.433 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814191567 KQTJDKAQGOAOIU-ZCAHEHFZSA-N 446.598 2.304 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1F)CC2)c1cc(O)nc(O)c1 1816722499 JAZXTGRGKHXCKI-SNVBAGLBSA-N 429.433 2.023 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822783503 GWEXMYDAPUZKLR-BBRMVZONSA-N 439.476 2.055 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2nccn2)CC1 1830432165 RXWRZBSANNDLOZ-KRWDZBQOSA-N 447.923 2.276 10 20 IECD O=C1C[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1831417892 HRLBHLNHSMOREE-DOTOQJQBSA-N 449.935 2.121 10 20 IECD Cc1ncccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1848119753 DIZKWZIZIGQDJD-VXKWHMMOSA-N 445.523 2.317 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(OC)c(F)c3)CC2)cc1 12069009 ZFEIWCWKUAHZOT-UHFFFAOYSA-N 437.537 2.334 10 20 IECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 729524295 XUGCBRIYRUGFSH-OAQYLSRUSA-N 435.532 2.022 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1 734016953 QBGORZYXKDEFLD-CQSZACIVSA-N 430.457 2.096 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742755462 XIUOUGZFGVTYSJ-QAPCUYQASA-N 439.578 2.259 10 20 IECD CC(C)CC(=O)NCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 745203262 ILFCHUOHLJBJQH-UHFFFAOYSA-N 436.464 2.496 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(O[C@H]4CCOC4)CC3)CC2)cc1 748615671 JGKUVNVCAGXFQD-QHCPKHFHSA-N 446.592 2.187 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)Cc2c(C)nn(-c3cncc4nnnn34)c2C)cc1 749663017 MNQFNVGPJAZTRI-UHFFFAOYSA-N 447.547 2.369 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1 758989870 NQPMAFMWWZUIEU-ZDUSSCGKSA-N 432.440 2.346 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(C)c(S(C)(=O)=O)c3)CC2)cc(OC)c1OC 759240085 VWMVVCAGRNWPIG-UHFFFAOYSA-N 448.541 2.387 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 768927325 QYZUGIFVRSSSIS-QGZVFWFLSA-N 435.569 2.030 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4COc5ccccc5O4)n3)CC2)cc1 771055499 FVPIEVXTPZQEIH-HXUWFJFHSA-N 436.468 2.482 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCCC3)cc2F)C[C@@H](C)O1 774815488 LHILSYMYXBULDT-HDICACEKSA-N 448.583 2.436 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@](C)(C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 774841139 SUQBUICPGGLMAW-HUYGQZFBSA-N 448.539 2.412 10 20 IECD CCN1CCOC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775013074 MOEALEPRIKIAGB-VBKZILBWSA-N 436.464 2.053 10 20 IECD C[C@@H](NCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc(N2CCOCC2)cc1 775258537 DGXOTDKYFGJBLE-GCJKJVERSA-N 449.617 2.132 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@@H](O)c3cccc(F)c3)CC2)cc1 778391863 YMNRFEBIBYUJGN-RUYIDPMESA-N 441.503 2.277 10 20 IECD COC1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 779982786 OVXZIMPMTGDLBD-UHFFFAOYSA-N 428.512 2.311 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1 785427691 GLLZCTWGUBANQX-MRXNPFEDSA-N 432.471 2.365 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cn1 787191136 OZWFXBBTGIUQRZ-UHFFFAOYSA-N 439.560 2.292 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccnc3OCC(F)(F)F)ccc21 787280362 NQYQHCZTIARIMU-UHFFFAOYSA-N 436.434 2.338 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)CC3CCCCC3)cc2)CC1 787318058 BWFGPRZRYWCIAL-SFHVURJKSA-N 428.577 2.446 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](NC(=O)OC(C)(C)C)C3)CC2)cc1 787355186 VBDRHDFZXKWHDM-GOSISDBHSA-N 432.565 2.333 10 20 IECD Cc1cnc([C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C2CC2)s1 789834296 LLNFRWAHZYMOJG-LJQANCHMSA-N 446.548 2.435 10 20 IECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 789838688 GHKPNQPWVUDIHB-CYBMUJFWSA-N 437.518 2.500 10 20 IECD CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844427 SANZEKPSWHJQIJ-RVHYNSKXSA-N 449.567 2.359 10 20 IECD CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789845103 KDWQCAUHUFZVLI-VQTJNVASSA-N 435.540 2.065 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 792046039 ZZQNRFZSKVJLHT-WBVHZDCISA-N 433.553 2.101 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)COc1cccc(N2CCCC2=O)c1 792328164 FEWVMHQUVVLXFL-UHFFFAOYSA-N 439.512 2.460 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Cc2ccc(Br)cc2)c1 795466702 PSRDNAUPPRVKDZ-UHFFFAOYSA-N 442.287 2.495 10 20 IECD O=C(OCC(=O)C(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 800217414 OECIVWOBRXNZMT-UHFFFAOYSA-N 430.341 2.092 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803298331 BDRVVEOLPLKQHG-HOYKHHGWSA-N 445.560 2.138 10 20 IECD Cc1noc(C)c1CO[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686616 OJXKIEIPKCIHCS-IBGZPJMESA-N 426.517 2.108 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOC[C@@H]1[C@H]1CCCO1 804395412 RRPZKGMAAPJHRN-NVXWUHKLSA-N 438.527 2.275 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCC[C@@H]1N1CCOCC1 806088064 LTRJWJUMUVPKBY-VXKWHMMOSA-N 430.593 2.249 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc(OC)c1OC 807652617 XOVALMDJIYTVIM-FGTMMUONSA-N 445.560 2.446 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)cc2)CC1 808338349 HMCFBPXPHIWFEN-XZOQPEGZSA-N 442.604 2.033 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cn(C)nc3C3CC3)cc2F)C[C@@H](C)O1 812957547 VYIFXKHIBISPNU-ZIAGYGMSSA-N 429.496 2.305 10 20 IECD O=C(CSc1nnnn1C1CC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916457457 FEINDONSSJHIDY-UHFFFAOYSA-N 442.467 2.272 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1 916646988 ZRSSRTIWPJDNTG-UHFFFAOYSA-N 446.573 2.115 10 20 IECD CCOc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918464909 DQFSXECDMXSXFY-MRXNPFEDSA-N 442.491 2.181 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3cccc4cccnc34)CC2)c1 919810237 KAPJMQSXGSNJOP-UHFFFAOYSA-N 440.525 2.270 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncccc1OCC(F)(F)F 1338286843 HBOFLVLQVXGUDV-LBPRGKRZSA-N 428.363 2.338 10 20 IECD CCc1oncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004398 CMNQARCLODFZTB-FQEVSTJZSA-N 435.864 2.059 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCC=C1F 1804571316 MCCQYQZHIOLAOX-JHXTVGTDSA-N 443.541 2.231 10 20 IECD CCc1nc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)co1 1807996174 ZCZZWESUGBYIMW-JLTOFOAXSA-N 437.456 2.072 10 20 IECD C[C@H](Nc1cccnc1)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809781053 ZJELVADPWPYPKW-INIZCTEOSA-N 439.516 2.233 10 20 IECD Cn1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)n1 1821291253 XGXLJZRFJWGDED-CYBMUJFWSA-N 445.867 2.223 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)c2ncc[nH]2)CC1 1825640440 ISBHTRRKMFCNMY-QQOXCAACSA-N 440.500 2.473 10 20 IECD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1827423741 FBOUALZCVABWHH-MAUKXSAKSA-N 427.505 2.184 10 20 IECD COc1cccc2c1C[C@H](C(=O)N1CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C1)CC2 1843250731 IHXQBPFYCVQTQW-MRXNPFEDSA-N 437.496 2.124 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1C 727614953 FGCKOMSWAWRXPN-GOSISDBHSA-N 438.528 2.350 10 20 IECD C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 736376180 PUGLDPHHBJEGOE-LVQVYYBASA-N 427.542 2.156 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 743312539 FBCVFNQYERDSEQ-UHFFFAOYSA-N 449.548 2.156 10 20 IECD CC[C@@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCCC1=O 745690219 CRWZRPVMGAEWMM-SFHVURJKSA-N 434.448 2.345 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 750296496 JVNNAIQKTWDXMJ-RCZXVUMTSA-N 434.606 2.267 10 20 IECD CCN1CCN(C(=O)Cc2ccc(NC(=O)NCc3cccc(OC)c3O)cc2)CC1 751010413 LGDGZTJENXEAHN-UHFFFAOYSA-N 426.517 2.429 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1OC 751145974 OJXNBLQRZUMEKJ-UHFFFAOYSA-N 437.499 2.099 10 20 IECD C[C@@]1(CCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC(=O)N1 753418362 TUHMKDLYUDQJPQ-HSZRJFAPSA-N 440.523 2.007 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3=O)CC2)cc1F 753890000 CBIAYOUUSHCWTN-HXUWFJFHSA-N 426.492 2.467 10 20 IECD CCc1cc2c(=O)n(C[C@H](O)CN3CCN(c4ccc(OC)cc4)CC3)cnc2s1 758196017 CSTGMDXKZYHZBE-QGZVFWFLSA-N 428.558 2.212 10 20 IECD CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 758988992 UGLIGVQBKMXHLU-QGZVFWFLSA-N 430.549 2.309 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OCC(F)F)nc3)CC2)cc1 761498326 SINXECRUZSGHCO-UHFFFAOYSA-N 435.427 2.240 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C(=O)[C@H]2C1 761635102 HXEMMHVBWBRCEN-FRFSOERESA-N 437.443 2.473 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)cc2)C1 765886909 VWKHHHDRGHRXOV-RXVVDRJESA-N 441.576 2.121 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C(C)(C)C1 769913112 AITPRYKWKGXAEY-UHFFFAOYSA-N 427.523 2.235 10 20 IECD CC(C)N1CCC(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 771203821 GZSKCWYKBXZATR-UHFFFAOYSA-N 447.599 2.362 10 20 IECD COc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N(C)C)cc1OC 774856612 DSYATRJHWOIELH-HXUWFJFHSA-N 442.560 2.114 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 775259429 SPSDTTHCTQQZRD-QGZVFWFLSA-N 446.573 2.077 10 20 IECD COc1ccc(O)c([C@@H](C)NCCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 775372639 DVSWTUCCEHXJDQ-MRXNPFEDSA-N 436.530 2.151 10 20 IECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775675917 FVELZFHEWWMLOU-FYYLOGMGSA-N 427.637 2.251 10 20 IECD C[C@@H]1CN(CC(C)(C)O)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781941748 SYEWILWOERMPRZ-MRXNPFEDSA-N 435.524 2.178 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 782420776 BDPJISVDZZWAPC-UHFFFAOYSA-N 426.441 2.067 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccn1 786257429 PNXFSBWZQZHMGZ-UHFFFAOYSA-N 444.399 2.439 10 20 IECD CCOc1ncccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787283478 JOTGJYZWOKQSKU-INIZCTEOSA-N 448.470 2.483 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 789653544 ZDILGMULKGKZCU-YVRYJGMNSA-N 448.523 2.281 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc4ncccc4c3)cc2F)CC1 789696538 LRPVPGZWUATGMW-UHFFFAOYSA-N 449.530 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cc(S(=O)(=O)N4CCCC4)ccn3)CC2)cc1 797674466 WIMNXFPIWJYJCS-UHFFFAOYSA-N 445.545 2.229 10 20 IECD C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N2CCOCC2)cc1 801746143 IWACMGFPSUBYTJ-GOSISDBHSA-N 446.573 2.080 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N2CCOCC2)cc1 803310626 IHRPUOKPNWAPEA-ZWKOTPCHSA-N 448.527 2.159 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCC[C@H](S(C)(=O)=O)C2)cc1)C1CCCCC1 803677256 KMEPTRVIPYWQTE-FQEVSTJZSA-N 435.590 2.107 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)c1 803687837 IIDVZLPCOOEPQL-UHFFFAOYSA-N 448.567 2.368 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 810164938 RSUYIDDCBBEUQY-UHFFFAOYSA-N 432.546 2.086 10 20 IECD CN1CCN(c2cc(CNC(=O)NCc3ccc(N4CCSCC4)cc3)ccn2)CC1 916390818 ZCPPZCMKLHZAQR-UHFFFAOYSA-N 440.617 2.386 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 917706756 MYXYKNMZIOCUBB-UHFFFAOYSA-N 444.463 2.337 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 918303286 ACYLBKVTEKMBDC-UHFFFAOYSA-N 444.557 2.280 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-n4nc(C)cc4C)nc3)nc12 919107528 RFRRVUOJPHYLMB-UHFFFAOYSA-N 436.428 2.166 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1 919708492 HPRVMOHKLSADFK-UHFFFAOYSA-N 449.511 2.077 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(N4CCOCC4)cc3)cn2)CCO1 919791961 OMEAYVNYBAFANT-SFHVURJKSA-N 425.533 2.143 10 20 IECD CC(C)CS(=O)(=O)N1CCC(NCc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1319858023 POXXSAQGJUMNFC-UHFFFAOYSA-N 426.602 2.117 10 20 IECD CC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)CCCC1 1792219232 NDWVQLDSQRSSLR-ONQJJZRUSA-N 444.528 2.377 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cc(C2CC2)on1 1802786811 YLELYKHETXWURM-BTYIYWSLSA-N 449.467 2.387 10 20 IECD O=C(Cc1ccccc1O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729362 STHCWYUFJMBEOR-CYBMUJFWSA-N 440.481 2.123 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3ccnn3c2)[nH]n1)c1cc(O)nc(O)c1 1817847403 ZQYHCKMIMIWIDG-KRWDZBQOSA-N 447.455 2.483 10 20 IECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)sc1C 1843442378 GPODKVIZFZLCTQ-UHFFFAOYSA-N 437.525 2.370 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1 303503064 ZBFLNNNWKNJABQ-UHFFFAOYSA-N 436.500 2.456 10 20 IECD C[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)C1CCCCC1 727308545 OJAKCRNUNVRIDM-YLJYHZDGSA-N 428.577 2.480 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](N4CCCCC4=O)C3)CC2)cc1 732824198 JXARJTPIXMSFBZ-OAQYLSRUSA-N 443.592 2.004 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@@H]3COc4ccccc4O3)CC2)cc1 742948540 XOFFTSHYAJKODP-OAQYLSRUSA-N 440.544 2.299 10 20 IECD CN1C(=O)COc2ccc(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 743246825 ALDLJLMTFCUDMB-UHFFFAOYSA-N 428.464 2.464 10 20 IECD CCc1cc(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)ncn1 748618693 PPYRFUNXXZHFLT-UHFFFAOYSA-N 442.539 2.483 10 20 IECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 748672687 BTWAJDZWSQXLTI-UHFFFAOYSA-N 440.484 2.167 10 20 IECD O=C(NCCCNC(=O)c1cccs1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749018648 MPPFTVDWYPXMKD-UHFFFAOYSA-N 434.537 2.468 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)c(F)c(C(=O)OC)c2)cc1 755963228 UKTQIIANBQEAOX-UHFFFAOYSA-N 434.442 2.314 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(Cc4cccc(F)c4)nn3)CC2)cc1 759171636 KVTDLWLYQALYEV-UHFFFAOYSA-N 438.507 2.026 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C)[C@H](n4ccnc4)C3)CC2)cc1 759576412 VHBVBYFKQLXDOJ-DENIHFKCSA-N 426.565 2.306 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 762416087 NTMAOQXQADVQOH-UHFFFAOYSA-N 443.475 2.076 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1F 762427250 XDYXKVCMIUCNSN-UHFFFAOYSA-N 429.448 2.298 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 769160481 INPDUPOJFSEQHX-PKTZIBPZSA-N 448.583 2.354 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1 769914540 SNJVSEZQJDHHCN-UHFFFAOYSA-N 432.437 2.008 10 20 IECD COCCCOCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775922667 BYNALGUCFXQSGP-CQSZACIVSA-N 425.437 2.385 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-n4ccnc4)nc3)CC2)cc1 778238798 ULLCBZGUORGJIZ-CMDGGOBGSA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](C)O[C@@H](C(F)(F)F)C3)CC2)cc1 778294229 KGSQFMAWZOWDPE-YMQRJHMESA-N 441.450 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(O)CCCc4ccccc43)CC2)cc1 778296221 VPGOHVXGZQVBFV-HTOVTZSWSA-N 449.551 2.240 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCN(c2ncccc2F)CC1 788909663 GTUHKPXXGMOUJT-UHFFFAOYSA-N 425.508 2.176 10 20 IECD CCN(CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 789946169 ITTPRVQYPFENHX-UHFFFAOYSA-N 432.565 2.449 10 20 IECD CCOC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789950796 QPLRBCYFZNOGQC-HNNXBMFYSA-N 443.466 2.043 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@](C)(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298384 SMXNRVDIQINYPU-CLOONOSVSA-N 437.540 2.475 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803304996 HCNRWOBDQFCKPE-HKUYNNGSSA-N 429.517 2.057 10 20 IECD Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NCc2ccccc2O)c1 806645034 RBRVYTTYNFNNJA-UHFFFAOYSA-N 442.335 2.241 10 20 IECD C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770365 LCTLFNCSEZYDAC-GPMSIDNRSA-N 438.519 2.172 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)[C@H]1CCOC1 807954956 IXFHYULOVSORSY-WMZOPIPTSA-N 437.968 2.456 10 20 IECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C[C@@H](C)S1(=O)=O 813062907 KEMFYEKSQOAPCO-SJLPKXTDSA-N 440.585 2.075 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(-c4nncn4C)c3)CC2)cc1 918461803 MHGMVIHTFQVDCW-UHFFFAOYSA-N 434.500 2.168 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccncc3)cc2F)C[C@H](C)O1 1326553429 TUCRECKKZLZPSC-IRXDYDNUSA-N 445.491 2.211 10 20 IECD CC(=O)NCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786457050 YONWXFIFBTUWJV-UHFFFAOYSA-N 440.500 2.403 10 20 IECD Cc1nc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)o1 1804286213 PAQKJQPTFQFMGD-SEDYWJOHSA-N 427.457 2.373 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2[nH]cc3c2CCC3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994262 FHSHGFAACJEEML-AOMKIAJQSA-N 447.495 2.338 10 20 IECD CC(C)(O)CC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809432783 ABXNSBSLXSJYGN-FNORWQNLSA-N 432.517 2.209 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cn4ccccc4n3)CC2)C1 1810552229 RBFLIAXBXKMVJD-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CCC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1812568602 KIVRDQUEJGVQTE-UGSOOPFHSA-N 431.876 2.445 10 20 IECD CC(C)n1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816727314 NNLUUADUJHNILQ-LBPRGKRZSA-N 442.501 2.266 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428776 IPNBJYRAIFMECC-LPHOPBHVSA-N 441.532 2.259 10 20 IECD Cc1csc(CCC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1 1842043542 FUYOHFUDNHKAMP-UHFFFAOYSA-N 437.612 2.053 10 20 IECD O=C(c1nccc2[nH]ccc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441855 WWHHYJZENHUSIW-UHFFFAOYSA-N 442.479 2.173 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@H](CCS(C)(=O)=O)C3=O)c2C)cc1F 16573931 SQHOTCGZISLPLB-GOSISDBHSA-N 449.504 2.079 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)NN1C(=O)N[C@](C)(CCc2ccccc2)C1=O 28623659 MNWWQRQGQTVTKK-XMMPIXPASA-N 436.512 2.422 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCN3C(=O)COc4ccccc43)cc2F)CC1 303253248 BKLZAPKKFWXCDF-UHFFFAOYSA-N 440.519 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 725805836 YLVIYLFNZRAHDJ-SFHVURJKSA-N 432.565 2.190 10 20 IECD O=C(NCC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 726619752 UETFYDGZSWIVDR-UHFFFAOYSA-N 426.492 2.046 10 20 IECD CCOCCN1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 729995193 RJMCBHZLZMZRIP-KRWDZBQOSA-N 435.524 2.443 10 20 IECD Cc1cc(C(=O)COC(=O)CC2(O)CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 740982174 YWFGBUORYJWNBP-UHFFFAOYSA-N 434.514 2.163 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc(C(=O)N(C)C)c3)CC2)cc1 742940395 SCEICUJCLTYVPY-UHFFFAOYSA-N 439.560 2.018 10 20 IECD O=S(=O)(c1ccc(Cl)c(NC(=S)NCc2cccc(F)n2)c1)N1CCOCC1 747722696 VMAXQADPQVPUDC-UHFFFAOYSA-N 444.941 2.382 10 20 IECD CCOC(=O)c1cnn(-c2cccc(Cl)c2)c1NC=C1C(=O)N(C)C(=O)N(C)C1=O 747827686 JOHCKQYGZKHYFE-UHFFFAOYSA-N 431.836 2.049 10 20 IECD CCCCNC(=O)[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 747860681 LYYCNVNSDCPFKQ-HXUWFJFHSA-N 445.608 2.155 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(C(N)=O)cn3)c2C)cc1 748889814 OAQJVJSBVQKCRC-UHFFFAOYSA-N 435.436 2.414 10 20 IECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(Br)cc(C)c2O)C1 754153385 GXLRZYWHBVDYAE-MRXNPFEDSA-N 435.384 2.336 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 756337340 UHRJHOLKBAXJOG-FGZHOGPDSA-N 438.524 2.500 10 20 IECD CCOC(=O)c1cc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cn1C 759502296 ZBFUMQZSJRKITE-UHFFFAOYSA-N 429.521 2.154 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)N1CC[C@@H](CO)C1 759700603 DDELZWRPGIGPNT-AISSWFOISA-N 441.372 2.491 10 20 IECD COc1cc(N2CCN(C[C@H](O)COc3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759886627 NYVAASFHPQAZMN-KRWDZBQOSA-N 447.488 2.183 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](C)S(=O)(=O)CC1 760000738 XEUCASSCSPSREP-GJZGRUSLSA-N 440.521 2.298 10 20 IECD COC(=O)c1[nH]c(C)c(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 760083642 GGLKVSWBRKFHKJ-UHFFFAOYSA-N 431.489 2.406 10 20 IECD O=C(COc1ccc2c(c1)CCCC2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 764941328 YAQKANJPEYEUNN-UHFFFAOYSA-N 428.554 2.495 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 768917415 YYHWWFSMDZQYOJ-KRWDZBQOSA-N 437.949 2.348 10 20 IECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2)CN1 772474654 MSRVIFCWYOBYEO-QUCCMNQESA-N 437.496 2.142 10 20 IECD CCC(=O)c1cccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 772856866 SPHNLVJTICDAJO-UHFFFAOYSA-N 426.472 2.150 10 20 IECD CCOC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1C 774115577 AEYSXVSAGPZGMW-QGZVFWFLSA-N 429.473 2.054 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1(N(C)C)CCCC1 774860018 SBBSMOWYBZKKBF-UHFFFAOYSA-N 426.355 2.494 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)C2=Cc3ccccc3OCC2)cc1C(=O)O 775277396 AHOLLXYIXGZEGK-UHFFFAOYSA-N 438.483 2.322 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1 778673552 GVCHRECRINVPLX-LJQANCHMSA-N 448.589 2.163 10 20 IECD O=C(NCCCN1CCCCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 785518780 YEUASSBCMNOXGR-QGZVFWFLSA-N 438.519 2.365 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCCc3ccccc3)cc2)C1 785662051 JRUPEIZZUYIFQK-NRFANRHFSA-N 436.556 2.144 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cn4cc(Cl)ccc4n3)CC2)cc1 786502148 INJDFDQWYUFSKO-UHFFFAOYSA-N 441.919 2.351 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)CCO4)cc2F)C[C@@H](C)O1 788345718 ZIUYTARLLGCVDC-IYBDPMFKSA-N 441.503 2.307 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](CS(C)(=O)=O)C1 795091328 STERBKIHLMSSDI-HUUCEWRRSA-N 440.521 2.156 10 20 IECD COCCCS(=O)(=O)NCC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800343243 IJKJMALURZCSKK-HNNXBMFYSA-N 431.986 2.148 10 20 IECD C[C@@H](O)C[C@@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448574 CLQQVSTVDJXFTA-PBHICJAKSA-N 425.476 2.135 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685904 ONYRMNSLGHAZBP-MRXNPFEDSA-N 430.549 2.153 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ncc(C)c(OC)c3C)CC2)cc1 804316821 KNFJQODJJVJQJH-UHFFFAOYSA-N 440.544 2.459 10 20 IECD CC(C)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1=O 806259739 BVRNOZGILBXOGE-CRAIPNDOSA-N 434.968 2.318 10 20 IECD COCc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 806844478 YGDHZUQUEFPMTD-STQMWFEESA-N 436.509 2.297 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 808279522 KJPOKOQXWHUURA-UHFFFAOYSA-N 431.558 2.436 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 810354784 IMOBRQKQYIEUMC-UHFFFAOYSA-N 429.448 2.012 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 810368745 FYIIOQJDVFMNIY-LJQANCHMSA-N 446.525 2.081 10 20 IECD C[C@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1CCc1ccccc1 812057006 JRSSXXFXMMAJJV-INIZCTEOSA-N 429.546 2.473 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@]4(CCCO4)[C@@H]3C3CC3)CC2)cc1 819261431 MNUHPKDLYXNKKV-JVDVXARLSA-N 425.529 2.070 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCC(F)(F)F)cc2F)C[C@@H](C)O1 919154506 KPJWRZQUCNDNPO-BETUJISGSA-N 436.402 2.178 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1 920683111 RVYHMAYRVNAQRQ-QFIPXVFZSA-N 437.540 2.488 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nc(-c2ccsc2)no1 1321358724 AHNQUCLMLLJMAM-AWEZNQCLSA-N 431.470 2.433 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(=O)c2ccccc2o1 1796600994 OZIDYSAEIXLQKY-QDMKHBRRSA-N 435.436 2.165 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1cccc1)C2)c1cc(O)c(O)c(Cl)c1 1799770393 UJZSUDPBCSEFJO-CWPLJXCYSA-N 447.919 2.236 10 20 IECD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1827429162 QETNKBKCDLGRGT-YJBOKZPZSA-N 427.505 2.184 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 10308456 SAUHQOWGKOUOPI-UHFFFAOYSA-N 429.542 2.335 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccco4)C3)cc2F)CC1 303292433 LDNZKPQHCWKBDQ-GOSISDBHSA-N 428.508 2.226 10 20 IECD Cc1ccc(C(=O)NCCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(O)c1 728068503 PPIFDDUUFODDLC-UHFFFAOYSA-N 425.529 2.346 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 728839928 XXSPXZDCILEBEI-STEAMIEHSA-N 435.446 2.451 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1 729062380 ACIVIUXDKKOQQE-DJJJIMSYSA-N 427.457 2.334 10 20 IECD NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc3c(c2)C(=O)NC3=O)c1 729534684 BDOTWBYCOJOCLP-UHFFFAOYSA-N 428.448 2.314 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCc1ccccc1S(=O)(=O)N(C)CCO 733041618 YKJIBYCADJMIMD-UHFFFAOYSA-N 435.546 2.127 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c1 734074541 RNTKDKHURQMWGM-UHFFFAOYSA-N 425.485 2.211 10 20 IECD Cc1nn2c(SCC(=O)c3cc(C)n(-c4ccc5c(c4)OCO5)c3C)n[nH]c2nc1=O 734235270 JURUOIFTBCBKTI-UHFFFAOYSA-N 438.469 2.232 10 20 IECD NC(=O)CCOc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 743149220 FZYZKNNTBNUXDV-UHFFFAOYSA-N 430.480 2.363 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 749659545 RFAGPLPVPKGGFP-UHFFFAOYSA-N 445.541 2.214 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cc(C(=O)OC)c(C)o3)n2)c[nH]1 751128196 ZDBZNSKPIQCIMU-UHFFFAOYSA-N 425.444 2.414 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(-c4ccc(Cl)cc4)n3)nc12 751817426 CLYDQGGCNGKMER-UHFFFAOYSA-N 442.819 2.203 10 20 IECD CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CCC[C@]34NC(=O)N(C)C4=O)cc2)CC1 752010416 PFIYIQRTQDLFPM-MBSDFSHPSA-N 427.549 2.443 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)c1 756781184 VNASPGJEFCPCRU-UHFFFAOYSA-N 430.411 2.487 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(c4cccnn4)CC3)cc2F)CC1 758672686 YPHLXKLFDDDSKS-UHFFFAOYSA-N 441.555 2.226 10 20 IECD CCN1CCN(c2ccc(CN3C(=O)NC4(CCC(C(=O)OC)CC4)C3=O)cc2F)CC1 761285266 XMJCVTDDQXBUBB-UHFFFAOYSA-N 446.523 2.121 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(CN2CCOC2=O)c1 765904780 VWBXJPSFRXZGGT-UHFFFAOYSA-N 448.273 2.362 10 20 IECD CNC(=O)Cn1nc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1C 767973955 QXBDKBXNFXZMEW-UHFFFAOYSA-N 436.463 2.329 10 20 IECD CC(C)(C)[C@@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 768204481 KFXSTAVJKNBDFP-QGZVFWFLSA-N 437.474 2.238 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)CN3CCCC[C@H]3C)cc2F)C[C@@H](C)O1 768516168 BBIRHNKUWUSWCP-KURKYZTESA-N 449.571 2.428 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]2CCCC[C@H]2N1 769984453 UNOCPPPZVQQYBI-HUUCEWRRSA-N 435.527 2.138 10 20 IECD Cc1nc(S(=O)(=O)N2CCC(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cn1C 773012362 BNODPWKMBPLCBW-HNNXBMFYSA-N 433.578 2.073 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2F)C[C@@H](C)O1 774355935 FQYWLYTXHYMPCH-OKILXGFUSA-N 431.464 2.148 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CO)c3ccc(Br)cc3)nc12 782074460 KJHNUXRAKPTNJZ-HNNXBMFYSA-N 435.278 2.197 10 20 IECD CCC[C@]1(C)C(=O)NCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783871913 DNXVAZFTSCKZEQ-LJQANCHMSA-N 437.543 2.385 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1 787982284 ZOJLNIZPHOJTDW-UHFFFAOYSA-N 440.544 2.276 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 788399918 FVONDSQDWVFMHK-MSOLQXFVSA-N 441.528 2.293 10 20 IECD CO[C@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1(C)C 789816110 BUSJNEQVSIUJAP-ZHBRXAKASA-N 435.540 2.375 10 20 IECD Cc1ccncc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822972 XMXYWSIGPLBZDZ-CALCHBBNSA-N 428.508 2.418 10 20 IECD Cc1csc([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789842473 CZNNLIJALBNNIR-CYBMUJFWSA-N 434.537 2.088 10 20 IECD C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793729480 ADJJVOXZVHAUGH-YVWKXTFCSA-N 428.577 2.336 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 793844404 MRZAVMDGIXKQPM-RXVVDRJESA-N 442.560 2.493 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CC2)cc1 803721727 NEWXBLFRHZVSDA-MDZDMXLPSA-N 446.507 2.391 10 20 IECD Cc1nc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Br)n1C 804969250 ACDBAJUUIDFYIX-GFCCVEGCSA-N 443.367 2.367 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCC(F)(F)C3)cc2F)CC1 805007821 QRDLCKZGRWGPSR-MRXNPFEDSA-N 426.483 2.135 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 805202154 GHQHOYLRJGFPFH-LJQANCHMSA-N 438.915 2.254 10 20 IECD CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 806501957 NEILDFCFEICHPX-JFIYKMOQSA-N 438.519 2.362 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3nn(C)cc3Br)CC2)cc1 814382588 NSDJYBYQWYUAEL-UHFFFAOYSA-N 436.354 2.133 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C(=O)N(C)C)CC1 915217361 ZEJZFRNTWBSWBE-OAHLLOKOSA-N 434.496 2.088 10 20 IECD CC(C)n1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n1 1780381846 MNWXBTXBXDLAOK-NRFANRHFSA-N 448.907 2.286 10 20 IECD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1783237958 SFEISUVJDYKYEP-SWWFSWNPSA-N 439.512 2.424 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1coc(Cl)n1)C1=NN(c2ccccc2)C(=O)C1 1794705874 AUYJUHZXMNOVFZ-YOWGUQMCSA-N 441.875 2.373 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808467661 JFSAAOJNFFDKKJ-KXBFYZLASA-N 441.438 2.145 10 20 IECD CN1CC(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1811809155 HJFOMZBXPCDOTF-IFXJQAMLSA-N 444.919 2.027 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362393 NEYUJYYCKZXYSF-JTQLQIEISA-N 433.440 2.113 10 20 IECD Cc1cc(C)n(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844156 RYBFNYKBCSBXBX-INIZCTEOSA-N 439.476 2.035 10 20 IECD Cc1cc(C)n(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1825240692 ANVQUKPDHREIFW-IBGZPJMESA-N 441.532 2.240 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1 1832300295 RKOPEESTHYWCCN-VZSQWMKGSA-N 437.500 2.230 10 20 IECD Cc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837437502 WHBVVEGIKPPRHZ-UHFFFAOYSA-N 444.488 2.024 10 20 IECD CC(=O)Nc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)o1 1844262508 GDLCYMIRQGIMSL-UHFFFAOYSA-N 433.848 2.433 10 20 IECD O=C(c1cnc2[nH]ncc2c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501465 RIGZTWDDWHGFMU-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CC(C)(C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccn1 1846518805 ADAWOKLTHDLMOS-CSKARUKUSA-N 437.496 2.393 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 23745204 MNNPHABYVIYJRR-HXUWFJFHSA-N 431.558 2.482 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)Cc3nccn3CC(F)(F)F)CC2)cc1 727759018 MNBRGPRRZJPTPJ-UHFFFAOYSA-N 425.455 2.235 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1 729048656 FZFOSQCDJVDBBO-KRWDZBQOSA-N 426.517 2.500 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCN3C(=O)Cc4ccccc43)cc2F)CC1 730125995 SZVTXWBWLXQNDA-UHFFFAOYSA-N 439.535 2.356 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F 731356540 INPHZKMQRYVOOW-UHFFFAOYSA-N 443.566 2.401 10 20 IECD COc1ccc(O)c(CNC(=O)CNC(=O)c2ccccc2I)c1 734017630 SDVUGUNIYLBHOB-UHFFFAOYSA-N 440.237 2.052 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCN(CC(F)(F)F)CC2)c1 738069329 GQPVBUVNCOJAKU-UHFFFAOYSA-N 429.483 2.497 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCS(=O)(=O)NCC1CCC1 745812089 LBCVAWOAYQEJHS-UHFFFAOYSA-N 448.383 2.406 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)C1 746148250 VZGWZTXQUOAXPY-JOCHJYFZSA-N 449.599 2.217 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3cccc([N+](=O)[O-])c3)cc2)C1 758969859 NAHXJTUZOBOLGJ-SFHVURJKSA-N 425.489 2.338 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](NC(=O)NC2CC2)C1 760905226 FISXRYFDGPHBFC-ZBFHGGJFSA-N 446.507 2.325 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCC[C@H]1N1CCOCC1 763658692 KNLWKDRVMUONJX-DHIUTWEWSA-N 430.593 2.338 10 20 IECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765903846 NWEBDDPBXCDBBA-UHFFFAOYSA-N 436.306 2.480 10 20 IECD Cc1ncc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(N)n1 767406649 GRPDMDYOBBJWLS-NSHDSACASA-N 430.420 2.327 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)OC[C@@H]4CCCO4)n3)CC2)cc1 771067892 PKWMNPMQCBJRQS-LPHOPBHVSA-N 430.505 2.226 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)OC[C@H]4CCCO4)n3)CC2)cc1 771067897 PKWMNPMQCBJRQS-QFBILLFUSA-N 430.505 2.226 10 20 IECD COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@@H](C)c1cc(OC)ccc1O 775368820 GOEKTAHHBOWARO-XOBRGWDASA-N 425.485 2.433 10 20 IECD CNC(=O)c1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778235512 POLJOKYNXUDYNN-VAWYXSNFSA-N 436.512 2.207 10 20 IECD Cc1cc(Br)cc([C@H](C)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1O 779033647 YQHLSNJAVLXDPN-GOEBONIOSA-N 426.355 2.047 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c(F)c1 780407225 JULBMTDESMFBEH-UHFFFAOYSA-N 434.493 2.253 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1 785298899 XOCRTOFFZZSGEI-LBPRGKRZSA-N 429.864 2.077 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C[C@@H](C)O1 785864089 AFIMVUITDBCKLR-HDICACEKSA-N 430.593 2.248 10 20 IECD CC(C)(CO)CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 787041563 RTNCUOXVBAKQIL-UHFFFAOYSA-N 445.482 2.073 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 787908797 GLESPOIZVXXZSH-KDURUIRLSA-N 448.583 2.153 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 788318492 DBRXNRMJTOZVED-PMACEKPBSA-N 443.569 2.316 10 20 IECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C(F)(F)F)O1 795060588 IYSKOICWLYZCTH-KRWDZBQOSA-N 433.446 2.320 10 20 IECD O=C(COC(=O)c1cc2nccnc2cc1F)NCc1ccc(N2CCOCC2)c(F)c1 795865434 CSDLFEHALTUHKC-UHFFFAOYSA-N 442.422 2.218 10 20 IECD COC(=O)CN(CCN1CCN(C)CC1)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 799035856 NYTFQUOXYYZPKA-UHFFFAOYSA-N 430.524 2.096 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)c1 799673521 FZBMODWCVQFDPD-NSHDSACASA-N 429.445 2.018 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS(=O)(=O)CC1 802436786 VJLSHSQREMIOLI-UHFFFAOYSA-N 429.546 2.234 10 20 IECD CNC(=O)CC[C@@H]1CCCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 806333088 FJWCOGJMMNAQKY-NRFANRHFSA-N 445.608 2.298 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1 806887139 YWFCEZHFGHLPKM-LLVKDONJSA-N 429.404 2.009 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(-n4cnnn4)cc3)CC2)cc1 915314409 DEPRLXYTCLGYQV-UHFFFAOYSA-N 436.520 2.005 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C4CCCC4)CC3)CC2)cc1 916196341 BHLRGXXUKNUXMD-UHFFFAOYSA-N 429.609 2.477 10 20 IECD CCN(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCS(=O)(=O)C1 916633468 DKNVDAGKZDHRJQ-INIZCTEOSA-N 449.495 2.261 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 917929328 DKKRSKNCPPMCCY-INIZCTEOSA-N 432.502 2.083 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(C(=O)c4ccccc4)CC3)cc2)C1 918118150 WXHVINSKOOZBLS-OAQYLSRUSA-N 449.555 2.056 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2ccc(F)cc2)n1 918337815 OPHLDOAEPDHIMY-UHFFFAOYSA-N 428.489 2.176 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(CO)cc3)cc2F)C[C@@H](C)O1 918878638 YAKMIOPNLFVGKW-HZPDHXFCSA-N 430.476 2.405 10 20 IECD Cc1noc(CCCC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 919115763 RTBVKSTTXQWOJX-HUUCEWRRSA-N 448.495 2.313 10 20 IECD NS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc2c1CCC2 1318726577 JAHAPDZDKQFTGD-UHFFFAOYSA-N 431.583 2.306 10 20 IECD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]n3)CCC2)cc1)C1=NN(c2ccccc2)C(=O)C1 1788672558 RWPDCAKDDQFCEP-UHFFFAOYSA-N 443.467 2.345 10 20 IECD CC(C)Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1799715920 DMKHPIXWJXXRMW-HATOLVCRSA-N 439.512 2.208 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc4n(n3)CCCC4)CC2)C1 1810546331 BXSDCVBXGRZGIL-UHFFFAOYSA-N 439.516 2.184 10 20 IECD CN1CCCC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1814893279 NSUVLGGOFZCMRH-HOTGVXAUSA-N 428.493 2.006 10 20 IECD CC(C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824258123 NRVWRTGEBBVVFW-XDJBQHOISA-N 446.544 2.453 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cc[nH]n2)CC1 1824669101 JVDBPAXAQNSVJD-NRFANRHFSA-N 448.527 2.436 10 20 IECD CC[C@H](NC(N)=O)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1843338284 DPYIVGKUUFCPLX-FQEVSTJZSA-N 437.544 2.358 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(Cl)ccn2)C1 1844436303 PTMPKGOYHLMFQE-HWKANZROSA-N 429.860 2.382 10 20 IECD O=C(NCC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCC(O)CC2)c(F)c1 726618140 GTTOGTCQWVDJLO-UHFFFAOYSA-N 440.519 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccc(O)cc3)cc2F)C[C@H](C)O1 726872313 DYBFHRFQTHTHKE-HOTGVXAUSA-N 429.492 2.120 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC(=O)NCc3ccccc3)cc2F)CC1 730119536 VTNXITQARFMMSI-UHFFFAOYSA-N 427.524 2.083 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(C(=O)N(C)C)c3)cc2F)CC1 730268890 JDHFTWVMKPNWTI-UHFFFAOYSA-N 448.564 2.148 10 20 IECD CC(=O)N1CCN(C(=O)CCNC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 730825116 QWTQOMDZXLMLJL-UHFFFAOYSA-N 443.592 2.336 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1ccc(N2CCCS2(=O)=O)cc1 735315192 GDQLUCUOHRZHLW-UHFFFAOYSA-N 433.602 2.144 10 20 IECD CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H](C)CS(C)(=O)=O 744399355 KHATXZWEVKOUEO-AWEZNQCLSA-N 428.510 2.156 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 749642377 HGXVCCZJFBSBCT-ZDUSSCGKSA-N 435.502 2.368 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1F 753858144 TUHBMTHIIBVPSB-SFHVURJKSA-N 427.524 2.089 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1=O 754462803 SKTWDJBJEBLMKN-MRXNPFEDSA-N 428.489 2.131 10 20 IECD CN(C)c1ccc(CNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1F 755307315 DPNMYGMLUJCIOA-UHFFFAOYSA-N 426.436 2.005 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cnc(Cl)cc3C)CC2)cc(OC)c1OC 759409249 JMVPUUSCQKQRSK-UHFFFAOYSA-N 448.907 2.357 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1cc(-n2nnnc2C2CC2)ccc1F 759590243 VVVDJDJCQAWCLY-WAPJZHGLSA-N 439.403 2.285 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1csc(-c2ccccn2)n1 762637389 RCUJIUGINLVPGT-UHFFFAOYSA-N 441.488 2.436 10 20 IECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 769025855 VTWDHABOOKMKPT-UHFFFAOYSA-N 449.555 2.432 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](CO)Cc2ccccc2C(F)(F)F)c1 769384680 MTSXVJDDAHDHNI-LBPRGKRZSA-N 446.447 2.364 10 20 IECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1C 774145033 GOWUCQADXXLYNQ-UHFFFAOYSA-N 430.530 2.010 10 20 IECD O=C(NCc1ccc(O)c(O)c1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 778918251 HZWZRCVKVONIIL-UHFFFAOYSA-N 428.466 2.212 10 20 IECD CCC[C@H](C)NC(=O)[C@H]1CCCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779222171 WDOAEJGJAVLUSU-QNWVGRARSA-N 446.636 2.195 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2)C[C@@H](O)C(F)(F)F)c1 781372842 YQTQGMIBDZLODH-MRXNPFEDSA-N 432.420 2.329 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@H]3CCC[C@@H](C)C3)CC2)cc1 785527601 MDGWPAABMBGCCF-CTNGQTDRSA-N 430.593 2.361 10 20 IECD COc1c([N+](=O)[O-])ccc(CNC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 789776019 WKMDJYYNTUSEFR-KRWDZBQOSA-N 447.463 2.255 10 20 IECD O=C(NCC[C@@H]1CCCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950337 OKGDFYFCENQQLP-KRWDZBQOSA-N 443.466 2.234 10 20 IECD C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 793911357 AMVUAFXIKOKCNJ-PMACEKPBSA-N 444.620 2.354 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298388 SMXNRVDIQINYPU-UQBPGWFLSA-N 437.540 2.475 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663743 YUQMXPOXCUFNAP-UHFFFAOYSA-N 440.519 2.237 10 20 IECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 803975923 RSLPMFYPUGZPPU-IBGZPJMESA-N 436.556 2.049 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@](O)(C(F)(F)F)CC3)cc2)C1 806494199 MVYXHQNCYMLRIN-OXQOHEQNSA-N 442.482 2.377 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 807101796 BSWNPPQOHZXFFT-NRFANRHFSA-N 436.556 2.027 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2)CC1 808338347 HMCFBPXPHIWFEN-PKTZIBPZSA-N 442.604 2.033 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)c1 813614797 RCMCELQZEBTDIF-GOEBONIOSA-N 436.490 2.366 10 20 IECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n1 815446853 FUAKBMPAECLHJD-UHFFFAOYSA-N 430.530 2.231 10 20 IECD COCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 917918498 SBKFWPVXGJWNSZ-UHFFFAOYSA-N 438.521 2.474 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(-c2nncn2C)c1)c1ccc(N2CCOCC2)cc1 920922600 GQLUQBHZTMQDDS-INIZCTEOSA-N 434.500 2.135 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2c(C)cnc2O)cc1 1320519744 LZFDUELFEYWKOY-KRWDZBQOSA-N 425.441 2.202 10 20 IECD CC1=CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CC1 1777847996 GVPRTZPNGOCGQB-JTUHZDRVSA-N 429.517 2.367 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(F)cc1 1780414310 RVEUGRVLAZSKKJ-VGOFRKELSA-N 429.448 2.073 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c(C)c1 1789501572 ACBSOMLQRHKKDN-SNRMKQJTSA-N 425.485 2.017 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1807993985 BLEULKJOBSXRBM-KXBFYZLASA-N 437.456 2.126 10 20 IECD CC[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)N(CC)CC 1816720377 OHTXOENRWAJFNH-ZFWWWQNUSA-N 447.561 2.296 10 20 IECD O=C(COc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722636 SIRVFXISBNJKEG-CYBMUJFWSA-N 440.481 2.254 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(F)n1)CC2)c1cc(O)nc(O)c1 1816726466 WRLHEHYFPSKQNL-JTQLQIEISA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1cc(O)nc(O)c1 1817846222 LAMNACSYBABSGT-CQSZACIVSA-N 426.408 2.370 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3[nH]cc4c3CCC4)sc2C1)c1cc(O)nc(O)c1 1821198238 KUQRMDHDYHGPOE-LBPRGKRZSA-N 439.497 2.306 10 20 IECD CO[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823713912 UJYXISICNQPRFI-WPRPVWTQSA-N 425.894 2.468 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1824843702 CHSDEZFDDIBWTL-LBPRGKRZSA-N 441.488 2.350 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)COc2cccnc2)CC1 1825064828 OUUFQKXYCDMCGI-IBGZPJMESA-N 440.500 2.200 10 20 IECD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502212 AJBQOYGGPGOZJX-HUUCEWRRSA-N 448.903 2.324 10 20 IECD O=C(Cc1ccccc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039262 YMFWANDRFNUQKE-VQHVLOKHSA-N 426.444 2.402 10 20 IECD Cc1cc(NC(=O)COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n(C)n1 105344360 BCQXTSOBWXEGFD-UHFFFAOYSA-N 448.391 2.208 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(N4CCCC4=O)CC3)cc2F)CC1 303340613 WBKLLKGQQKTVJD-UHFFFAOYSA-N 431.556 2.264 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726727201 OHHZCVGZDIIYCO-UHFFFAOYSA-N 429.448 2.345 10 20 IECD Cc1cc(C(=O)[C@@H](C)N2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(OC(F)F)cc1 730806625 QGBHSIYLZNGBDG-MRXNPFEDSA-N 434.487 2.370 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 732984517 BIDAFDVJYAZGPU-DEOSSOPVSA-N 449.599 2.134 10 20 IECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NCc2cccc(OC)c2O)n1 737285935 NOTKBDFWQLQFGD-UHFFFAOYSA-N 438.440 2.018 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-c4noc(C)n4)c3)CC2)cc1F 754211686 KFLGRQTVOJXIQZ-UHFFFAOYSA-N 439.447 2.480 10 20 IECD COc1ccc(N2CCC(NC(=O)N(C)[C@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 771767981 YUOWCCXUPXFTPL-QFIPXVFZSA-N 429.609 2.474 10 20 IECD C[C@@]1(C2CCCCC2)NC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772876371 RFQYBILXIOEGTK-QHCPKHFHSA-N 446.523 2.169 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 774873110 FZFGRQQYKSSVHN-UHFFFAOYSA-N 442.520 2.124 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1cccc(NC(=O)CCN2CCOCC2)c1 779500372 PCKFZPGZBQWNTQ-ALCCZGGFSA-N 425.485 2.088 10 20 IECD CCOC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781440768 NQTRMRDQLJJYAM-UHFFFAOYSA-N 429.448 2.094 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3[C@@H]3CCCC3=O)cc2F)C[C@@H](C)O1 784355118 DNNKCRUXMXDLIA-WCIYBSDLSA-N 447.551 2.126 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCn3c(C)nc4ccccc43)CC2)cc1 785498067 WFGDZCAUHOQLLT-UHFFFAOYSA-N 435.528 2.208 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@@H]3CCC[C@@H](C)C3)CC2)cc1 785529814 YLMAVQCLVNJUOX-WOJBJXKFSA-N 430.593 2.266 10 20 IECD COCCN(Cc1ccc(C)cc1C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313102 QBBNTWGCEMEGKL-UHFFFAOYSA-N 439.556 2.431 10 20 IECD COCC1(C)CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789834536 MRZKRGYAVVEFHV-IAGOWNOFSA-N 435.540 2.331 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCC1 793727073 VOMZLNOWZFPGDA-GOSISDBHSA-N 428.577 2.337 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 793808969 CQYSCEBMPIGNRA-CYFREDJKSA-N 430.593 2.361 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)CCc2cccc(Cl)c2)cc1C(=O)O 794761761 GYQZJDSITRGTAU-UHFFFAOYSA-N 432.907 2.394 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(F)c1 795113829 UGSMWXHVQJHCKC-UHFFFAOYSA-N 436.505 2.300 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c(O)c1 797390567 YPWYSBUVYPCZOR-UHFFFAOYSA-N 431.342 2.330 10 20 IECD C[C@@H](NCCS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 799321524 GJBXUURBDGWFRY-MRXNPFEDSA-N 439.603 2.127 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(CCO)Cc1ccccc1 807770150 YWOKERIPTIGJOT-SFHVURJKSA-N 447.482 2.394 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NCc1cc(Cl)cc(Cl)c1O 807841320 XVYRKJYSCKHEJG-VIFPVBQESA-N 435.333 2.033 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 808609933 JCPXUYCBRGQTQB-IBGZPJMESA-N 446.910 2.391 10 20 IECD CCOc1nc2ccc(C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)cc2[nH]1 815441553 ABYIYXAMVSVBMJ-UHFFFAOYSA-N 438.484 2.476 10 20 IECD Cc1cc(NC(=O)CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 823801474 GJEGHXYAKFTSPQ-UHFFFAOYSA-N 448.391 2.377 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C(=O)N(C)C)CC1 915217250 ROFPQLNVBXRONI-HNNXBMFYSA-N 434.496 2.088 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccnc1N1CCCCC1 918286906 LZBYSTKWMBBDOS-UHFFFAOYSA-N 441.507 2.303 10 20 IECD CC(C)S(=O)(=O)CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919601669 WVHDGIHDOZALQA-CYBMUJFWSA-N 443.477 2.155 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 919839117 BPBVVKNLLSNIJN-FQEVSTJZSA-N 443.525 2.291 10 20 IECD Cc1c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 920015403 ZJJYJSJMJWCYSN-UHFFFAOYSA-N 434.430 2.299 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)CSc1cccc(F)c1 1117114924 XFIOAKWEHGBUJT-KKSFZXQISA-N 437.489 2.371 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1321299147 OWPSMNGZLSMPER-UHFFFAOYSA-N 430.461 2.145 10 20 IECD CCOC(=O)c1ncc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 1346586642 CENITAYIGDUUHM-UHFFFAOYSA-N 435.502 2.308 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCn1cccc1 1798564547 HGNWPQMRXSVJOP-BJWYYQGGSA-N 448.614 2.157 10 20 IECD O=C(CS[C@H]1CCCCO1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038975 WIMSNAICRYVXOT-FNQPIQQGSA-N 448.541 2.280 10 20 IECD O=C(c1nc2ccccc2o1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039316 FAWDUXNRCWXTMG-VQHVLOKHSA-N 435.436 2.475 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 11193299 KXXIANZZJCEFSA-QHCPKHFHSA-N 437.540 2.082 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1 728980259 YZRUDDMPFXNJRJ-PBHICJAKSA-N 434.514 2.349 10 20 IECD O=C(CNC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 732274125 KZFAQHLXWQCWMX-UHFFFAOYSA-N 426.492 2.046 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(NC(=O)N(C)C)c3)CC2)cc1 740366769 JENQBFRLSKBSBP-UHFFFAOYSA-N 440.500 2.294 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)cc1 742597849 RWDZPNVXAYXTIC-UHFFFAOYSA-N 440.979 2.488 10 20 IECD COC(=O)COc1cccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743294682 UOWBATDMLDTFGW-UHFFFAOYSA-N 442.516 2.191 10 20 IECD CCN(CC)c1ccc(CNC(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)cc1F 747569700 FUTZHKZQKYPTBV-UHFFFAOYSA-N 432.500 2.049 10 20 IECD CCc1nnc(O)c(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1CC 758154077 ASCIPJAWEGVUSQ-UHFFFAOYSA-N 427.549 2.258 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(N(C)C)cc3)CC2)cc(OC)c1OC 759408960 GQLLWASIDIPEKF-UHFFFAOYSA-N 442.516 2.066 10 20 IECD O=C(CN1CCN(c2ncc(F)cn2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759923999 YOCVLSXWILNMKD-UHFFFAOYSA-N 445.454 2.152 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCC[C@@H]1N1CCOCC1 763662205 YBNCIKJBTNMIFQ-IRLDBZIGSA-N 434.556 2.229 10 20 IECD COc1ccc([C@@H](CCO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764353322 WRVCMLDUOUSINN-SIKLNZKXSA-N 440.544 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC(F)F)cn3)CC2)cc1 773607556 CLVBZKWOWBVUMG-HJWRWDBZSA-N 446.454 2.213 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)Cc1ccccc1 774926880 XSAGIZXRUFYVIF-VXKWHMMOSA-N 439.556 2.189 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1O 775011955 NNNMWYMZRGEOIB-GOSISDBHSA-N 428.489 2.296 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)NC(=O)CC4)CC2)cc1 778289531 NIZFLPCSZPTSIB-ZHACJKMWSA-N 434.496 2.423 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789821566 TYCRBXJHEVYXHW-YJXLLHPSSA-N 433.524 2.081 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCC34CCN(C)CC4)cc2F)C[C@@H](C)O1 789825715 OBWBVICJXIHDAN-QZTJIDSGSA-N 446.567 2.142 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C12CCCC2 789842127 AADJKXNUUPIDJI-LEWJYISDSA-N 447.551 2.257 10 20 IECD CC(C)(C)OC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789853873 AGXYSWNRCULRKZ-QGZVFWFLSA-N 433.574 2.046 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c(O)c1 797389301 ZOWXFZHSGOIKLC-UHFFFAOYSA-N 434.514 2.369 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2)cc1 797432364 BVBDMANZEIVHNK-UHFFFAOYSA-N 425.410 2.262 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 798320131 DGJUWLBIBKBBEZ-UHFFFAOYSA-N 433.574 2.416 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1)c1ccc(N2CCOCC2)cc1 803303175 ISJBHAZIFCFVPC-ZJOUEHCJSA-N 442.604 2.470 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(NC(=O)Nc4ccccc4)CC3)ccc21 803685484 BNVNRLZQAQDXKB-UHFFFAOYSA-N 449.555 2.498 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(N(C)C)cc1 807674782 QVRKPVWXMRIXJW-WIYYLYMNSA-N 436.556 2.280 10 20 IECD CC[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807771907 YZLHHKUEJOFGOC-RDJZCZTQSA-N 425.476 2.401 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc2c(cc1OC(F)F)OCO2 808755580 SECZIJOUMSGKPO-UHFFFAOYSA-N 435.427 2.358 10 20 IECD COc1ccc(CN2CC[C@@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)c(OC)c1 809726360 NMRWCKZSZNETNV-MRXNPFEDSA-N 431.445 2.217 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 811530212 XOHJYDZMAXWLCY-UHFFFAOYSA-N 431.297 2.496 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(CC(=O)OC)c2)cc1 811682933 JUAAPFFCUYHORP-UHFFFAOYSA-N 426.516 2.355 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1cccc(C2CCC2)c1 812967903 UPJBATTYOHWJRK-UHFFFAOYSA-N 441.553 2.444 10 20 IECD CC(C)(O)CONC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 819542002 LVUIIYXBSPSMOV-GHXNOFRVSA-N 445.360 2.469 10 20 IECD Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1-n1cnnn1 916677705 GTCJYWJFWYFXKB-UHFFFAOYSA-N 425.468 2.393 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)NCC(=O)NC(C)(C)C 917191270 BSIOSEYOAZAWRI-UHFFFAOYSA-N 432.546 2.464 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1O 917735833 YDSOVEXKLGWLOC-UHFFFAOYSA-N 434.879 2.005 10 20 IECD O=C(NC[C@H]1CCCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 918372285 IXMCEWIHLOSAMF-CYBMUJFWSA-N 435.458 2.258 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1 918438391 NUBUAHRTOTVEKX-UHFFFAOYSA-N 438.553 2.387 10 20 IECD O=C(CC[C@H]1CCOC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935401 FSBYEBFFHVZJJF-XEYPJELSSA-N 438.528 2.234 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1 1801603798 LXSMVTDWBWIWKX-XZUXCOOYSA-N 449.551 2.190 10 20 IECD O=C(CCN1CCCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285749 RBPWPACBFYIZQE-ASYHBGTLSA-N 443.544 2.331 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1coc(Cl)n1 1805013881 MQCRWCIKPGLODW-PXAZEXFGSA-N 443.847 2.163 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(Cl)c3)C2)CC1 1807653814 WRHUTUVJJWPTKO-UHFFFAOYSA-N 446.891 2.405 10 20 IECD O=C(CCCn1cccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813450285 XAZCRGNHXLIFEW-MBSDFSHPSA-N 449.511 2.489 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1 1823500686 HBSUTAUDGJRSAX-LBPRGKRZSA-N 439.538 2.154 10 20 IECD O=C(c1ccncc1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898205 GFOGJWFWEMONMZ-KRWDZBQOSA-N 446.598 2.175 10 20 IECD CCO/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899296 BXJLLUVRSBSPHP-RCLKMUNOSA-N 439.603 2.017 10 20 IECD CN(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nc1 1845500718 GCCRYJPWGIQEPB-UHFFFAOYSA-N 430.892 2.343 10 20 IECD O=C(c1nccc2nc[nH]c12)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501140 FCUWMRIYQVRUSN-UHFFFAOYSA-N 427.848 2.153 10 20 IECD Cc1cc(C)c(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c(C)c1 1847056418 LKVPINNGQABHDA-UHFFFAOYSA-N 431.583 2.289 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CCN3C(=O)CCC3=O)c2C)cc1 12957172 NOCIUOGHTRJLPV-UHFFFAOYSA-N 440.452 2.146 10 20 IECD Cc1nnnn1/C(=C\c1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 36784591 DKWSTDBWPXMCJR-STZFKDTASA-N 434.500 2.247 10 20 IECD COc1ccc(N2CCC(NC(=O)CSc3nnnn3CC(F)(F)F)CC2)cc1 729970270 YBUVUEUMURRYFU-UHFFFAOYSA-N 430.456 2.121 10 20 IECD COc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1 734016403 OZONJJIDMNAPOD-GASCZTMLSA-N 434.514 2.129 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)nn(C(C)C)c3C)CC2)cc1 734496927 TYDZLFOLHCNQEJ-UHFFFAOYSA-N 435.594 2.190 10 20 IECD Cc1nnc(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)o1 746136148 FVABIROVKYEQMK-UHFFFAOYSA-N 426.498 2.210 10 20 IECD CC(C)OCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 747580924 KOHXYKZBGAUQRE-HXUWFJFHSA-N 445.608 2.077 10 20 IECD O=C(CN1CCN(C[C@H]2CCOC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 749852885 QIRUFTAOTQWGAC-QGZVFWFLSA-N 433.508 2.055 10 20 IECD CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccccc2O)c2ccccc2O1 750362320 NGBKKMICZBERLV-FQEVSTJZSA-N 425.485 2.107 10 20 IECD CCOC(=O)c1c[nH]nc1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 751455838 ICAQYVGBSPMLQZ-LBPRGKRZSA-N 444.460 2.135 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c(C)c([N+](=O)[O-])c1 753829323 QCQPXYUJGIUZLC-NSHDSACASA-N 431.401 2.220 10 20 IECD C[C@H](CO)CCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760834604 PIXMKNSKPGCFOH-ZDUSSCGKSA-N 437.474 2.240 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC(C)C)c3)cc2F)CC1 762439809 NBSRZWUISXHCLO-UHFFFAOYSA-N 430.528 2.075 10 20 IECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1 768187037 ZIPFVMZQBJLEDJ-UHFFFAOYSA-N 434.543 2.302 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)cc3F)cc2F)C[C@@H](C)O1 769743242 VVQJCFOAKXVKPQ-CHWSQXEVSA-N 439.484 2.156 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H](c4nccn4C)C3)CC2)cc1 769770292 IQULZJCBIHJQTL-JBVUFVISSA-N 437.544 2.040 10 20 IECD CN(C)CCCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769843021 WRFZEXAYUDVSHQ-UHFFFAOYSA-N 436.490 2.173 10 20 IECD COC(=O)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(F)c1 770135217 YRDWTFUDNPDCCW-OAHLLOKOSA-N 430.841 2.200 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)Cc2ccc(N3CCOCC3)c(F)c2)c1 770289651 VVXDTFAFHWEZBC-UHFFFAOYSA-N 442.495 2.287 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@H](O)c4cccc(F)c4)n3)CC2)cc1 771056057 KTPRRNVRXMCLQP-FQEVSTJZSA-N 440.475 2.385 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 774920521 SBHWOFXTONAAOV-GOEBONIOSA-N 444.482 2.160 10 20 IECD CS(=O)(=O)NC1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775645065 CUSIYQQWYHIIKK-UHFFFAOYSA-N 442.173 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3nccn3C(F)F)CC2)cc1 778228747 KYCQEOMEHAWYFF-FPLPWBNLSA-N 433.459 2.150 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(OCC4CC4)CC3)CC2)cc1 778295296 RYXKKLODGOEAON-CMDGGOBGSA-N 427.545 2.318 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910431 BOKMOFARNBACIQ-NRFANRHFSA-N 449.599 2.230 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790551497 LQZSKLDTQPJRTM-QZTJIDSGSA-N 440.548 2.338 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCC(=O)NC)cc1C 796682187 ZQUFMCJEDXWOLN-UHFFFAOYSA-N 426.517 2.173 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@H](C)N1CCOCC1 803677052 DVRIKNKUXFSYRY-OALUTQOASA-N 430.593 2.297 10 20 IECD CC(C)(C)OC(=O)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804903635 NWMPCBQVZSQIER-CQSZACIVSA-N 441.475 2.221 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H](C)c3nccs3)cc2F)CC1 805007534 VERLODZGXOKJST-MRXNPFEDSA-N 447.580 2.302 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(CC4CCOCC4)CC3)cc2)CC1 805025806 UUPYXFDRYQYAFM-UHFFFAOYSA-N 442.604 2.110 10 20 IECD CN(C[C@H]1CCCOC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769007 CUQFPJDNSVKISO-HZPDHXFCSA-N 425.476 2.258 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCCO4)cc2F)C[C@@H](C)O1 918286277 GNAMFQKJAVDECH-GASCZTMLSA-N 443.475 2.465 10 20 IECD COC(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 918457942 YJIWPANIAXNRJT-UHFFFAOYSA-N 425.485 2.434 10 20 IECD Cc1noc(C)c1CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918894932 WBXGVBUXXSTZOL-ZIAGYGMSSA-N 433.480 2.446 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(C(N)=O)c3)cc2F)C[C@@H](C)O1 919063177 VOZLAOUPHFVQLF-GASCZTMLSA-N 443.475 2.011 10 20 IECD C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637445 GDSKXWZJYNSOFT-NSHDSACASA-N 442.440 2.418 10 20 IECD COc1ccc(N2C(=O)/C(=C/c3ccc(OC)c(OCC(N)=O)c3)SC2=S)cn1 1115963879 OFYDWTJKDNNYTK-NVNXTCNLSA-N 431.495 2.369 10 20 IECD Cc1cc(C(=O)N(C)CCNS(C)(=O)=O)c(C)n1-c1cccc(Br)c1 1116058352 ZUJOHENYAAQIMA-UHFFFAOYSA-N 428.352 2.478 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(CCNC(C)=O)s3)CC2)cc1 1116413886 IDZFWVYCQDTGRC-UHFFFAOYSA-N 437.587 2.336 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1c(F)cccc1F 1780280286 KISKDNUWQJCIOS-OPAMFIHVSA-N 447.438 2.212 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cccc(F)c1F 1780477636 QNWOQOLJDIIUNV-OPAMFIHVSA-N 447.438 2.212 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243079 QLYIUWKNFPQCPZ-AFFGTUGMSA-N 434.920 2.391 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc[nH]1 1796232008 LZSDGHLHIRAZGF-CHIZEWAFSA-N 425.485 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cncnc1)c1cc(O)c(O)c(Cl)c1 1796247369 QSXHWRPSCLGTMO-MUJYYYPQSA-N 430.892 2.426 10 20 IECD Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807994354 UZZISWSAOZIOGA-HRAATJIYSA-N 433.468 2.225 10 20 IECD CCn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cc1C 1817846148 IZZDTXXNUHVADH-MRXNPFEDSA-N 439.476 2.360 10 20 IECD Cc1nc2ccccn2c1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843653042 CQYLDLPSILPLCH-VQHVLOKHSA-N 448.479 2.290 10 20 IECD O=C(c1ccc2ncoc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037672 PUBZMAMTTJXHID-QPJJXVBHSA-N 435.436 2.475 10 20 IECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccc(N(C)C)cc3)c2)C[C@H](C)O1 15135011 JDIOAEHSEPIZAG-IRXDYDNUSA-N 431.558 2.481 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)c2)CC1 472804311 OFNRUEXCHCUDMH-UHFFFAOYSA-N 447.539 2.410 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726568051 ZORRFNVZFATUFW-UHFFFAOYSA-N 439.484 2.475 10 20 IECD CN(C)c1ccc(CN(Cn2nc(CCC(N)=O)n(C)c2=S)CC(F)(F)F)cc1 728904739 RMILXNPRAYXXPR-UHFFFAOYSA-N 430.500 2.457 10 20 IECD COc1ccnc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 734913683 KGJBGCNMHOYAOR-GASCZTMLSA-N 431.464 2.316 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)n3cccn3)c2)c1O 737284501 PDJZOEKXXIFJAA-AWEZNQCLSA-N 437.456 2.052 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(O)nc2ccc(F)cc12 737806181 JSPADVIZROAXMZ-UHFFFAOYSA-N 429.473 2.244 10 20 IECD C[C@H]1CS(=O)(=O)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 739744424 HHSARDXXRVVGBY-LQELWAHVSA-N 444.625 2.375 10 20 IECD CCS(=O)(=O)c1ccc(F)c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 746175768 WWXKUZAZSQICOY-UHFFFAOYSA-N 449.548 2.180 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N(C)C(C)=O)cc3)CC2)cc1F 754210738 DKHHBTUQQXOIRB-UHFFFAOYSA-N 428.464 2.104 10 20 IECD CCC[C@@](C)(CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 754911192 MPFCZGNNCIDSQP-QFIPXVFZSA-N 430.528 2.293 10 20 IECD COC(=O)C12CCC(C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)(CC1)C2 759262998 IPPZBMKUGMJRAH-UHFFFAOYSA-N 430.501 2.011 10 20 IECD COc1cc(N2CCN(C(=O)CN3Cc4ccccc4C3=O)CC2)cc(OC)c1OC 759402817 CEMPNOYBGRZRGR-UHFFFAOYSA-N 425.485 2.017 10 20 IECD CN1CCC(NC(=O)Nc2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)CC1 765090705 VWSFOZWVEGSGHX-UHFFFAOYSA-N 430.490 2.239 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 768062548 MGQMNTWJEDZYLX-HNNXBMFYSA-N 442.491 2.180 10 20 IECD COC(=O)c1cccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)c1 771055650 IGHSBRDVJISGSM-UHFFFAOYSA-N 436.468 2.423 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](CO)[C@@H](C)c3ccccc3)CC2)cc1 771425263 YUYKOXFHDIYAMY-CVDCTZTESA-N 426.561 2.281 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 779223382 KEYLYKDDSWLYKP-NRFANRHFSA-N 448.608 2.121 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(N4CCCC4=O)cc3)c2)CC1 780406968 BMQYPNUJSUCPQE-UHFFFAOYSA-N 442.541 2.283 10 20 IECD O=C(NCc1cn2ccsc2n1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 785583398 LJDAXOSUJYZNMB-UHFFFAOYSA-N 449.483 2.399 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCSc3nccs3)cn2)C[C@H](C)O1 787198007 MBSRSOXIQOREOB-GJZGRUSLSA-N 449.602 2.067 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(-n2cccn2)cc1)c1ccc(N2CCOCC2)cc1 788378136 CSKLPXCSZSNOQV-GOSISDBHSA-N 433.512 2.203 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 788401086 JPMWTNXZBNPRAW-QGZVFWFLSA-N 443.569 2.448 10 20 IECD CCCCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 789799519 IJYNAIOOSVYZOB-VQTJNVASSA-N 435.540 2.379 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N(C[C@@H]1CCCO1)C1CCCC1 789800914 RTKSLKLAOGUTSM-IBGZPJMESA-N 433.524 2.229 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C(F)F)cc3)cc2)C1 793733611 NAGUTCQSGMDBJB-SFHVURJKSA-N 444.482 2.259 10 20 IECD COCCN1CCC(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 793814980 CORCBMDGZGHGKA-UHFFFAOYSA-N 430.593 2.299 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(OC)cc3OC)CC2)cc1 793866075 ZWPSGHVNTJHCDB-UHFFFAOYSA-N 441.528 2.156 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3N(C(=O)OC(C)(C)C)CC3(C)C)nc12 796220638 HHAIUNZYBXLFGA-OAHLLOKOSA-N 448.476 2.300 10 20 IECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449011 LEBPIVBUAIHXAN-KXBFYZLASA-N 439.503 2.383 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC(F)F 803662480 WRXYFMIDNZGIGJ-UHFFFAOYSA-N 439.434 2.477 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N3CCCC[C@@H]3C)cc2)CC1 805023781 AVTRDVIAGFAAJV-OALUTQOASA-N 428.577 2.445 10 20 IECD CN(C)C(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806495602 IKWGCBVMCRTEQL-ICSRJNTNSA-N 445.564 2.151 10 20 IECD CC(C)(C)c1ncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 808559242 BJZWFEJRKDLBEY-UHFFFAOYSA-N 430.480 2.223 10 20 IECD COC(=O)Cc1occ(C)c1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 809970604 FPYOEUMNNBVPRC-UHFFFAOYSA-N 429.517 2.254 10 20 IECD O=C(NCCNS(=O)(=O)c1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 916295894 YTUKUOUNSUXQDO-GOSISDBHSA-N 433.530 2.061 10 20 IECD CN(CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S)CC1CC1 917153509 PTMRRXPTWVFHBY-MFOYZWKCSA-N 433.555 2.075 10 20 IECD CCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 917833001 KAGYGIDFTCBJPK-KRWDZBQOSA-N 426.517 2.440 10 20 IECD CCc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 919391484 IUJPGDHGIPBMKU-HUUCEWRRSA-N 430.480 2.265 10 20 IECD O=C1CN(S(=O)(=O)c2ccc(C(=O)Nc3cccc(N4CCCCC4)c3)cc2)CCN1 919825023 IXVYYIBLFOMGNJ-UHFFFAOYSA-N 442.541 2.050 10 20 IECD CCOC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194551 FWPMDAXUSNAAEH-UHFFFAOYSA-N 426.473 2.347 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4cncn4)cc3)CC2)cc1 1116501147 WPJZADKDVWAZTJ-KHPPLWFESA-N 432.484 2.119 10 20 IECD Cc1noc(C)c1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931115 NAVFLOPXAZIZRA-GGPHIMKMSA-N 449.511 2.265 10 20 IECD Cc1ncsc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805750354 DEOWUXQMTWJMBC-KBXCAEBGSA-N 439.497 2.286 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cc[nH]n3)C2)CC1 1806238798 CJXCYCGFOCOTOA-HWKANZROSA-N 426.473 2.085 10 20 IECD O=Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1815370991 DFUJJEMUMGFCIS-SNVBAGLBSA-N 444.494 2.363 10 20 IECD Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1 1817844110 QDRKAQLSAGJUBN-KRWDZBQOSA-N 436.472 2.468 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2ccnc2c1 1819098767 ZMHHKWMWSIMZBF-MRXNPFEDSA-N 447.455 2.483 10 20 IECD Cc1occc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823495813 CDVRHMKHVBJFIO-CQSZACIVSA-N 447.542 2.477 10 20 IECD CC(C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824258117 NRVWRTGEBBVVFW-FCRGVEGXSA-N 446.544 2.453 10 20 IECD CN(C)c1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)o1 1827426800 HVEWLJPABWETOV-MRXNPFEDSA-N 443.504 2.094 10 20 IECD CC[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876817 ZLOSGAFCWXKMJA-AZGCOUAMSA-N 432.517 2.207 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 108689919 LJBVFZCAELZVPV-UHFFFAOYSA-N 435.521 2.485 10 20 IECD Cc1c(CNC(=O)C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)n(C)c2ccccc12 517255862 ADIHVJOGYLSEQX-FQEVSTJZSA-N 433.556 2.478 10 20 IECD Cc1c(Cl)cccc1NC(=O)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 725898421 HSXBBTLJXVTJTR-UHFFFAOYSA-N 425.894 2.484 10 20 IECD COc1ccc(OC)c(-n2nnnc2SCC(=O)NCc2ccc(N(C)C)cc2)c1 726432600 OXXXYRHOOUTBGR-UHFFFAOYSA-N 428.518 2.154 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)N3CCC(OC)CC3)CC2)cc1 730826106 YWWGPLZRQKLSLA-UHFFFAOYSA-N 447.624 2.006 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@H]3CN3CCCC3=O)CC2)cc1 732456466 WHMZLFDIKFWPOH-NRFANRHFSA-N 443.592 2.004 10 20 IECD Cc1c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnn1-c1ccccn1 741754387 HTOKEKLPRXSZSY-UHFFFAOYSA-N 427.530 2.233 10 20 IECD CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NCc1ccc(N2CCOCC2)cc1 745747512 WCWOTYSFADIOJH-QFIPXVFZSA-N 435.528 2.161 10 20 IECD Cn1nc2c(cc1=O)CN(C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745903044 BHYBBLAZPSPOJU-OAHLLOKOSA-N 433.459 2.118 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 746782368 DAIQDUCQKPPAFZ-UHFFFAOYSA-N 429.448 2.012 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(=O)oc2ccccc12 750609783 NBQIHJHXVDRWCK-UHFFFAOYSA-N 426.494 2.266 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(F)c(C(=O)N(C)C)c3)CC2)cc1 752725975 LJMPENSNGSXLRA-UHFFFAOYSA-N 442.491 2.260 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H](O)c1cccc(F)c1 752878950 HEVVYGGOBMWFKU-XERREHJYSA-N 428.508 2.449 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccn(-c4ccccc4)n3)CC2)cc1 757164577 WMCZASXWXUUUHP-UHFFFAOYSA-N 434.496 2.315 10 20 IECD CCCOc1ccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 768945194 QAVHYAWXGXOSMW-UHFFFAOYSA-N 440.544 2.361 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4cncn4)CC3)cc2F)C[C@H](C)O1 778226274 PXHPCFFSOWXVJE-ROUUACIJSA-N 444.555 2.059 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)N(C)c1ccccc1 787634659 CRKLHHPGLCHUIH-KRWDZBQOSA-N 442.535 2.044 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@]2(N(C)C)CCSC2)cc1 788255958 VOGWWYLAGFHRRP-HSZRJFAPSA-N 444.601 2.428 10 20 IECD COc1ccc(CCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789799733 KUTHRYHFQBYALB-UHFFFAOYSA-N 429.492 2.036 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 790411706 NFOVZLDBXBTUMG-UHFFFAOYSA-N 426.516 2.376 10 20 IECD O=C(OC[C@@H]1CCCS(=O)(=O)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 792204158 UXGRYYTXDFMSHD-LBPRGKRZSA-N 445.540 2.236 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@@H]1Cc2ccccc21 793683527 XRLPEPSPADETQC-QFIPXVFZSA-N 432.568 2.291 10 20 IECD CCN(CC)[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 793844405 MRZAVMDGIXKQPM-WIYYLYMNSA-N 442.560 2.493 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)cc1F 803661960 PHTWMQANZUXARG-MRXNPFEDSA-N 436.528 2.271 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2COc3c(cccc3OC)C2)cc1F 804673608 ITPHUJKCGDFNEA-QGZVFWFLSA-N 429.492 2.417 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1 806282879 XFJJWFAWZOVWII-KBPBESRZSA-N 441.600 2.154 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)CC2)cc1 806333031 DAVYYRHTAVQDTM-RBBKRZOGSA-N 429.609 2.476 10 20 IECD CC[C@@H](NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1nccs1 807257420 NDCHACSNKIEBSD-OAHLLOKOSA-N 448.545 2.085 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 808058246 LCQDKLJGBLVBSV-DHIUTWEWSA-N 436.556 2.043 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H]4CN(C(C)=O)C[C@H]43)cc2F)CC1 808357768 OKWBPQUQSFLWOW-TUNNFDKTSA-N 445.583 2.414 10 20 IECD C[C@@H](OC(=O)c1cc2n(n1)CCO2)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 811351914 YORKDZBEWGJJSK-GFCCVEGCSA-N 431.404 2.235 10 20 IECD Cn1cnc(NC(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)n1 817153547 RBROAXRXZQQUCC-WDZFZDKYSA-N 438.332 2.418 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(CN2C(=O)CNC2=O)cc1 916687813 KKQVUTHHLJMAHH-UHFFFAOYSA-N 441.463 2.036 10 20 IECD O=C(CN1CCO[C@H](c2ccc(F)cc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 917048475 CPVBANONLQEUGN-QFIPXVFZSA-N 431.483 2.491 10 20 IECD COCCCN(CCOC)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 917839562 MCRKSHLWKUZYNW-UHFFFAOYSA-N 426.425 2.495 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1S(=O)(=O)N1CCCCC1 918443818 HJKFYUDOJMAUEX-UHFFFAOYSA-N 445.541 2.472 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)CC2)cc1 1116483519 HQPSCSJHZRYLFV-UHFFFAOYSA-N 441.912 2.488 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2 1782008600 FQRCAZKZDMIBHP-NKZDFZCZSA-N 436.917 2.070 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c(C)c1 1787295399 NAZHACWPPUMRMG-SNRMKQJTSA-N 425.485 2.017 10 20 IECD COCc1c[nH]c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1799202654 GNZWAABXERSOKT-ZURAMSNBSA-N 441.484 2.243 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)C1CCCC1 1806188609 FKYRPSDKCGXAHR-QFBILLFUSA-N 446.598 2.138 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000171 XRWORCGTLWQSQY-ZWWNWMABSA-N 440.500 2.024 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(F)nc1 1810692069 BOAXKRLMPROLMU-VLIAUNLRSA-N 437.431 2.055 10 20 IECD CC(C)N[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(C)C 1816722848 ZLROBRJCTRUAMF-SCLBCKFNSA-N 447.561 2.198 10 20 IECD Cc1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816725184 MBDYMKFCIBLDDA-SNVBAGLBSA-N 431.499 2.254 10 20 IECD COc1ncc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1C 1842571699 VNQYEJAEBHTRDG-FNORWQNLSA-N 439.468 2.046 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc2c(c1)CCC2 730570819 LOXRMGIUNWUKGG-GOSISDBHSA-N 444.601 2.271 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1cccc2ccccc12 737245753 PGKLDVBIZMLYLL-UHFFFAOYSA-N 437.521 2.330 10 20 IECD O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NCc1ccc(N2CC=CC2)cc1 740904753 NGPFBLHADIENRT-UHFFFAOYSA-N 434.949 2.494 10 20 IECD COc1ccc(N2CCN(CCNC(=O)COc3ccc4ccc(=O)oc4c3)CC2)cc1 742916776 MEBHECGGWSQVGI-UHFFFAOYSA-N 437.496 2.119 10 20 IECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)N1c1ccccc1 745690494 CEAVXSAYBDSBPL-JUXOCIIHSA-N 449.555 2.382 10 20 IECD CN1CCCc2cc(CNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc21 746812737 KSIOLGVYQOBZNK-UHFFFAOYSA-N 429.542 2.020 10 20 IECD CN1CCCc2cc(CNC(=O)c3ccc4c(c3)S(=O)(=O)N(C3CC3)C4=O)ccc21 746814276 KWEKFPVZOZMKNR-UHFFFAOYSA-N 425.510 2.306 10 20 IECD COc1ccc(Cl)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 751213766 YFFIBHAZQJECHV-UHFFFAOYSA-N 430.935 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)NCCN3CCN(c4ccccc4)CC3)CC2)cc1F 753860345 YEGVBPXNDZEECQ-UHFFFAOYSA-N 441.551 2.488 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3coc(S(=O)(=O)N(C)C)c3)cc2F)C[C@H](C)O1 755579908 VPTGKLRVSQPDLZ-KBPBESRZSA-N 439.509 2.213 10 20 IECD CCC(=O)N1CCC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 756896968 WUBWVLHBMFVGCR-UHFFFAOYSA-N 426.540 2.433 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(Br)ccc2O)C1=O 757905106 DHKTVHAFUUJVSQ-UHFFFAOYSA-N 447.289 2.260 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 762442518 RKUIEGPQYMCWRZ-AWEZNQCLSA-N 429.448 2.265 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)NCc2cccc(Br)c2O)s1 766201746 URXMRCLPRFFLFQ-UHFFFAOYSA-N 436.305 2.490 10 20 IECD CCc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768447044 LRNJQECXGVESEI-HRAATJIYSA-N 426.513 2.492 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 770277442 AFPAHDYZGRMSBZ-UHFFFAOYSA-N 440.468 2.191 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1OC 774730177 TWXDPKGHZGJNMU-UHFFFAOYSA-N 443.569 2.232 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 774804687 BRQGSJCBWQCHLI-HDICACEKSA-N 445.539 2.075 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)c1O 774821071 VFKUWYCMTAXMBE-UHFFFAOYSA-N 441.893 2.469 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](O)[C@@H]3C(=O)OC)c2C)cc1 781956827 BAYDMNFWVCJMHZ-TZIWHRDSSA-N 428.485 2.062 10 20 IECD O=C(Nc1ccc(OC2COC2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 782104573 GZJZSVQQBYDJNF-IBGZPJMESA-N 426.469 2.316 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)s1 782305868 MWEHMYRJKPJORF-CYBMUJFWSA-N 425.484 2.047 10 20 IECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)c(OC)c1 782779152 JVCNFSMGKUANCA-MRXNPFEDSA-N 429.425 2.146 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCN3C(=O)c4ccccc4C3=O)cc2)CC1 786256053 PPESDQZNEWKWCL-UHFFFAOYSA-N 448.523 2.048 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1 788328682 JYZLQAOWKGAQFJ-SNVBAGLBSA-N 426.878 2.274 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](c4ncc[nH]4)C3)cc2F)C[C@@H](C)O1 789820920 QWPKZCPPLJETIC-JZXOWHBKSA-N 443.523 2.185 10 20 IECD C[C@@H](COc1cccc(F)c1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833687 IIOUAOPKBVZDPG-HNNXBMFYSA-N 447.482 2.126 10 20 IECD Cc1cc(C(=O)CN(C)CCCN2CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 799174153 CNYOQVPEHYZPRZ-UHFFFAOYSA-N 432.590 2.342 10 20 IECD C[C@@H]1CN(Cc2cccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)CCO1 803131008 FTPAFEYGPCFJCZ-HXUWFJFHSA-N 448.567 2.216 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN3c4ccccc4C[C@@H]3C)CC2)cc1 803976267 YJWZGUGLKXTUHS-SFHVURJKSA-N 436.556 2.348 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCC3(N4CCCC4)CCOCC3)cc2)CC1 804737741 PESNBDGUPZHGDL-UHFFFAOYSA-N 442.604 2.300 10 20 IECD CCCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 805008749 AZNXSQZKMFPVKW-FQEVSTJZSA-N 448.583 2.392 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2cc(CC)ncn2)C1 806270607 XXWLGHKAFOYMTP-IBGZPJMESA-N 425.533 2.268 10 20 IECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807289348 QTNQSCXVBVGKOG-UHFFFAOYSA-N 428.533 2.006 10 20 IECD CN(CCOC(C)(C)C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855584 FNJXAGOPJPLYFX-UHFFFAOYSA-N 430.593 2.108 10 20 IECD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCc1ccc(O)c(O)c1 917371594 JEBOVEZADULPQC-MRXNPFEDSA-N 433.486 2.216 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)cc1[C@]1(C)NC(=O)NC1=O 917897633 ASYZNNRNNNWFPW-SFHVURJKSA-N 448.482 2.267 10 20 IECD COc1ccc(N(C)CC(=O)N(Cc2cccs2)[C@H]2CCS(=O)(=O)C2)cc1OC 920418785 HQVDOYLOOULGCV-INIZCTEOSA-N 438.571 2.417 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)CC2)cc1 1253443689 ZTBCEYZKABWDJJ-RUZDIDTESA-N 448.523 2.127 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 1324468221 UWBFFHRDCNHXGW-UHFFFAOYSA-N 426.473 2.284 10 20 IECD COC1(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1782007054 AKOBWHXTDKLKTO-NRFANRHFSA-N 438.908 2.154 10 20 IECD CC(C)(C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314456 CSIGDKKZTHCYNR-QGZVFWFLSA-N 449.598 2.388 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cccnn3)CCC2)cc1 1792315184 NLDRBZOKWJPAFK-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccn2cn1 1797657963 FZUJMWKTUIGOMA-CMTWWZJASA-N 448.479 2.416 10 20 IECD O=C(Cc1ccc(F)cn1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543581 JNCCJIBVLAVXFN-UHFFFAOYSA-N 428.464 2.114 10 20 IECD O=C(c1ccc(Cl)nn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428325 OMTTVOWTJFYILQ-MRXNPFEDSA-N 445.907 2.483 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCCC3)C1 1843265404 WNVJOJSILGVZCA-UHFFFAOYSA-N 430.892 2.484 10 20 IECD Cn1ncc2cc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)ccc21 1843798526 WXACGAFKELQGJQ-VMPITWQZSA-N 448.479 2.221 10 20 IECD C[C@H](Oc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502397 SQOSJYCZPFYDCN-ZDUSSCGKSA-N 431.876 2.431 10 20 IECD Cc1c(CNC(=O)N2CCN(C[C@H]3CN(C(C)C)CCO3)CC2)n(C)c2ccccc12 472286869 WWHXHSAFGAGRLY-FQEVSTJZSA-N 427.593 2.423 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)n2)c[nH]1 727247875 RBLLGOVXZFFONI-UHFFFAOYSA-N 441.512 2.129 10 20 IECD Cn1ccnc1COc1ccc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 728729248 JNOKQVPNMDPUIA-UHFFFAOYSA-N 431.470 2.433 10 20 IECD CCN1CCCC[C@@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729332971 FYGPGDYGGSMVTP-OAQYLSRUSA-N 426.540 2.433 10 20 IECD C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 729601069 ZPVQVNMRTCMQEN-NHCUHLMSSA-N 429.609 2.223 10 20 IECD O=C1OCCN1c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 740890526 ABTMMNZFVVBIAN-UHFFFAOYSA-N 435.477 2.097 10 20 IECD COc1cc(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1OC 741795309 JITBNUGILGALFO-UHFFFAOYSA-N 447.507 2.441 10 20 IECD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743869201 KKOCPWRUTHGQMT-UHFFFAOYSA-N 442.497 2.101 10 20 IECD CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCOCC2)cc1 746430975 QQNGWKJZWNYKKI-UHFFFAOYSA-N 436.490 2.225 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccc([S@@](C)=O)cc1 749808548 FKXNVKMLFAQVLC-SSEXGKCCSA-N 433.549 2.148 10 20 IECD COC(=O)c1nscc1S(=O)(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 751014197 PVWWQWNWBFINRP-VXGBXAGGSA-N 443.522 2.161 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(S(N)(=O)=O)s2)cc1 751407492 WHCGDWPRIMDWRW-KRWDZBQOSA-N 437.587 2.212 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1N(C)S(C)(=O)=O 757822169 AVWVDEXYCNDAJQ-UHFFFAOYSA-N 432.546 2.136 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cccc(Cl)c4)C(=O)C3)nc12 758754539 KNJADFSDQDLEAV-UHFFFAOYSA-N 443.891 2.109 10 20 IECD COCCc1noc(CN(C)[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 758805111 SCNUXTZBTSEPPT-AWEZNQCLSA-N 448.479 2.493 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)cc1 758953010 GTZODQGZOLRCPN-UHFFFAOYSA-N 443.511 2.438 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(Cc1ccco1)Cc1ccccc1O 759706869 MDMLUEDNQRGJIG-UHFFFAOYSA-N 445.497 2.282 10 20 IECD CS(=O)(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 761770939 MLQGMGVAYSIGEG-AWEZNQCLSA-N 431.505 2.475 10 20 IECD COc1cccc(CNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)c1O 769504463 ZUPNYNVTTQHQEX-UHFFFAOYSA-N 430.848 2.467 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1cccs1)N1CCOCC1 774806400 IIXDVSUKFMANKG-HXUWFJFHSA-N 444.601 2.352 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)ccnc2Cl)cc1C(=O)O 777931172 OIAPHGCQZLFQCA-UHFFFAOYSA-N 440.286 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@](C)(O)c3ccc(F)cc3)CC2)cc1 778402651 PYPGCLTZKFSBIV-FJIRUFBNSA-N 441.503 2.063 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 779339714 DJIXIPPYEPJVGU-INIZCTEOSA-N 447.605 2.367 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nc(C)n(-c4ccc(F)cc4)n3)cc2)CC1 786259145 LIVDFVCQLGZPPR-UHFFFAOYSA-N 436.491 2.313 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCc4occc43)cc2F)CC1 788629515 VSYCGSRUDPVLFR-IBGZPJMESA-N 428.508 2.371 10 20 IECD Cc1c(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)cnn1C 793350728 PGHNOMHTKYTLAJ-ZDUSSCGKSA-N 438.575 2.378 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc(N2CCOCC2)cc1 793808508 BVRVBAMIJICLIU-LJQANCHMSA-N 447.539 2.262 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)c(O)c1 797390604 ZXHGEXJVRKRXDF-UHFFFAOYSA-N 446.467 2.086 10 20 IECD C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451115 DROSJCGOCIZSIM-QLFBSQMISA-N 425.476 2.397 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769767 VOKXYPJLIBLKFI-QGZVFWFLSA-N 440.535 2.419 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 1322015037 AVDIXAVSAGODQI-UHFFFAOYSA-N 425.457 2.476 10 20 IECD O=C(CCc1ccoc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007419 HVOBPIKBNNOZHW-NRFANRHFSA-N 434.876 2.421 10 20 IECD CCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)CCC1 1792219548 YAEAQVXTVZLQEB-ONQJJZRUSA-N 444.528 2.377 10 20 IECD O=C(c1ccc2cncn2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546415 FCVPDRVXBCKJTC-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CCOCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1816881745 FPDDSJZIGAITRM-SFHVURJKSA-N 438.488 2.231 10 20 IECD CC(=O)O[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1827428491 RAQYIRFSRSNUBX-RXVVDRJESA-N 447.532 2.314 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccnc(Cl)c2)C1 1842446847 HKASGTCDXKOGDC-UHFFFAOYSA-N 437.887 2.345 10 20 IECD Cc1ncccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848118885 HNHTXHDYEFDPMR-BDJRERGKSA-N 437.496 2.355 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3ccccc3CS(C)(=O)=O)C=C2)cc1 466295412 GGZUPMKIMXCMOT-UHFFFAOYSA-N 444.534 2.214 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n(C)c2ccccc12 550513566 OSBDSPCHKIAUAG-IRXDYDNUSA-N 449.555 2.428 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(OC)c(OC)c3)cc2F)CC1 730268699 DSGNXADIZWUSLB-UHFFFAOYSA-N 437.537 2.463 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741096986 HXAJJHDNMWUGAM-UHFFFAOYSA-N 435.528 2.208 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc(OC)c(OC)c3)CC2)cc1 742928681 ZQLLCQRVZWQKPE-UHFFFAOYSA-N 442.560 2.376 10 20 IECD CN(Cc1ccccc1O)S(=O)(=O)c1cc(S(C)(=O)=O)ccc1Br 751236517 WMGNXLGPOIRSNV-UHFFFAOYSA-N 434.333 2.379 10 20 IECD O=C(CSc1nnnn1CC(F)(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 752152017 SAGJESGGOXSLDV-CYBMUJFWSA-N 431.440 2.241 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1Br 756102787 QOXFSECVBAHQLH-UHFFFAOYSA-N 437.246 2.205 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 759588671 NOPZKOQCCAVKDG-CLFYSBASSA-N 438.480 2.384 10 20 IECD COC(=O)CS(=O)(=O)Cc1ccc(CNCc2cc(Cl)cc(OC)c2O)cc1 761216295 NVJQTHUNRNNDIV-UHFFFAOYSA-N 427.906 2.432 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(-n2cncn2)c(F)c1 765903338 JJVCNDNVFUUWDQ-UHFFFAOYSA-N 434.225 2.129 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(NS(C)(=O)=O)cc1 765980038 XMZDTFPJTCPVLX-INIZCTEOSA-N 437.587 2.144 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OC(C)=O)c(OC)c3)CC2)cc1 770498389 YMDUOLAFQQOFJE-UHFFFAOYSA-N 442.468 2.135 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771069368 YFWJNDYCSLHHGK-HNNXBMFYSA-N 441.937 2.283 10 20 IECD O=C(Cn1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1)NC1CCCC1 772429362 SJTADRNLMCDSRN-UHFFFAOYSA-N 439.560 2.081 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(C(=O)C(F)(F)F)CC3)CC2)cc1 775854286 LWPPYJASMFQHPZ-SFHVURJKSA-N 429.483 2.022 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)Cc3c(C)noc3C)CC2)cc1 778286708 CRCKVJVRGIXCSZ-ZBTGYSDGSA-N 426.517 2.252 10 20 IECD COC(=O)c1cccc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778323658 JHBWYUXPPCLYLW-ZHACJKMWSA-N 437.496 2.003 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCc1nnc2n1CCCCC2 785924523 JVPJYOSGOFQVOO-UHFFFAOYSA-N 438.576 2.312 10 20 IECD CCOC1CC(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789823516 DVJGEBDAMDUYHO-GIOYIUAESA-N 435.540 2.377 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccn(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 793661842 AXXIEBIMNKKJNW-SFHVURJKSA-N 433.512 2.203 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccccc3)cc2)C1 793718910 KQMZFQHGQKKHBL-IFMALSPDSA-N 434.540 2.368 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 793910933 KRWYYAYMWJCYLD-JTJHWIPRSA-N 431.577 2.382 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(Br)c(OC)cc2OC)c(O)c1 797389662 RZXZSTCDIUNUGU-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O 802610885 WVSRDFNGPLJLSS-UHFFFAOYSA-N 445.541 2.482 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450602 LLENSDSWWQQHGO-GOSISDBHSA-N 438.519 2.364 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)cc1F 803648714 YZGQMVUUUUYTPG-FQEVSTJZSA-N 426.536 2.189 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661991 QICAHBJCMMGHNK-WMLDXEAASA-N 436.528 2.270 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(F)c(CN(C)C)c3)CC2)cc1 806040075 DFXXMJRYOHUWBA-UHFFFAOYSA-N 442.535 2.251 10 20 IECD CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806327541 CCIKWZGRJXAHIG-IRXDYDNUSA-N 438.519 2.364 10 20 IECD CC(C)(C)OC(=O)N1CC[C@H]2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC[C@@H]21 816999665 CCOKWQVOJDNPIK-BBRMVZONSA-N 439.534 2.235 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 920495838 GLGRACWWCNLGNK-GOSISDBHSA-N 436.505 2.408 10 20 IECD CCc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782002838 XNQFXJWPVMPTKU-JOCHJYFZSA-N 445.903 2.466 10 20 IECD CC(C)(C)NCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1788006828 JAMRPWOXLUIYDX-UHFFFAOYSA-N 448.614 2.369 10 20 IECD O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807459453 NAXATOAKLUWYEO-OPAMFIHVSA-N 435.484 2.168 10 20 IECD CC(C)CCC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189984 NILLTWMZNBYNLA-OXJNMPFZSA-N 448.614 2.384 10 20 IECD Cc1nc(F)ccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816726342 SZVQNJZZVCVCSX-NSHDSACASA-N 443.460 2.331 10 20 IECD CCO/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1826473538 LJXLLPXPGYAUPG-HFTNPTAHSA-N 445.497 2.436 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@@H]2C[C@H]2C1 1828809128 DGOUQHYBBIDDDB-XFWGSAIBSA-N 442.560 2.066 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)cc2F)CC1 730194584 MDXCRKLWDKXIPH-RTBURBONSA-N 444.551 2.149 10 20 IECD COc1ccc(N2CCC(NC(=O)N(C)[C@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 732889508 VEHIUQYFFUYIIR-KRWDZBQOSA-N 428.455 2.469 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4c(F)cccc4F)=NO3)cc2)C1 736005093 BMBNYZIRCGAFPJ-YWZLYKJASA-N 442.466 2.476 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1O 737278563 LZICHWYPLNEGNR-UHFFFAOYSA-N 438.528 2.188 10 20 IECD CN(C)CCn1ccc(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 746382384 UDLJNZRPNVTPPF-UHFFFAOYSA-N 426.565 2.469 10 20 IECD Cc1c(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cnc2c1c(=O)n(C)c(=O)n2C 747741178 NSSYQZAGLIQZRQ-UHFFFAOYSA-N 435.528 2.203 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(O[C@@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 748833289 RUQRHGWOBVLFAT-DBXWQHBBSA-N 449.567 2.325 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnn([C@@H]4CCOC4)c3)cc2F)C[C@@H](C)O1 751974296 MAWNOYBYZHMJNS-HLLBOEOZSA-N 438.525 2.076 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754212670 OGUKKOCKVGTDGG-UHFFFAOYSA-N 431.464 2.147 10 20 IECD CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NCc3ccccc3O)cn2)CC1 755229574 ANQANKPVBRJUFQ-UHFFFAOYSA-N 443.504 2.416 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4c(c3)N(C)CCC4)CC2)cc1 757893701 VMGKYGAWABINSW-UHFFFAOYSA-N 444.601 2.178 10 20 IECD CCOC(=O)N1CCC[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759222698 UTISCUHHPJXARF-MRXNPFEDSA-N 435.521 2.230 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCCN1C(=O)NC2(CCCC2)C1=O 760944768 TVXMPDGZAGNXCN-UHFFFAOYSA-N 434.880 2.065 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](N2CCCC2=O)C1 761114756 OUHUSGDQKGRQNF-HZPDHXFCSA-N 431.492 2.486 10 20 IECD Cc1nc2sccn2c1CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 761912260 LNOCUVVGXANMTQ-UHFFFAOYSA-N 431.537 2.428 10 20 IECD Cc1nc(NC2CC2)sc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 770076952 DZJUWXLZXFTHCZ-UHFFFAOYSA-N 448.520 2.475 10 20 IECD CCN(Cc1ccccc1)C(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 771718633 PGPVEMYAKDEHJG-UHFFFAOYSA-N 430.486 2.405 10 20 IECD CC(C)[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS1(=O)=O 772700740 XDDKGUMHYLMTHR-MAUKXSAKSA-N 445.532 2.433 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 774862260 NXWXAMOESPZIHI-QFIPXVFZSA-N 442.535 2.006 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCc4ccccc4C3)cc2F)CC1 775120887 NQUCFKZKYFFWLA-OAQYLSRUSA-N 438.547 2.258 10 20 IECD C[C@@](O)(CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 778339412 RJADTDDGCNMCRC-HSZRJFAPSA-N 430.476 2.120 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3COC4(CCCCC4)O3)CC2)cc1 778419564 MCLQQRBQBQZIBD-YUQDSPFASA-N 443.544 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CO)c3c(F)cccc3F)CC2)cc1 778423727 VUMQSCQORPHGML-XTXLJPNXSA-N 445.466 2.028 10 20 IECD C[C@H]1C[C@H](C)CN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 787910367 LYZBARJGFDBYLQ-SFTDATJTSA-N 444.620 2.356 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 788401934 NJFCGIMCLWSRMM-UTKZUKDTSA-N 442.512 2.492 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N(C[C@@H]1CCCO1)C1CCCC1 789839827 AUGDIEORNCVYBS-FQEVSTJZSA-N 447.551 2.353 10 20 IECD CC(C)Cc1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 792330055 JKGDGADXDYVQOY-UHFFFAOYSA-N 429.496 2.030 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 800458820 VWULIPQMQQAYMC-MRXNPFEDSA-N 440.521 2.300 10 20 IECD CCc1cnc(CN(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)s1 805006680 BDHNUMCAWIAZDQ-UHFFFAOYSA-N 447.580 2.261 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1 807291809 IAWAXNYJDODJFL-GBXCKJPGSA-N 448.567 2.085 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1F 807386935 RAJOUYNLLCTPHE-UHFFFAOYSA-N 425.210 2.335 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cnn(Cc2ccncc2)c1 807387297 HISLNPYCPDXOQT-UHFFFAOYSA-N 430.262 2.049 10 20 IECD COCCCN(CCO)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807954874 HAIXJXCKSHTMLN-INIZCTEOSA-N 425.957 2.050 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3COC4=O)cc2F)C[C@@H](C)O1 808919127 NHAPYILKSBXBHG-ZIAGYGMSSA-N 441.459 2.365 10 20 IECD O=C(CN1CCCN2c3ccccc3C[C@@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 810051344 ZUWNRNBDVASUJY-OAQYLSRUSA-N 438.547 2.416 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1 811864170 PQKOMLVAZOSRJR-HNNXBMFYSA-N 446.445 2.262 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(c4nccs4)CC3)cc2F)C[C@@H](C)O1 917026896 RTGUGUYGEUXRNJ-IAGOWNOFSA-N 447.580 2.334 10 20 IECD COc1ccc(N2CCCN(Cn3nc(C4CC4)n(CCC(N)=O)c3=S)CC2)cc1 917485860 UBNWYLXFUCMGGD-UHFFFAOYSA-N 430.578 2.345 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3OCC(F)(F)F)nc12 919075345 JZECUQZLXLSDSP-UHFFFAOYSA-N 440.334 2.305 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 920195451 RTRZLIRGIWRXHK-UHFFFAOYSA-N 447.919 2.457 10 20 IECD Cc1ncc(Br)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 1326308723 WHJJGRYWLBDSQH-AWEZNQCLSA-N 432.322 2.179 10 20 IECD CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1C 1798922748 GPFVMOHJXRERJT-FJXIAYRNSA-N 440.500 2.293 10 20 IECD Cn1ccnc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1808626485 RKFFELILMVNMAO-GQCTYLIASA-N 440.500 2.095 10 20 IECD CNC(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1824438345 KTVJEOUEKGCUIJ-MRXNPFEDSA-N 437.924 2.121 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)[C@@H]1C[C@@H]1F 1833633686 BHBVQTZXUTTXOC-WBVHZDCISA-N 439.915 2.294 10 20 IECD O=C(CCc1cnc2ccccc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248747 JVYWNBHNYYEFFN-UHFFFAOYSA-N 432.480 2.491 10 20 IECD CC(C)c1nn2ccccc2c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249944 STFQDJBMPIJSGT-UHFFFAOYSA-N 435.484 2.395 10 20 IECD O=C(COc1ccc(O)cc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500481 GTSRJYLHOKANDS-UHFFFAOYSA-N 432.860 2.353 10 20 IECD O=C(Cc1ccc(F)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038951 GNNKOEDSCTVOBI-WEVVVXLNSA-N 426.444 2.402 10 20 IECD Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21 16544769 BQSRWSBLWKJREI-UHFFFAOYSA-N 428.539 2.416 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCCO1 727489918 NCYYVGXWMVLEKL-CYBMUJFWSA-N 435.458 2.352 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(Cl)nc3)CC2)cc1 737082391 NQBAGHKWCBRLCL-UHFFFAOYSA-N 431.924 2.011 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCN3C(=O)CCc4ccccc43)cc2)C1 737516741 DGGRFOLUGQHBOW-HXUWFJFHSA-N 434.540 2.374 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 742042217 ZIRQOFLSJYKXEC-QGZVFWFLSA-N 447.605 2.353 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742800264 PVHSQCWTCQAPRU-INIZCTEOSA-N 439.484 2.475 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1 745485207 KVBAGDSPPASCCX-UHFFFAOYSA-N 437.587 2.232 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N(C)C)c(F)c3)cn2)C[C@@H](C)O1 747097709 XCEKHFZPHRDOIP-GASCZTMLSA-N 432.500 2.046 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCCCSc1nccs1 749731453 PQPVXGCAUSJEON-UHFFFAOYSA-N 436.559 2.481 10 20 IECD CCOC(=O)C1(N(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 754072342 TYYBFMFUGLRKFT-NRFANRHFSA-N 433.593 2.376 10 20 IECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 761064625 BUXFGWBFFUXEPS-UHFFFAOYSA-N 431.489 2.250 10 20 IECD COc1ccc2c(c1)CCCN2Cn1nc(CCC(N)=O)n(C[C@H]2CCCO2)c1=S 766342582 UMPDOOUUBQXOSZ-QGZVFWFLSA-N 431.562 2.430 10 20 IECD C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NCc2ccccc2O)C1=O 771558453 DWDZXLSOLMFGBT-LJQANCHMSA-N 432.274 2.238 10 20 IECD COc1ccc(COCCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 772051356 KGLCNBIIMXGYEM-HXUWFJFHSA-N 440.544 2.413 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773307976 HKLLGWUCWMHERR-INIZCTEOSA-N 434.562 2.238 10 20 IECD CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 776118708 SMENNMKZSLHYLZ-NHCUHLMSSA-N 435.540 2.248 10 20 IECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C(C)(C)C1=O 779250025 MMDNAGZIWIGQSW-UHFFFAOYSA-N 437.543 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccccc3CN3CC[C@H](O)C3)CC2)cc1F 781833539 HIWNOCPDDOSCOX-NRFANRHFSA-N 442.535 2.433 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cc(C)ccc3OC)CC2)cc1 785525787 XWHAVSBWKFSZOU-UHFFFAOYSA-N 425.529 2.456 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 786655137 DRNIAGCKQNQTJF-RXVVDRJESA-N 428.577 2.256 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(OC)c1 786665272 HMYUSKIECDJLPB-UHFFFAOYSA-N 429.542 2.190 10 20 IECD O=C(COC(=O)[C@@H]1CCCN1C1CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 786878065 ITBRPFCSKVOTGG-NRFANRHFSA-N 433.524 2.229 10 20 IECD Cc1cc(C)c(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1 787302200 CBMCSHCMRVKFBE-FQEVSTJZSA-N 436.556 2.246 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1cc(Cl)c2c(c1)OCCO2 787873964 HPSYNEUXCKQTCC-UHFFFAOYSA-N 427.935 2.483 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC(c2cccnc2)CC1 789797595 BGNDYNOSXDCTTG-UHFFFAOYSA-N 426.492 2.080 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccc2c1OCCCO2)c1ccc(N2CCOCC2)cc1 793746175 MOBWKZVMMBFPIX-QGZVFWFLSA-N 439.512 2.178 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OC 798443258 GFYXOIJLZVYQPS-UHFFFAOYSA-N 438.477 2.140 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803299839 OEKLNXQEKCIDPA-TZYHBYERSA-N 436.556 2.262 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCN1C(=O)OC(C)(C)C 803686576 MJCTZLAMMCHRSM-INIZCTEOSA-N 430.549 2.153 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCNC(=O)Cc1cccc(F)c1 804080913 VZQJWBUXXJQSRV-UHFFFAOYSA-N 442.535 2.104 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCO)Cc3ccc(C)cc3)CC2)cc1 804315666 PHSQXBKGBICZGL-UHFFFAOYSA-N 425.529 2.110 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN([C@H]4C[C@H]5CC[C@H]4C5)CC3)CC2)cc1 804317883 RPMYYQNWAOSZAM-YDHSSHFGSA-N 440.588 2.113 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 806457297 JHTYLQJEWOYZSS-GOSISDBHSA-N 447.555 2.266 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)o1 806793349 KXPMJWKOHRZJMH-HXUWFJFHSA-N 429.517 2.141 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)CC2)cc1 809522556 GYJUJLFBDIKDNE-QRVBRYPASA-N 435.615 2.230 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@H](C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 810015137 IURMDNMAJDAVJL-PJIJBLCYSA-N 434.512 2.022 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@](CO)(C(C)C)C3)CC2)cc1 819036309 DHTNBGQGZRRWHW-HBRDYDSTSA-N 429.561 2.157 10 20 IECD COc1ccc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 917016488 UIODLJUQLXTSSQ-UHFFFAOYSA-N 431.508 2.428 10 20 IECD COc1ccc(OC)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918005254 UBDXZBAVTIKUCE-QGZVFWFLSA-N 426.517 2.405 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1OCC(F)(F)F 918340233 NJVGCHIKAYOKLN-UHFFFAOYSA-N 443.447 2.188 10 20 IECD C[C@@H]1CN(Cc2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@@H](C)O1 919812737 NOJPTYNIZYAQQQ-HZPDHXFCSA-N 447.557 2.303 10 20 IECD COc1cccc(/C=C(\C(=O)NCc2ccc(N3CCOCC3)cc2)n2nnnc2C)c1 919860330 UOYKUPDBQRVCPA-PXLXIMEGSA-N 434.500 2.141 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 920194500 DOWZLUPHHFXBQL-UHFFFAOYSA-N 444.919 2.133 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCS(=O)(=O)N2CCOCC2)c1 1338076876 SHBUTIOHLVOHMC-UHFFFAOYSA-N 425.938 2.139 10 20 IECD O=C(c1ccc(O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008213 SYRGNGCIXWAPSV-OAQYLSRUSA-N 432.860 2.214 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)c[nH]1 1790243582 ZCHWHGUXIUHPIH-QITLCBANSA-N 433.892 2.295 10 20 IECD Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1804659778 POZBPAWXWOUDHN-WZONZLPQSA-N 447.495 2.154 10 20 IECD Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1817469485 QKRFDIBYVIKRDK-LBPRGKRZSA-N 425.470 2.192 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCCn2ccnc2)[nH]n1)c1cc(O)nc(O)c1 1817848405 HWDZUWIVDGMFSO-INIZCTEOSA-N 439.476 2.199 10 20 IECD CC1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1824364724 DXWMYRNIBVXPMN-HXUWFJFHSA-N 444.576 2.458 10 20 IECD CC(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195335 LWQIVKJHJPCKQK-GBVBUYCNSA-N 447.513 2.310 10 20 IECD O=C(Cn1ccnn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830737738 UKXYJUIOIYESQB-QGZVFWFLSA-N 447.923 2.276 10 20 IECD COc1ccc(N(CC(=O)NCCCN(C)S(C)(=O)=O)Cc2cccs2)cc1 727139334 IGMXYPFXETXKAF-UHFFFAOYSA-N 425.576 2.161 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C[C@H](C)NC(=O)C3CCCCC3)CC2)cc1 727375721 LRNIAPNRZWLMSD-IBGZPJMESA-N 430.593 2.409 10 20 IECD O=C(COC(=O)C1(C(=O)NC2CC2)CCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729741555 SVWQXVPYAJECRI-UHFFFAOYSA-N 446.459 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(N(C)C)cc3)cc2F)CC1 730391443 NEQRWXXKFPPAEK-UHFFFAOYSA-N 427.524 2.289 10 20 IECD O=C(COC(=O)c1cc2c(nc1O)CCCC2)NCc1ccc(N2CCOCC2)c(F)c1 731737947 OXAOZVKXFVOKFH-UHFFFAOYSA-N 443.475 2.115 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(C(=O)N(C)C)cc1OC 734702047 RTZLRCKUFQRYHW-UHFFFAOYSA-N 442.516 2.035 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](CN2CCOCC2)C1 741811431 ZNLBDDVEMJMGRX-QZTJIDSGSA-N 447.535 2.443 10 20 IECD O=C(CNS(=O)(=O)c1cccs1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800497 SPBKRLMCDUTHGC-ZDUSSCGKSA-N 445.513 2.413 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743928498 INWREBYPZLVELD-UHFFFAOYSA-N 446.573 2.009 10 20 IECD COC(=O)c1nscc1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 751455745 GRDMWWSBFULAKF-NSHDSACASA-N 447.485 2.478 10 20 IECD CN(C)C(=O)c1ccc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[nH]1 752260342 VKVNWOJJPLCTLW-UHFFFAOYSA-N 437.523 2.262 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 758288757 JDJLSULULSEKOA-UHFFFAOYSA-N 426.441 2.067 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)CC2)cc1 762558738 LKACPYUXRYBSCR-AQNXPRMDSA-N 436.647 2.496 10 20 IECD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 763280058 PYXKABAXDUPLIF-YOEHRIQHSA-N 438.571 2.245 10 20 IECD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 765727866 QGCYVPUADPAPEY-GFCCVEGCSA-N 431.283 2.227 10 20 IECD C[C@H]1[C@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 771395033 JQTMQNWNZJTNAK-KBPBESRZSA-N 448.501 2.266 10 20 IECD CN1CCN(c2ccc(CNCCC(=O)N3CCN(c4ccc(F)cc4)CC3)cc2)CC1 771825030 VPZCKRKGXVCMGQ-UHFFFAOYSA-N 439.579 2.406 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nc4ccccc4[nH]3)CC2)cc1 778221767 QHYIUWMNQBPUDJ-KHPPLWFESA-N 433.512 2.135 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1 781524536 NEKGHYHMHOEAIG-JOCHJYFZSA-N 449.617 2.466 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 785527022 IMRUFPUTGCEUAR-QHAWAJNXSA-N 442.604 2.409 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC3C[C@H](C)C[C@@H](C)C3)CC2)cc1 785529222 VZZXFGAWROYTBC-RTBURBONSA-N 430.593 2.264 10 20 IECD Cc1csc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 788614068 ZHDSUOXJFOENQH-HUUCEWRRSA-N 434.537 2.179 10 20 IECD CCC(CC)c1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)on1 789800741 OMANRRLOOHWDCY-UHFFFAOYSA-N 432.496 2.487 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc(OC)c1OC 790024594 TUDUGJAWWTXXMV-INIZCTEOSA-N 447.454 2.064 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(CCO)Cc3cccnc3Cl)cc2)C1 792892739 DQLSGEQYMKJABT-SFHVURJKSA-N 445.951 2.141 10 20 IECD CO[C@@H](C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771394 LNPFAZBULXYCNI-WHEQGISXSA-N 447.447 2.453 10 20 IECD CNC(=O)C1CCC(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803147462 NKVOXAMXUPPEFU-UHFFFAOYSA-N 428.577 2.493 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803298334 BDRVVEOLPLKQHG-UUOWRZLLSA-N 445.560 2.138 10 20 IECD Cc1ccc([C@H]2COCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803302850 CUNRYRSHRNIFBR-FXAWDEMLSA-N 427.501 2.202 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)n1 803685204 CMLPGPOLUHHBLA-FQEVSTJZSA-N 449.555 2.266 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1F 804852957 JKYNSQYCBLSUOT-NVXWUHKLSA-N 436.528 2.271 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCO[C@H](C(C)(C)C)C3)cc2F)CC1 805008279 IOICRNYMZMXZRP-RXVVDRJESA-N 448.583 2.294 10 20 IECD O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809541779 XMVXSWHIUMDZGN-MMKMLUHNSA-N 428.529 2.364 10 20 IECD COc1cccc(/C=C(\C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n2nnnc2C)c1 818074592 SYDFOVLIQGVKPP-XQNSMLJCSA-N 448.527 2.483 10 20 IECD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccn1 914613901 OGEMFCPGWFEXQS-HNNXBMFYSA-N 442.497 2.321 10 20 IECD O=C(COc1cccc(N2CCCC2=O)c1)NCc1ccc(N2CCOCC2)c(F)c1 917708910 MRNFGBFSGVTTDC-UHFFFAOYSA-N 427.476 2.484 10 20 IECD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917709191 QWIPKLAHGWMBCG-FYJGNVAPSA-N 440.454 2.411 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)cc2)C1 917833868 UNAAECJBBXXGSX-ROUUACIJSA-N 438.503 2.197 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918033677 YVERBMJCHNQNIT-UHFFFAOYSA-N 440.500 2.342 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918295549 QHJXFICZGCOMKY-MRXNPFEDSA-N 430.432 2.464 10 20 IECD Cc1ccc(-c2cc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n[nH]2)o1 919328101 LXLAGMIJQSTIDT-UHFFFAOYSA-N 442.447 2.427 10 20 IECD COCCNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 920435730 SIJIBEILWLFBET-UHFFFAOYSA-N 432.952 2.268 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1C[C@@H]3CC[C@H]1C3)C2)c1cc(O)nc(O)c1 1777850416 BEZRRKWBKPLEST-FKGOBVFQSA-N 443.544 2.447 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cccnc1 1785947957 NLKMFSIBJLICAB-YEWWUXTCSA-N 431.876 2.053 10 20 IECD Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808788661 MSPKPPZDNOEQNM-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccn2nccc12 1821462700 CKZGUYIMPRABQJ-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1829686734 MGNDLCYYFPCRHC-OAQYLSRUSA-N 438.908 2.011 10 20 IECD CCC(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831358968 JUANLUZWEYXEHC-LKUPDRCFSA-N 430.501 2.415 10 20 IECD O=C(c1cccc2c1OCC2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441895 YWFHKSISHYXJJS-UHFFFAOYSA-N 444.491 2.231 10 20 IECD C[C@H](Oc1ccccc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442782 WMJDKTXSENKVCG-SFHVURJKSA-N 446.507 2.450 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2csc(-c3cccnc3)n2)C1 1843443794 JNWBLRSKLGLXAZ-UHFFFAOYSA-N 437.481 2.142 10 20 IECD CC1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)CC1 15401752 ZGLLAYHGHUVZTM-WOJGMQOQSA-N 447.582 2.465 10 20 IECD O=C(CN1CCC[C@H](N2CCCC2=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 732210701 DPKCUVAKLBPSOV-INIZCTEOSA-N 431.492 2.487 10 20 IECD C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 733224714 CXRHRQZIABHMJT-NWDGAFQWSA-N 444.465 2.264 10 20 IECD COc1ncc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 734049656 SPTFSPKCWFDHGR-GFCCVEGCSA-N 431.404 2.445 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)ccc3O)cc2F)C[C@@H](C)O1 745072012 KXADHKQYCHTCJD-OKILXGFUSA-N 432.448 2.324 10 20 IECD O=C(Nc1ccnn1Cc1ccccn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 746363350 USRKMXMNEBPPGF-LJQANCHMSA-N 435.484 2.178 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3csc([C@@H](C)OC)n3)CC2)cc1 747850471 DAEFZJHWTPOYQI-HOLBHBGLSA-N 437.587 2.457 10 20 IECD CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NCc1ccccc1O 748355075 RIOCKZZDLIHOQJ-HXUWFJFHSA-N 434.514 2.173 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 753446398 LZYYZNUYAXIKJU-UHFFFAOYSA-N 443.589 2.086 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1 753668226 GOODKIXLJXTFLI-GOSISDBHSA-N 434.562 2.339 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)cc2F)C[C@H](C)O1 760535919 XUVHTEUOZIHGSJ-HOTGVXAUSA-N 439.491 2.254 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cn3cnc(-c4ccccc4)n3)CC2)cc1 761219986 NLQUERNLILFRCZ-UHFFFAOYSA-N 434.544 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3C[S@@](C)=O)CC2)cc1F 762673154 OMRNQOGMZQDFRT-SSEXGKCCSA-N 433.505 2.000 10 20 IECD NC(=O)c1csc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 769386115 XCLWYPRXPYHLSH-UHFFFAOYSA-N 426.521 2.393 10 20 IECD COc1ccc(N2CCC(NC(=O)N(C)[C@@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 771767977 YUOWCCXUPXFTPL-JOCHJYFZSA-N 429.609 2.474 10 20 IECD C[C@@H](NC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 773262523 ANFODSKQNOGHJF-MRXNPFEDSA-N 433.553 2.192 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@]4(CCS(=O)(=O)C4)C3)cc2)CC1 776041069 JCRONBHWQJNYKA-KNQAVFIVSA-N 435.590 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@H]3c3ncon3)CC2)cc1 778287353 ODXMOFVYEXHSBU-YXBWYFRISA-N 425.489 2.037 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1 781505940 JBOCSWSJDJDJFF-ZDUSSCGKSA-N 440.456 2.195 10 20 IECD CO[C@]1(C(F)(F)F)CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 781976275 FJCZKAIETAUPFF-LJQANCHMSA-N 433.446 2.322 10 20 IECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 784622083 UYXMZIRAUSIAGV-UHFFFAOYSA-N 437.500 2.302 10 20 IECD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785303243 IAVSYYLBQVIGOE-OAHLLOKOSA-N 427.501 2.478 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)NCCCSc2nccs2)cc1 785559788 LETHSOWDYYIRAR-SFHVURJKSA-N 448.614 2.240 10 20 IECD C[C@H](Cc1ccccc1F)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787974140 LFQDYIGYXRYIOK-OAHLLOKOSA-N 431.483 2.290 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCC34CCN(C)CC4)cc2F)C[C@H](C)O1 789825717 OBWBVICJXIHDAN-ROUUACIJSA-N 446.567 2.142 10 20 IECD C[C@@H]1OCC[C@]1(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 790261388 WVCWOZXBLMSBQJ-AGSYNLEESA-N 426.585 2.386 10 20 IECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)c(O)c1 794381382 PRKLZHPTDJFXTI-UHFFFAOYSA-N 446.525 2.321 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@H]4[C@H](C3=O)[C@H]3CC[C@H]4O3)cc2Cl)C1 800049329 IGFQDQZJAUOTJJ-YQLOYEBCSA-N 445.947 2.355 10 20 IECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)c1 803661338 XOTANVGHOZSJJK-QGZVFWFLSA-N 428.508 2.159 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(C)c(OC)c3)CC2)cc1 804319392 PILGCCXPSFRLSD-UHFFFAOYSA-N 425.529 2.456 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)cc1F 804852494 AZYUEIXWICZATJ-QQMNAOGKSA-N 435.540 2.473 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cn1C 804959482 CIXRHJLRTVQQDU-UHFFFAOYSA-N 435.546 2.436 10 20 IECD Cc1cc(N2CCC(NC(=O)C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2)n[nH]1 805025566 VEBCJWDPROVPMP-UHFFFAOYSA-N 438.576 2.356 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(Cc1ccc(-n2cncn2)cc1)C1CC1 807099535 YIZCGAFBWWBFGE-UHFFFAOYSA-N 432.528 2.449 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](n4cc(C)cn4)C3)CC2)cc1 811994996 JXSKZRSITFHUQU-OAQYLSRUSA-N 426.565 2.369 10 20 IECD Cc1cc(C(=O)CN2CC[C@]3(CCCN(C)C3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815145523 XKSRDXLYEBNGJL-QHCPKHFHSA-N 444.601 2.342 10 20 IECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 917734753 CONJDWRTNJGSOO-UHFFFAOYSA-N 435.867 2.429 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 917762045 OYYCYZLQFXGEBA-UHFFFAOYSA-N 430.935 2.381 10 20 IECD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(O)n1 917834325 IRCAQLXBPMRWDG-INIZCTEOSA-N 443.573 2.163 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C[C@@H]2O 918224641 SBFQIHCSDUZIJL-IBGZPJMESA-N 445.491 2.438 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)C2CC2)cc1 918457034 RMIWCOSHWOXPPF-UHFFFAOYSA-N 433.505 2.425 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 1116100015 ASTRFXWAWJOOHY-UHFFFAOYSA-N 446.569 2.384 10 20 IECD CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)on1 1777851306 VINYDPCIXOKMIV-VGOFRKELSA-N 444.488 2.046 10 20 IECD Cn1c(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc2ccccc21 1792924355 QGBMFKXMIDBEBQ-BCDXTJNWSA-N 434.496 2.479 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cccnc1S 1796932069 JDZHYSSJTXJLEW-ACHSLPGTSA-N 449.536 2.415 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)C1CC(O)C1 1803052250 NXTOBCJNPTZZFS-DMPJCAKFSA-N 445.903 2.237 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)C(F)F 1806430580 BIZIEJNNIAGRGQ-DNVCBOLYSA-N 441.438 2.145 10 20 IECD CCn1nc(C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817839034 SFRGBKWMCFYAEG-HNNXBMFYSA-N 439.476 2.360 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@]3(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826266446 RKKUBPKNFSYXKE-CGMALJKESA-N 426.857 2.100 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)n(C)c2ccccc12 557934102 BAOQRIWVKHQMKJ-FQEVSTJZSA-N 446.551 2.453 10 20 IECD CC(C)CCC(=O)NCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 727769110 PVDUNCYIPJPFIH-UHFFFAOYSA-N 436.464 2.496 10 20 IECD CCOC(=O)N1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730133500 WDIULROKLJHVRS-UHFFFAOYSA-N 435.544 2.341 10 20 IECD CCN(C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1)S(C)(=O)=O 731406140 QCBQKRNAMVMARJ-UHFFFAOYSA-N 438.594 2.120 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)NCCS(=O)(=O)NC[C@H]2CCCCO2)cc1 732474734 VSNFIGOLRGFWQZ-HXUWFJFHSA-N 440.610 2.163 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 737131497 PCVKOMWJDOYWAG-UHFFFAOYSA-N 443.475 2.076 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccc(S(N)(=O)=O)cc1 751465836 KUVRLVXNSOCKLO-UHFFFAOYSA-N 449.348 2.013 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCCN2S(C)(=O)=O)cc1 753696388 HEEPEKUONQIXDL-LJQANCHMSA-N 434.562 2.481 10 20 IECD CCCC(=O)N1CSC[C@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759223641 SIGIBMQEXOYBJN-INIZCTEOSA-N 437.562 2.063 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CCCCN3C(=O)C(C)C)CC2)cc(OC)c1OC 759226585 ZXRDWGWTWBQLFO-SFHVURJKSA-N 433.549 2.398 10 20 IECD Cc1ccc(S(=O)(=O)NCCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 760987797 GKZCNRVYHGZDJG-UHFFFAOYSA-N 437.905 2.097 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](c4ccc(OC)c(F)c4)C3=O)CC2)cc1 761181432 AIZUAXDEIXQNEV-NRFANRHFSA-N 442.491 2.258 10 20 IECD COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nn1C 772641098 VQHGDWIWUCBRMK-GFCCVEGCSA-N 433.420 2.388 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3ccc(F)cc3F)CC2)c1O 774820925 JYBRCGYONXEEII-UHFFFAOYSA-N 443.428 2.094 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@]4(C3)C(=O)Nc3ccccc34)cc2)C1 779537357 RHJMHNUHTJWQRT-IQGLISFBSA-N 447.539 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-c4ncn(C)n4)c3)CC2)cc1 783613342 LXGJXQYJEBTZBT-ZHACJKMWSA-N 446.511 2.334 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H](C)c3nccs3)cc2F)C[C@@H](C)O1 789834248 LGEZIUOQVHRPML-SOUVJXGZSA-N 434.537 2.432 10 20 IECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 790020722 DQKLCOFVCPHYGY-LJQANCHMSA-N 436.578 2.137 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccccc3-n3ccnc3)CC2)cc1 793717390 JTCZUUNGRKBFGA-UHFFFAOYSA-N 433.512 2.282 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)c(O)c1 797389203 UYTIUJWXUCFLTK-UHFFFAOYSA-N 449.529 2.041 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C 802610060 SNRTWLUFUMKFRJ-UHFFFAOYSA-N 433.530 2.424 10 20 IECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308099 SWBPUXAPBNCROI-OXQOHEQNSA-N 439.512 2.349 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 803448988 KQFGAXHZCFKLPT-PBHICJAKSA-N 425.476 2.399 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ncc(C)c(OC)c3C)CC2)cc1 803666953 NKUPUXWQXCDRCE-UHFFFAOYSA-N 426.517 2.071 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCCN1C(=O)c2ccccc2C1=O 804189146 WVNIXRGPPOBYGY-UHFFFAOYSA-N 427.844 2.496 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](CCN(C)C)C(C)(C)C)cc2F)CC1 805009104 WSLPEGKSKUUNKI-NRFANRHFSA-N 449.615 2.066 10 20 IECD O=C(N[C@@H]1CCOC1)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806513010 WYTRTKLLRRGBQY-TZIWHRDSSA-N 446.548 2.102 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@@H](C)CC3)CC2)cc(OC)c1OC 806965522 JNAPMXKKAQNDIU-IAGOWNOFSA-N 433.549 2.446 10 20 IECD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290797 OTQRQAPHVNJAEQ-GOSISDBHSA-N 430.512 2.479 10 20 IECD C[C@H]1COCCN1CCNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807955327 SZJMLCZJESYOPV-SJORKVTESA-N 436.984 2.029 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)c3ccccc3)CC2)c1 915825736 AZJCJTNFBFUCRC-UHFFFAOYSA-N 437.540 2.385 10 20 IECD CCCn1c(CCC(=O)N(C)Cc2ccccc2O)nc2cc(S(N)(=O)=O)ccc21 917309040 DCNDBWOWUUUFKL-UHFFFAOYSA-N 430.530 2.391 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1-c1ccccc1F 918340135 LXNWJSCCBMGNKN-UHFFFAOYSA-N 442.516 2.485 10 20 IECD CC(=O)N(C)[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427942 ISLCLQCTRFLRMI-ZDUSSCGKSA-N 426.473 2.107 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccnnc2)cc1 1794671692 AIXRNPAGCZGKDE-IUTQVRIDSA-N 445.523 2.401 10 20 IECD 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](O)CC1 1802561991 OXAKIHNLQATKBY-PAAQBCISSA-N 430.501 2.006 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469398 MMDGXEMCTSEALA-XMSQKQJNSA-N 431.496 2.290 10 20 IECD O=C(c1ccc(O)c(F)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810554331 MASDNQUZMPKJDB-UHFFFAOYSA-N 429.448 2.496 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1824297398 ZMYFJPHCOHBXNP-IBGZPJMESA-N 441.532 2.011 10 20 IECD CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCS(=O)(=O)C1 26657157 UCJCLAMIJOFTTQ-OAHLLOKOSA-N 440.521 2.300 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)CC3CCCCC3)CC2)cc1 60318397 DGFHRBXNBCNMEK-UHFFFAOYSA-N 430.593 2.410 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 108432220 OLZOLMUZWSQFEY-SBUREZEXSA-N 428.533 2.235 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](NS(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 110179670 HOHZBCLNONIAJM-KRWDZBQOSA-N 447.557 2.062 10 20 IECD CCOC(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 727032556 JPHOTZNONXPNKQ-GOSISDBHSA-N 445.564 2.151 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCN3C[C@@H](C)O[C@H](C)C3)cc2F)CC1 730115674 XNLAXIOVWNOLHU-RTBURBONSA-N 435.588 2.266 10 20 IECD CC1CCN(c2ccc(CNC(=O)C3CCN(c4ccc5nnnn5n4)CC3)cc2)CC1 731014777 JXDKQRGDELAKKZ-UHFFFAOYSA-N 434.548 2.288 10 20 IECD CC(=O)NC1(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCC1 731252334 CREHFFWWRUZFGN-UHFFFAOYSA-N 434.448 2.393 10 20 IECD CC[C@H](C)[C@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734269378 IWUHUOQWYMKMHZ-OXJNMPFZSA-N 430.528 2.149 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccnn3CC3CC3)cc2F)C[C@@H](C)O1 746354734 KHYMUXWIZAJTRO-GASCZTMLSA-N 429.496 2.301 10 20 IECD CN(CC1CC1)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 746413661 HFCGMWJCVNXRCN-LEWJYISDSA-N 427.593 2.262 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]([C@H]3CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750251914 CGHFIKVXJXDWAG-ROUUACIJSA-N 431.558 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)CC2)cc1F 754211583 GUYFSOAQHBTCPK-UHFFFAOYSA-N 426.448 2.006 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 756327948 XACQTCMSUCTOEZ-IBGZPJMESA-N 447.557 2.262 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 762441611 PNRDHGAFYQXVFJ-ZDUSSCGKSA-N 425.411 2.098 10 20 IECD Cn1cc([C@H](O)CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 762527101 MBJKSVRTUOBPGJ-VLHYRRCOSA-N 436.584 2.313 10 20 IECD CNS(=O)(=O)c1cccc([C@H](C)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 764682819 ICQRMFMTLTXLFL-IBGZPJMESA-N 446.617 2.466 10 20 IECD CCOC(=O)Cc1csc(NC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)n1 765000000 FHNXFWGDZSNFQD-OAHLLOKOSA-N 432.546 2.375 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\c3ccc(O)c(OCC)c3)nc12 768624286 JJQYHKZQRIJKAQ-VURMDHGXSA-N 427.413 2.473 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)N(C)OC)c3)c2)CC1 770143011 HPPAHZHYFHSNTO-UHFFFAOYSA-N 432.546 2.263 10 20 IECD COc1ncc(/C=C\C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)cn1 776306726 OAIPTDRJUKAOLP-TWGQIWQCSA-N 428.514 2.262 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccnc(OC(C)C)c3)CC2)cc1 778393517 GHYNJZOXHFZFRK-CMDGGOBGSA-N 438.528 2.399 10 20 IECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCC1 789801365 RWAAPKFNGZZMTB-UHFFFAOYSA-N 435.540 2.382 10 20 IECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1Cc1ccccc1 792939888 IMGSSNOKIAVXDB-JOCHJYFZSA-N 440.563 2.137 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2c1=O 793062619 UWSJVHPWWKYPLE-UHFFFAOYSA-N 430.258 2.262 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 795557010 SQPKBAYUBMUUSB-UHFFFAOYSA-N 445.541 2.295 10 20 IECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797387642 MVWIEJMFCVHAGD-UHFFFAOYSA-N 449.529 2.076 10 20 IECD O=C(NC1CCN(C[C@H]2CCOC2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807103168 KDMMQACJCCIBKM-GOSISDBHSA-N 441.528 2.131 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@]4(CCCN(C)C4)C3)cc2F)C[C@@H](C)O1 815144725 NMALIGMLMJQMFU-GLDPYIMESA-N 432.584 2.473 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNS(=O)(=O)c2cccc(F)c2)cc1 916566450 YSHJQQOECXIQNK-HXUWFJFHSA-N 449.548 2.378 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1CN1C(=O)CNC1=O 916687835 LKDHLKJUSVQMKO-UHFFFAOYSA-N 437.500 2.239 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C(=O)NC4CC4)cc3)CC2)cc1 918461387 AFJVZIZPVPKUBY-UHFFFAOYSA-N 436.512 2.265 10 20 IECD COc1ccccc1N1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971427 XUSWAXBNOHVXSY-QGZVFWFLSA-N 441.503 2.465 10 20 IECD Cc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777848009 YRNMGQWDZNPQDO-NTKDMRAZSA-N 439.512 2.171 10 20 IECD CC(=O)NCC(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788674251 ZVPJNWLCNHJABH-UHFFFAOYSA-N 447.495 2.050 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc(Cl)n1 1798978012 QPNFTUNISFERGW-BTTYYORXSA-N 432.864 2.115 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1O 1799471967 QIYCPHOPWABKLX-CCWDJLKJSA-N 446.887 2.282 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993512 IZZDCFRVDYUWEA-GTHHWVDSSA-N 426.448 2.100 10 20 IECD Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807993520 JORPNVJQEBQKAZ-MBSDFSHPSA-N 447.495 2.154 10 20 IECD C[C@H](Oc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550891 VKYFEBKWEBOXHM-INIZCTEOSA-N 440.500 2.200 10 20 IECD O=C(COc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1813692678 AHUKLARUUJMJMR-CYBMUJFWSA-N 440.481 2.254 10 20 IECD Cc1cc(C)n(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1815926547 WWSCRMVJVJJTPA-MRXNPFEDSA-N 439.476 2.035 10 20 IECD O=C(CC1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817163832 AXVMSJBTSVOUSD-INIZCTEOSA-N 429.477 2.339 10 20 IECD O=C(Cc1cc[nH]n1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823712254 APDVFHPSLVKXFV-SNVBAGLBSA-N 447.904 2.399 10 20 IECD Cc1nnc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)s1 1827426139 LPCJRSWPABLFDM-INIZCTEOSA-N 445.545 2.129 10 20 IECD Cc1cc(C(=O)CN2C(=O)NC3(CCOCC3)C2=O)c(C)n1-c1ccc2c(c1)OCCO2 727781688 MGJICBVEWYTFJA-UHFFFAOYSA-N 439.468 2.149 10 20 IECD CCc1ccccc1NC(=S)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 727978654 MUMMGBBJWCJXPB-UHFFFAOYSA-N 433.603 2.499 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1cccc(S(=O)(=O)NC2CC2)c1 733899297 FNNYBBDGVKVPEJ-UHFFFAOYSA-N 433.602 2.045 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c1 734072627 KTBKKTVJXSZECU-UHFFFAOYSA-N 435.362 2.255 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3c(C)nc4ccnn4c3C)CC2)cc1 742919428 IMAXOGHLLHNLHZ-UHFFFAOYSA-N 436.560 2.226 10 20 IECD O=C(NC[C@H](O)COc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065332 OZIPLZKSPHLJAV-HNNXBMFYSA-N 448.522 2.424 10 20 IECD CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)ccc1Cl 753397935 ZNMSFZGELVPYMY-UHFFFAOYSA-N 446.935 2.372 10 20 IECD COC[C@@](C)(NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)OC 757012876 RXLZIEUGNUXQTB-ADYSOMBNSA-N 442.584 2.424 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3sccc3OC)CC2)cc1 760520914 RWMRSRXWYNTWCM-UHFFFAOYSA-N 425.576 2.256 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1(CO)CCOCC1 760935524 BRBAWLZDHYXFNO-SDNWHVSQSA-N 426.585 2.387 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)N1CCN(c2ncccn2)CC1 764945132 CHDWDBQCNRGJCF-UHFFFAOYSA-N 438.576 2.409 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccccc3S(=O)(=O)CCN(C)C)CC2)cc1 767174115 MCEIHKLGUQKMCL-UHFFFAOYSA-N 445.585 2.383 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1)c1ccc(N(C)C)cc1 773856022 HZHGMMODTOLCCU-OAHLLOKOSA-N 444.557 2.351 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCc2nccn2C1 786814633 JKRYQKOQEPOYEI-SFHVURJKSA-N 435.507 2.018 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN(C)C1CCCCC1)c1ccc(N2CCOCC2)cc1 787686767 GFYQHWJTIYANAC-LJQANCHMSA-N 430.593 2.471 10 20 IECD Cc1cccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)C 789812230 LHVALHUPEIGRGC-HXUWFJFHSA-N 428.508 2.495 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 789835947 RNKXOXFFZMVICF-SOLBZPMBSA-N 433.524 2.273 10 20 IECD COCc1cc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 789840421 HNBSHXLVZVSXRV-UHFFFAOYSA-N 447.482 2.005 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1nc(C2CC2)cs1 789845279 VLAHZPMWFCSSIO-UHFFFAOYSA-N 432.521 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCC(=O)OC3CCCCC3)CC2)cc1 801552618 PIGAAVLHFFRWAV-VAWYXSNFSA-N 443.544 2.282 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCOc2ccc(F)cc21)c1ccc(N2CCOCC2)cc1 803300252 RICFDCKRTNFSKV-QRWLVFNGSA-N 427.476 2.480 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C2CC2)O1 803449979 BFHPIRZQXRAIJO-AUUYWEPGSA-N 437.487 2.399 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](CC(=O)NC)c2ccccc2)cc1F 804852591 KQJMLOQVLOGJJH-LJQANCHMSA-N 428.508 2.282 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)cc1F 804852953 JJFGIELDROEVKO-PXNSSMCTSA-N 447.507 2.232 10 20 IECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 804853161 LPRVZIQLWQGAIH-UHFFFAOYSA-N 434.556 2.395 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(CC(F)(F)F)CC3)cc2)CC1 805026722 YDXUKTBGDDYDAI-UHFFFAOYSA-N 426.483 2.246 10 20 IECD C[C@@H](NC(=O)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 807678254 VWGWQLRHAVDELY-DNVCBOLYSA-N 441.507 2.492 10 20 IECD CO[C@@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1(C)C 808854649 GTSUVUDVQDDPBQ-OFVILXPXSA-N 442.604 2.155 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(CC(=O)OC)c3)cc2F)CC1 810047403 STYPWLMRTOXCSA-UHFFFAOYSA-N 449.548 2.162 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](CS(C)(=O)=O)C2)c([N+](=O)[O-])c1Br 813627401 JQDFXFFSKKYIHB-MRVPVSSYSA-N 438.256 2.145 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc4ccccc4nc3O)CC2)cc1 915571062 BMVPCMCZFABTMJ-UHFFFAOYSA-N 435.480 2.384 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1OC 917759357 OQOWXRUZFOAXPV-UHFFFAOYSA-N 442.515 2.419 10 20 IECD NC(=O)CSc1ccccc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918036198 TYUULTDPIVRMPM-INIZCTEOSA-N 441.557 2.287 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1 918434511 OKNOJBMGZXENPB-UHFFFAOYSA-N 437.500 2.186 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cnn(C)c3I)CC2)cc1 1347687337 DMPMBNLXELINKM-UHFFFAOYSA-N 440.285 2.386 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C1)C3)C2 1783222614 DWHSLTDVEVBANH-ZFFFYTDFSA-N 442.512 2.131 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3)C[C@@H]21)c1cc(O)nc(O)c1 1787292435 YUYUCILENINCNA-IEZWGBDMSA-N 437.452 2.146 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(N2CCCC2)ccn1)c1cc(O)nc(O)c1 1797051830 WZGXOXLDKYENIR-VBUUOAMHSA-N 437.500 2.054 10 20 IECD Cc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1803268281 XEOICTONTMIOLC-SBUREZEXSA-N 447.495 2.154 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nccn2c1 1818754521 KKTSGQRUHXGOBY-MRXNPFEDSA-N 447.455 2.483 10 20 IECD CCCC(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834446483 XYAXBDSSLABJGM-FNORWQNLSA-N 431.533 2.188 10 20 IECD COc1ccc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847039256 XWRMARQMSJHBOZ-UXBLZVDNSA-N 438.480 2.271 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCCN1CCN(c2ncccn2)CC1 729232359 DMGDDVQKQWXZIG-UHFFFAOYSA-N 425.581 2.286 10 20 IECD COC[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 740128822 WEOGIRJOGCBHMP-CYBMUJFWSA-N 435.458 2.210 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(F)c1 740610194 SIMOMADZRLHPAG-UHFFFAOYSA-N 434.493 2.287 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1 740813007 NEHKCBRTAQUOES-UHFFFAOYSA-N 439.515 2.360 10 20 IECD CC(C)(NC(=O)Nc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 746136098 CJSVJCZDGJDLIA-UHFFFAOYSA-N 444.557 2.138 10 20 IECD NC(=O)NC1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 748552147 NOZLYSDAHKFGIP-KAMYIIQDSA-N 438.600 2.389 10 20 IECD O=C(CNC(=O)c1cc(-c2ccccc2)on1)NCc1ccc(N2CCOCC2)c(F)c1 749733622 UJIPIHWQVWCKRI-UHFFFAOYSA-N 438.459 2.364 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccsc3C(=O)OC)cc2F)CC1 751075440 PBIOBRRBANIGCM-UHFFFAOYSA-N 441.550 2.294 10 20 IECD CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cc(OC)ccc2O)cc1 751415096 JTCNUFRVRRUYNY-UHFFFAOYSA-N 428.532 2.421 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCO[C@H]([C@@H]3CCCO3)C1)c2[N+](=O)[O-] 757425646 OZCGRJKIQXDFFQ-ROUUACIJSA-N 436.420 2.390 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCCCSc3nccs3)CC2)cs1 759586932 YPCISWVVVIHNHW-UHFFFAOYSA-N 447.633 2.106 10 20 IECD O=C(NCc1cccc(Br)c1O)NC[C@]1(N2CCOCC2)CCSC1 764764329 OOQHIXAINUMEJG-QGZVFWFLSA-N 430.368 2.162 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(Cc4cccc(F)c4)CC3)CC2)cc1 766154739 LTXHVKJDBPSZFR-UHFFFAOYSA-N 426.536 2.301 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(NS(=O)(=O)CC)cc3)ccc21 767451473 RZVKULQPRKOTCG-UHFFFAOYSA-N 425.488 2.177 10 20 IECD Cc1nn2cc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cnc2c1Cl 770551107 MRGIDCFSRBKZPG-UHFFFAOYSA-N 435.937 2.348 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(C(F)(F)F)ccn1 772951785 BXOAFONHSNOLNG-UHFFFAOYSA-N 440.397 2.456 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCCCCS(C)(=O)=O)cc2F)C[C@H](C)O1 773236256 JBULULKWDYMBDI-HOTGVXAUSA-N 429.558 2.453 10 20 IECD CCN1CCOC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775013077 MOEALEPRIKIAGB-XOBRGWDASA-N 436.464 2.053 10 20 IECD CN1CCN(c2ccc(CNCc3ccc(N4CCCS4(=O)=O)c(F)c3)cc2)CC1 775358380 OIFBROHGIDXFHX-UHFFFAOYSA-N 432.565 2.407 10 20 IECD C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 775836322 MFPROLZIGFPNML-KRWDZBQOSA-N 448.564 2.075 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCN(C(C)C)C3)CC2)cc1 778251917 HBFRPSOQGHYDGU-CTDFXDFQSA-N 428.577 2.137 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 787198075 MWMCQKAJCWFDDB-ROUUACIJSA-N 440.544 2.456 10 20 IECD COc1ccc(CCS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 788599580 FGWGPFRRCGRQGT-IBGZPJMESA-N 431.558 2.059 10 20 IECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C2CC2)cc1 788908800 AOKIQELSSCHBPG-UHFFFAOYSA-N 434.540 2.454 10 20 IECD C[C@@H](COc1cccc(F)c1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798020 AJVPDKBJCCKFFX-HNNXBMFYSA-N 433.455 2.001 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC(c2ccccn2)CC1 789840463 IWPZEAKCMPINBN-UHFFFAOYSA-N 440.519 2.204 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(Br)c2C)ccc1O 790407261 KDGRGMPEOLLUKZ-UHFFFAOYSA-N 435.321 2.172 10 20 IECD Cc1cc(C)cc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793719902 NAQLAWZLYBAHDM-OAQYLSRUSA-N 436.556 2.280 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc([N+](=O)[O-])c3OC)CC2)cc1 796310874 HQTRULSSCGHXSQ-UHFFFAOYSA-N 429.429 2.118 10 20 IECD CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451078 YBQJTBUJHOSBCO-FUHWJXTLSA-N 438.519 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3c(F)cncc3F)CC2)cc1 804824295 LNLTWNHLPFKRKM-LZNQSLFOSA-N 430.455 2.451 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 917929329 DKKRSKNCPPMCCY-MRXNPFEDSA-N 432.502 2.083 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)nc3)CC2)cc1 918000915 XEGLNSPORXTURU-UHFFFAOYSA-N 425.533 2.349 10 20 IECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 919022834 TVOXHYBATICZTD-HUUCEWRRSA-N 431.464 2.316 10 20 IECD O=C(NCC(F)(F)F)C1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919790948 UKLHXUNBSGXIHA-UHFFFAOYSA-N 428.455 2.123 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC(Cc3ccccc3)CC2)c1 920637046 XUADNGSSZKJLLA-UHFFFAOYSA-N 446.525 2.402 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3ccc(C(N)=O)cc3)c2C)cc1 1317898032 WZAPVOWKDIXIPL-UHFFFAOYSA-N 427.482 2.320 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1319763260 VMJBHONIMSGDIE-OAQYLSRUSA-N 436.556 2.497 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccn(Cc2ccccc2)c1=O 1321360493 LUCMVWOXEQVMRH-IBGZPJMESA-N 436.464 2.212 10 20 IECD C[C@@H](NC(=O)c1n[nH]cc1I)c1ccc(N2CCOCC2)cc1 1324037489 IJGIDTQKGSHXQO-LLVKDONJSA-N 426.258 2.342 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1796932711 VHLACKOAZAEVOH-NUZGMZIFSA-N 445.523 2.364 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(C(F)(F)F)c1)c1cc(O)nc(O)c1 1798943267 BHNIYBMPVPYPTQ-QDMKHBRRSA-N 436.390 2.472 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2nccn2C)C3)cc1 1799620425 MBRQMMRUNBWLNA-VTYHHJSWSA-N 447.539 2.345 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1C 1808726117 YNDYOBZKIDEDOH-IERDGZPVSA-N 435.484 2.168 10 20 IECD O=C(Cn1cncn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736456 DTJOUVCGOZGMCU-KRWDZBQOSA-N 447.923 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3F)CC2)CC1 1838739412 FMLPCHHDNFZCHT-BTBBHFPPSA-N 448.491 2.173 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(O)nc(Cl)c2)C1 1842248193 ZXEHOAXLKDHXEX-HWKANZROSA-N 445.859 2.088 10 20 IECD NC[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1 1842972160 RFCWGSVUTHSKEL-INIZCTEOSA-N 429.904 2.311 10 20 IECD CCc1noc(C)c1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844500760 VDQALVIWDBBCDB-UHFFFAOYSA-N 435.484 2.155 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726725776 HJFRFKQHNUALBT-UHFFFAOYSA-N 427.501 2.444 10 20 IECD CC[C@@H](OC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(N)=O 726996197 FWXHROYWOSKWDZ-HBZGRHIISA-N 443.344 2.457 10 20 IECD CC1CCC(N2C[C@@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2=O)CC1 731325181 ROSLSBVBGSUSEF-YMZLFWGNSA-N 440.588 2.432 10 20 IECD COc1ccc(-c2n[nH]c(CNC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2)cc1 732451444 VXSUTIKNUMDTGD-UHFFFAOYSA-N 440.479 2.455 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)c2C)cc1 735272510 BZPPPYJFQXRKDM-UHFFFAOYSA-N 437.500 2.410 10 20 IECD COc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1N1CCNC1=O 742078874 UZSFHXBZJYJQTC-UHFFFAOYSA-N 437.500 2.179 10 20 IECD C[C@@]1(C2CC2)NC(=O)N(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801445 ZJUYTGTYLMOTHQ-SZNDQCEHSA-N 436.459 2.094 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)C1CN(C(=O)OCc2ccccc2)C1 743050160 VUOUQMGMFYQKEI-UHFFFAOYSA-N 431.514 2.302 10 20 IECD CCCCn1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 746365024 XUJGDFPXGRMIDL-UHFFFAOYSA-N 431.512 2.347 10 20 IECD CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NCc1ccccc1O 748354983 RIOCKZZDLIHOQJ-FQEVSTJZSA-N 434.514 2.173 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(NC(C)=O)ccc3C)CC2)cc1F 754209623 BBOINVUYQIQHIT-UHFFFAOYSA-N 428.464 2.388 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1Cl 754212636 NQIUIIQQACMRKP-UHFFFAOYSA-N 448.882 2.135 10 20 IECD Cc1ccc([C@@H](C)NCCOc2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc2)c(O)c1 756785152 AZQHVUMZIBJLBB-OAHLLOKOSA-N 442.559 2.156 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4cc(F)c(C)cc4c3=O)CC2)cc1 758231002 NAVZIZVBELOGQY-GOSISDBHSA-N 426.492 2.036 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccccc3Cn3cncn3)n2)c[nH]1 758387811 HSKGMYITKOQWQU-UHFFFAOYSA-N 444.498 2.365 10 20 IECD CCOc1ccccc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759409498 LCIJRSVYQWXDQH-UHFFFAOYSA-N 443.500 2.398 10 20 IECD CC(C)NS(=O)(=O)c1cccnc1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 763034389 HRZUQIVVCAXAEH-KRWDZBQOSA-N 431.562 2.082 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 768076567 YSVJPFMZQFJUDE-UHFFFAOYSA-N 426.517 2.186 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cnn(-c2ccccc2)c1 768718204 XFNHAJFMXBUFEB-UHFFFAOYSA-N 433.512 2.336 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)CCNC(=O)OCc3ccccc3)CC2)cc1 771730571 JCOJTSYFKDMKAC-UHFFFAOYSA-N 447.557 2.464 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3c(OC)cccc3OC)cc2F)CC1 772650480 NYWGATNGWAWUMB-UHFFFAOYSA-N 437.537 2.463 10 20 IECD Cc1coc2ccc(NC(=O)C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc12 773341358 SIQZEJRSFUKZQF-UHFFFAOYSA-N 441.509 2.231 10 20 IECD COc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 774789662 USVUBGZJNLKSFZ-HOTGVXAUSA-N 429.492 2.381 10 20 IECD CCCCN1CCC(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778269944 WYZZHKBLEZMMSW-KTKRTIGZSA-N 428.577 2.281 10 20 IECD Cc1nccn1CCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397656 DTWSQTHWQCYRIE-UHFFFAOYSA-N 446.441 2.463 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3ccc(F)c(C)c3)CC2)cc1 785528227 OSLQWMAVLOMBCT-UHFFFAOYSA-N 442.535 2.087 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)n1 788931111 FLLBYJIXCCDUKE-HXUWFJFHSA-N 449.555 2.484 10 20 IECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788931178 XUCTYKHDTMUGSE-UHFFFAOYSA-N 430.549 2.230 10 20 IECD C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799732 PTJIYEIJDIZZPZ-IIBYNOLFSA-N 426.492 2.283 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789815899 BIPPXZUAHHSJKQ-ZIFCJYIRSA-N 434.556 2.046 10 20 IECD COc1ccc(CCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789840677 MLLKYAWPYRCKIK-UHFFFAOYSA-N 443.519 2.161 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Oc4ccc(F)nc4)CC3)CC2)cc1 792390341 ZPIIBQOXVDHGSH-HXUWFJFHSA-N 444.551 2.256 10 20 IECD Cc1ccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)cc1 793733319 MGVRBHQIICWBST-FCHUYYIVSA-N 448.567 2.329 10 20 IECD C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665381 ZWGKIOSIIPRXSP-GDBMZVCRSA-N 436.528 2.412 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1 804976268 WHYNKZNKVSPBNX-UHFFFAOYSA-N 429.539 2.059 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)NCc1cc(Cl)cc(Cl)c1O 805134463 AEEIBDTYSCLVPH-UHFFFAOYSA-N 439.342 2.476 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(c2ncnc3sccc23)CC1 806280657 HVGPWVDEKPQCTQ-UHFFFAOYSA-N 448.599 2.095 10 20 IECD CN(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCCOC1 806507860 RUPJEVIKPPJRIX-GOSISDBHSA-N 428.512 2.263 10 20 IECD O=C(NCc1cccc(CO)c1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770207 ZVPZZXOXDPAUCZ-QGZVFWFLSA-N 433.455 2.182 10 20 IECD COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NCc1cc(OC)ccc1O 810050720 MGQZCLKKRBCPKA-UHFFFAOYSA-N 444.303 2.357 10 20 IECD O=C(NC[C@@]1(N2CCOCC2)CCSC1)N(Cc1ccccc1O)C[C@H]1CCCO1 916636637 HMHVRIBFPQCZQL-KNQAVFIVSA-N 435.590 2.291 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)N4CCC[C@@H](C)C4)CC3)nc12 917105230 DFGLEKPWYSNDTK-OAHLLOKOSA-N 429.521 2.082 10 20 IECD CC(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918119200 YCRYHWRPPWMWML-HXUWFJFHSA-N 443.592 2.082 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(Cl)c3)cc2)C1 918464094 QBEOGHYUHJOPGL-AWEZNQCLSA-N 432.883 2.436 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccn(-c2ccccc2)n1 918764226 ZMRIWYIXIBOTCW-UHFFFAOYSA-N 437.475 2.227 10 20 IECD O=C1CCc2cc(OC[C@@H](O)CNC(=O)NCc3ccc(N4CCCC4)cc3)ccc2N1 920812266 NOEKHHGZVATOAP-FQEVSTJZSA-N 438.528 2.411 10 20 IECD Cc1cc(C(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccccn1 921168045 LXVXBNIAIFLKPO-UHFFFAOYSA-N 443.485 2.106 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CC1)C2 1783220271 VZJFLMFLJDBTEN-WZMUZEJKSA-N 430.501 2.131 10 20 IECD Cc1noc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795048809 LBVLSZCOGPFYPL-SEDYWJOHSA-N 427.457 2.373 10 20 IECD CC[C@@H](NC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795726573 XSSLJSWXYLEULN-IRMYBRCSSA-N 438.572 2.295 10 20 IECD CCc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804990304 XMBCLYJCSVMKRP-KSFYIVLOSA-N 447.495 2.479 10 20 IECD CNCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804211 SEKDBGJLVLLYSI-YWZLYKJASA-N 446.935 2.465 10 20 IECD Cc1cc(CCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccn1 1841944634 GIXKLDSRLCYZLE-UHFFFAOYSA-N 445.523 2.319 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 726564613 OFMYVHAVXWXQBG-UHFFFAOYSA-N 430.411 2.217 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(C)nn4C)n2)c[nH]1 727245683 FKRMZPIUZJGJSE-UHFFFAOYSA-N 432.487 2.316 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CN(C(C)=O)c4ccccc4O3)cc2F)CC1 730192889 OTXVPUPKZLRVKB-HSZRJFAPSA-N 440.519 2.398 10 20 IECD NC(=O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nn1-c1ccccc1 732275024 WWXCRVLWQGKXDN-UHFFFAOYSA-N 437.475 2.001 10 20 IECD COC(=O)N[C@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 733554449 SDRAHXIKUYUCPL-IBGZPJMESA-N 438.436 2.324 10 20 IECD CC(C)N1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1=O 734167275 QCGSCKRLFUABGM-QGZVFWFLSA-N 428.455 2.351 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(O[C@H]2CCOC2)cc1 740460973 VUDQGWBGQHCPFK-NRFANRHFSA-N 445.541 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)CC2)cc1 741803923 KEEORWDTDAQGTF-GOSISDBHSA-N 432.565 2.285 10 20 IECD CC(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1 743257405 DMAMBGMEZPFHQK-UHFFFAOYSA-N 440.499 2.396 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCN1Cc1ccc(F)cc1 747364036 LIDCTYSVDZYZOT-QFIPXVFZSA-N 445.560 2.341 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cnn(CC(=O)N(C)C)c3)cc2F)C[C@@H](C)O1 747554887 VLSCCFWPRWWVPV-GASCZTMLSA-N 432.500 2.046 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 747803010 ZAQXRWRSBLUULT-SFHVURJKSA-N 449.548 2.041 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 749646088 VBJSIBIPBAIGMB-ZDUSSCGKSA-N 429.473 2.317 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)C3Cc4ccccc4C3)CC2)cc1 751240336 JMKWPUDRRDSTJQ-UHFFFAOYSA-N 429.586 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(N4CCCS4(=O)=O)cc3)CC2)cc1F 753742571 QZVZKKKRZLFDDJ-UHFFFAOYSA-N 433.505 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 755674486 QGPYCBZQEUNJOC-UHFFFAOYSA-N 429.429 2.118 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](N(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759967625 RJBAQNAAAKSTBJ-GOSISDBHSA-N 432.590 2.340 10 20 IECD COc1cc(O)c(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)cc1OC 768442693 ZAJVFENOWDSWOT-UHFFFAOYSA-N 427.567 2.036 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc4c(cc3=O)CCCC4)cc2F)C[C@H](C)O1 768518141 YQPFKWOHDGRCLL-HOTGVXAUSA-N 428.508 2.191 10 20 IECD O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775031458 AFONPBUFVHPWCW-YADHBBJMSA-N 437.540 2.291 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc4c(cc3F)NC(=O)CC4)CC2)cc1 778602466 XKEASVBIDCUQNX-UHFFFAOYSA-N 440.475 2.443 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OC(F)F)c1 785297378 NSPADBYOOUKPOL-SNVBAGLBSA-N 438.383 2.172 10 20 IECD CC(C)CN1CCO[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 785398927 PKFQWMANOOXENC-JOCHJYFZSA-N 430.593 2.012 10 20 IECD Cc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1C 788320339 PJNOENIZXPQLHS-UHFFFAOYSA-N 436.556 2.105 10 20 IECD 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CCc1cnccc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852532 VIUDJANRGBQUAH-UHFFFAOYSA-N 435.572 2.109 10 20 IECD Cc1cc(N2CCC[C@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)C2)n(C)n1 809872097 SHDORDNCAOIFFS-FQEVSTJZSA-N 440.592 2.317 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1COc2ccc(Cl)cc2C1 916676598 MFBXPPIIXCMHBT-KRWDZBQOSA-N 434.945 2.442 10 20 IECD CN(C)c1ccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)cc1 917999576 UUFMHQYPOPVYNF-NRFANRHFSA-N 440.544 2.426 10 20 IECD CCc1nc(CN2CCN(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2)cs1 920258634 XSDWXKZFEFUTEY-UHFFFAOYSA-N 443.617 2.181 10 20 IECD Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cs1 1782004703 KGWDZHLNFCUQDE-LJQANCHMSA-N 437.905 2.273 10 20 IECD COc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804285688 HEXSTJHLDNZTLE-NCSLWMNCSA-N 439.468 2.172 10 20 IECD Cc1nscc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805185375 NCJORRLFAGPRKY-KUHUBIRLSA-N 439.497 2.286 10 20 IECD CC(C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992890 DIGIRXDNDWAPRB-FOIQADDNSA-N 428.489 2.023 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)ncn2)[nH]n1)c1cc(O)nc(O)c1 1817846392 VIYXZUHAYHFHRB-CYBMUJFWSA-N 443.851 2.279 10 20 IECD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cnn1C 1826104378 AOZOWIZCSHSEHR-SFHVURJKSA-N 427.505 2.082 10 20 IECD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@H]2C1 1827428170 KMGWOTGRHXQVHQ-GEALJGNFSA-N 442.560 2.066 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)c2ncon2)CC1 1829503985 MKTROKCDPRSPDJ-BIENSFFJSA-N 442.472 2.133 10 20 IECD Cn1cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898575 QCUIJWJUFHIVJX-INIZCTEOSA-N 448.614 2.119 10 20 IECD O=C(c1cnc2c(F)c(F)ccc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250727 HYPOMHUYODGIGX-UHFFFAOYSA-N 440.406 2.450 10 20 IECD O=C(c1c[nH]c2ncccc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441787 UHRVENHWFCBYMM-UHFFFAOYSA-N 442.479 2.173 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc([N+](=O)[O-])ccc3OC)CC2)cc1 27800312 IINAWNDYFSPJMO-UHFFFAOYSA-N 429.429 2.118 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4nc(C)cs4)CC3)CC2)cc1 742940442 UVRIOWSRGYTYET-UHFFFAOYSA-N 444.605 2.114 10 20 IECD CCn1nc(C)c(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1C 743046784 RFTYKGQUHYHEPO-UHFFFAOYSA-N 430.519 2.420 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c(OC)c1 743918317 SNSRDQBGXDCKQQ-UHFFFAOYSA-N 439.468 2.122 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3CN3CCOCC3)cc2F)C[C@@H](C)O1 745648346 JXOWDEJBSYXNHO-NSHGMRRFSA-N 434.556 2.446 10 20 IECD Cn1ccnc(N2CCN(C(=O)C(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)c1=O 746041856 KVKYYLWWYOQTCR-UHFFFAOYSA-N 445.483 2.483 10 20 IECD COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 754423556 VYYGJYJZEVSAEY-SFHVURJKSA-N 434.562 2.002 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 754542638 SAWQXXARAJOXTM-AWEZNQCLSA-N 426.494 2.462 10 20 IECD COc1cccc([C@@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC)c(Cl)c3)C2=O)c1 757857286 OCZXMBYPFSDCDN-OAQYLSRUSA-N 446.891 2.292 10 20 IECD COc1cc(N2CCN(CN3C[C@@H](c4ccccn4)CC3=O)CC2)cc(OC)c1OC 758953149 BDZBUOBWDGLKIJ-KRWDZBQOSA-N 426.517 2.203 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)S(=O)(=O)C3CCOCC3)cc2F)C[C@@H](C)O1 764927566 ZOYNNVOCMGURBA-XHSDSOJGSA-N 442.553 2.038 10 20 IECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 767393691 IIQOCEDJCDXWQU-UHFFFAOYSA-N 444.456 2.361 10 20 IECD C[C@H]1[C@@H](C)OCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770022148 AHAWOKTXBQYKJT-QWHCGFSZSA-N 435.458 2.351 10 20 IECD Cc1ccc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)nn1 773311728 RYDQSGMYGDZGOL-UHFFFAOYSA-N 433.516 2.462 10 20 IECD COCc1ccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 773508590 GBNMPYOWBJWUDD-UHFFFAOYSA-N 443.500 2.146 10 20 IECD C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccc(N(C)C)cc1 773993553 HVXYMDQPFQRNLC-MRXNPFEDSA-N 447.557 2.460 10 20 IECD CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785304637 RNFPVEQJSMKIND-OAHLLOKOSA-N 443.500 2.031 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 788401084 JPMWTNXZBNPRAW-KRWDZBQOSA-N 443.569 2.448 10 20 IECD C[C@@H]1CC(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 789953248 BCYVTSUTNJQQIQ-ZIAGYGMSSA-N 443.466 2.230 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2c(F)cccc2OC(F)(F)F)SC1=S 790589254 AYOXOLYELRBQIQ-XFFZJAGNSA-N 444.453 2.475 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 792056991 LIYJWLQOPYYWRF-QGZVFWFLSA-N 435.569 2.030 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3COCCN3C3CCCC3)CC2)cc(OC)c1OC 793816203 SRXJVXFWOVXFME-LJQANCHMSA-N 433.549 2.004 10 20 IECD C[C@@H](NC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803299389 KBWNAWZBGQJGPQ-MRXNPFEDSA-N 448.564 2.120 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O)c1ccc(N2CCOCC2)cc1 803305783 OXXJBGJGRHNPGT-VHWBZUMISA-N 443.588 2.489 10 20 IECD C[C@H](NC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803306660 VSJYNDCXHCALDU-KRWDZBQOSA-N 448.564 2.026 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 806855535 PSEOOANNNFOLQI-UHFFFAOYSA-N 445.541 2.307 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385913 UKZQEEIVHNPVAW-UHFFFAOYSA-N 434.290 2.420 10 20 IECD CC[C@@]1(C)CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768799 BQEJOMHJFUFXGE-BTYIYWSLSA-N 425.476 2.401 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc(C4CC4)n(C)n3)cc2F)C[C@@H](C)O1 810349422 DUKCYSILMWKHRX-OKILXGFUSA-N 429.496 2.305 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc2c(cc1Cl)OCO2 918284877 SQFLJACZJXJWTN-UHFFFAOYSA-N 435.839 2.299 10 20 IECD O=C(CSc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340758 SZCWDIUHGJJMOY-UHFFFAOYSA-N 435.527 2.238 10 20 IECD CCN(Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C(C)=O 920195753 BBKAAHXRRQLPDO-UHFFFAOYSA-N 438.528 2.147 10 20 IECD C[C@@H](NC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(N2CCOCC2)cc1 920921610 NHCYXFQAMBEQOI-QGZVFWFLSA-N 443.548 2.138 10 20 IECD O=C(COC(=O)Cn1cc(C2CC2)nn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1323893659 FOTACRGPIYNUBP-UHFFFAOYSA-N 430.420 2.113 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)s1 1777847993 YNEDQZIJESZWGC-QVKFZJNVSA-N 446.529 2.007 10 20 IECD Cc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782004746 LYLYKXISVKVEFJ-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1783794693 OHVCOUMYWJOJBA-HSZRJFAPSA-N 437.496 2.058 10 20 IECD Cc1ccc(C)c(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796598932 MKXLBBDTCKTWDD-BCDXTJNWSA-N 425.485 2.440 10 20 IECD CCOC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796604121 JBCPTOGYUUBGIC-BCDXTJNWSA-N 439.468 2.235 10 20 IECD CC(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1798724414 UHQLDGCYTXIKRL-ZSBFGKGUSA-N 448.907 2.046 10 20 IECD Cc1nc(N)sc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285671 NIYPBLJLPSSMBR-JDGWPXKUSA-N 444.513 2.116 10 20 IECD O=C(CCc1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807644203 DRTSWMQCHZMXQV-JPYJTQIMSA-N 447.495 2.235 10 20 IECD CC(C)(C)CC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814186246 NAYOARWVAVIIIG-BEFAXECRSA-N 448.614 2.384 10 20 IECD C/C=C/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499529 LAWVNYBVAQKPBI-KOJPTDIOSA-N 433.559 2.394 10 20 IECD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827427961 FQWNJQZRBIEPGB-GOSISDBHSA-N 427.505 2.000 10 20 IECD CC[C@H](C)CC(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828243373 RJTFGUWPPREICY-WDEREUQCSA-N 440.616 2.352 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CCc3nc(N)n[nH]3)C2)cc1 1844184124 YVZVFASYLKJNHI-UHFFFAOYSA-N 447.543 2.244 10 20 IECD CC(=O)N1C[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)Oc2ccccc21 7077671 KVLCXSDCGPEWKO-NRFANRHFSA-N 425.485 2.068 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](C3OCCO3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 728928145 NBBBSJAVSLPAAS-KRWDZBQOSA-N 447.557 2.009 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1 732164083 FMZPIUCSGXBGTR-MRXNPFEDSA-N 425.576 2.374 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C\c2cnc(C)s2)c(O)nc1=O 732727581 OQHNHNDELGKILZ-HJWRWDBZSA-N 441.513 2.189 10 20 IECD COC(=O)COc1c(C)cc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 733330750 LKULJMPDHIALDM-UHFFFAOYSA-N 446.569 2.380 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1 741095374 BTGPLQBOGUMLGK-AWEZNQCLSA-N 447.513 2.065 10 20 IECD CCOCCN1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 742403683 AZGZNUKWTGSSJS-UHFFFAOYSA-N 433.259 2.433 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1noc(-c2cccc(F)c2)n1 746136049 AFEAWADVLKZGAY-UHFFFAOYSA-N 430.461 2.041 10 20 IECD CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 748185790 LIYYQJHFAKPGHA-ICSRJNTNSA-N 428.577 2.432 10 20 IECD CC(C)(C)S(=O)(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068272 MFIXAROBWSQZAO-UHFFFAOYSA-N 446.572 2.198 10 20 IECD CN(C)[C@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCSC1 751070283 IOFBGDBGYSRXOU-SFHVURJKSA-N 441.600 2.422 10 20 IECD CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 758978976 IWWFXNDLVMYIAU-SFHVURJKSA-N 436.512 2.154 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](S(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 763640346 GIWLBAGPQUVLRV-HLLBOEOZSA-N 427.542 2.158 10 20 IECD CSc1cccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 775147647 OEAFTHDIWXILDH-UHFFFAOYSA-N 447.582 2.207 10 20 IECD CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1F 776434685 JPSDFSKIUXDGLB-UHFFFAOYSA-N 432.451 2.180 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CC(=O)OC(C)(C)C)C(C)C)CC2)cc1 778407891 QVIBZRHGGJTQSD-QXMHVHEDSA-N 445.560 2.479 10 20 IECD Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)C2)c(O)c1O 780905541 RZYVUAFZVWXRTA-INIZCTEOSA-N 447.532 2.338 10 20 IECD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)OCC(=O)c1ccc(O)c(O)c1 783614872 OXNALLHCUXVIHP-UHFFFAOYSA-N 448.497 2.256 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCn3cnc4ccccc43)CC2)cc1 785412066 QKJLWYZBEYVQHX-UHFFFAOYSA-N 435.528 2.336 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCc2nc(C)ncc2C1 786673836 MDJXANHITFYIEG-INIZCTEOSA-N 447.333 2.275 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 787197037 JCEVNLWTKVIEIU-KDURUIRLSA-N 449.555 2.004 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)cc2F)C[C@@H](C)O1 792955655 IGBSLKWKSSLCSI-HUUCEWRRSA-N 441.507 2.437 10 20 IECD Cc1cccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 793727901 WDVQYYVIZKDCBK-YADHBBJMSA-N 448.567 2.329 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 795113454 NZOJEXLKSOYMPQ-UHFFFAOYSA-N 439.465 2.182 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2Cl)C1 800049326 IGFQDQZJAUOTJJ-ALAPKIMRSA-N 445.947 2.355 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccc(N2CCOCC2)cc1 803304085 CSPSQOIHIPWLEX-OXJNMPFZSA-N 429.542 2.362 10 20 IECD C[C@H](NC(=O)C(=O)NCCc1ccc(F)c(F)c1F)c1ccc(N2CCOCC2)cc1 803312677 ZYWKMCFUGHWKBZ-AWEZNQCLSA-N 435.446 2.477 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@H]([C@@H]2CCOC2)C1 803450505 JFHLYXUESKHRDR-JKSUJKDBSA-N 437.487 2.258 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CCN(CC(F)F)CC1 803650705 IDXRAAPNZQUXML-UHFFFAOYSA-N 448.308 2.349 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2NC1=O 807386965 SFKWIAQZEYVHQM-VIFPVBQESA-N 434.246 2.129 10 20 IECD O=C(N[C@@H]1CC[C@@H]2SCCS[C@H]21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809520920 GXFXFKUYPOBSCO-FPAYPSAMSA-N 436.599 2.396 10 20 IECD Cn1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C2CC2)n1 812985395 BHIHJGXRCKPSEV-MRXNPFEDSA-N 431.924 2.376 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@](CO)(C(C)C)C3)CC2)cc1 819036307 DHTNBGQGZRRWHW-DHSLYTQISA-N 429.561 2.157 10 20 IECD CCC[C@@H](C)N1C[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 917521017 KZCSYRHPQGEOBI-WOJBJXKFSA-N 430.593 2.361 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 918284923 VDBLKJZUCQGZOK-UHFFFAOYSA-N 431.464 2.243 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2c(c1)OCCCO2 918442965 ZTONLTVEEQTNMU-UHFFFAOYSA-N 439.512 2.312 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 921202868 IHUHZKSYAMTYCG-ZFGGDYGUSA-N 446.636 2.457 10 20 IECD Cc1cccc(N2N=C(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CCC2=O)c1 1317924922 AURWFNBCAILQAC-IBGZPJMESA-N 447.539 2.496 10 20 IECD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1cccc1 1784332553 WPRBXASPEUOWCJ-SPLOXXLWSA-N 433.892 2.257 10 20 IECD CC(C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1784948626 ADROHLBDTXLHRH-JDFRZJQESA-N 440.924 2.160 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccncc1 1785952714 OIKLNZPBDCYFPN-YEWWUXTCSA-N 431.876 2.053 10 20 IECD Cc1nccn1[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935521 QHPVHGDMILNUMX-WSTLGDPDSA-N 448.527 2.184 10 20 IECD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)n1cccc1 1807998773 OMJATRIJXGODFB-CEQIKUNHSA-N 435.484 2.270 10 20 IECD O=C(CCc1cnccn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428780 IQNJGDFPIVXGPA-LJQANCHMSA-N 439.516 2.149 10 20 IECD Cn1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)n1 727353646 WBDSQXYFCSCZQL-UHFFFAOYSA-N 428.442 2.300 10 20 IECD CCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 737108098 UKRHBQGZCXUXRX-UHFFFAOYSA-N 425.464 2.287 10 20 IECD O=C(Nc1ccccc1N1CCOC1=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 737111236 UMGVNNMOWRQERP-KRWDZBQOSA-N 439.468 2.495 10 20 IECD C[C@H](CN1CCN(C)CC1)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745809205 RHCRIKSAWCBFCE-IAGOWNOFSA-N 425.524 2.192 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCCCC3)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 746172061 DPHVWFUKZBPJGJ-UHFFFAOYSA-N 432.502 2.471 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(C4(C)OCCO4)CC3)CC2)cc1 756659758 PMQRHKYYJUMUSG-UHFFFAOYSA-N 446.592 2.392 10 20 IECD CCC1CCC2(CC1)NC(=O)N(C[C@H](O)CN1CCN(c3ccc(OC)cc3)CC1)C2=O 758196369 CIUXCTNOJXGZES-RKRRMPDFSA-N 444.576 2.069 10 20 IECD CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 763425753 HOTYMBKRXPUMFI-IBGZPJMESA-N 443.569 2.041 10 20 IECD COc1ccc([C@H](CO)N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764369155 NKOYOFGRYFFSJR-QHCPKHFHSA-N 442.560 2.201 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)NCc2cccc(Br)c2O)c1 764759737 BTJCOTWUKCCREX-UHFFFAOYSA-N 428.308 2.062 10 20 IECD C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 765329426 GQLAJVXWZSSAIV-UWJYYQICSA-N 425.529 2.498 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nc4c(cc3=O)CCCC4)cc2F)C[C@@H](C)O1 768518145 YQPFKWOHDGRCLL-HZPDHXFCSA-N 428.508 2.191 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cc1)C1=S=CC=C1 770774323 CSVMCWLBHLUWFD-UHFFFAOYSA-N 449.441 2.069 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(CCO)C(C)(C)C3)c2C)cc1 781961529 APRPPYDZCJNASN-UHFFFAOYSA-N 427.545 2.452 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)Cc3cccc(C)c3)CC2)cc1 785528970 SIJFIGVIGDIUQC-UHFFFAOYSA-N 438.572 2.291 10 20 IECD Cc1ccncc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822973 XMXYWSIGPLBZDZ-IAGOWNOFSA-N 428.508 2.418 10 20 IECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C12CCCC2 789842134 AADJKXNUUPIDJI-RTWAWAEBSA-N 447.551 2.257 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1 792056989 LIYJWLQOPYYWRF-KRWDZBQOSA-N 435.569 2.030 10 20 IECD C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793727894 WCXQLZCIIZEXKX-BOFXEDATSA-N 426.561 2.184 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc(Cn4cccn4)c3)CC2)cc1 793816259 ZDTCTHNWQOCDPQ-UHFFFAOYSA-N 447.539 2.341 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(OC)c1 793865402 SDXCFEPVTBOQNC-HXUWFJFHSA-N 442.512 2.276 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCCS(=O)(=O)NC3CC3)cc2Cl)C1 800700816 QPJLKRKXPFBOAL-CQSZACIVSA-N 428.986 2.457 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687806 HHPBVMIEWKFQRX-INIZCTEOSA-N 430.549 2.058 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCOC[C@H]3CCOC3)cc2Cl)C1 804931902 VQCKCXRLTPDDSI-AEFFLSMTSA-N 437.968 2.362 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@H](c1cccnc1)C1CC1 808292642 LWNLBCGGHXCAGU-DEOSSOPVSA-N 447.583 2.497 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 809455667 ITRMUDCKSOKOAY-JOCHJYFZSA-N 440.613 2.445 10 20 IECD CCOCCO[C@@H](C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919620172 BYBRJBQZBYJCQI-AWEZNQCLSA-N 425.437 2.385 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](NC(=O)c1ccc(C)cc1)C(C)C 1321048914 PDCOXKIDXRASGI-GHTZIAJQSA-N 442.512 2.451 10 20 IECD CN1CCN(c2ccc(CNCc3cccc(N4CCCS4(=O)=O)c3)cc2F)CC1 1321162749 MSRYJMATWQWUNP-UHFFFAOYSA-N 432.565 2.407 10 20 IECD CCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792217957 LURYIBKLZNEHBL-XASOIFFZSA-N 432.517 2.233 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(F)c1 1795225337 NDMBLEPNFZEFGO-KYXSFPASSA-N 427.432 2.303 10 20 IECD CC(C)N[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)C(C)C 1809943637 RPOCQOGVOIESOK-FQEVSTJZSA-N 432.565 2.360 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C(=O)c1ccccc1 1816713905 VKDJEFBCWANZDH-MRXNPFEDSA-N 435.440 2.405 10 20 IECD COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844400 ZXFHYWOVNBIAOM-OAHLLOKOSA-N 438.444 2.239 10 20 IECD Cc1ncc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1817889754 OYMMPPFCNVNHHX-JTQLQIEISA-N 431.499 2.254 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nn[nH]c2c1 1821606493 SUOFHMGGKZFVEH-INIZCTEOSA-N 448.443 2.107 10 20 IECD O=C(CCc1cccc(O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037391 MSJGJLYFUQRHRU-JXMROGBWSA-N 438.480 2.358 10 20 IECD O=C(c1cncc2cnccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038314 LEBUXVQFYSADPA-HWKANZROSA-N 446.463 2.277 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)C=C2)cc1 466993498 ZIWCOMWMKHYNPP-UHFFFAOYSA-N 440.481 2.167 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)n(C)c2ccccc12 556100592 KTUKEDUZVOIUKJ-QFIPXVFZSA-N 447.583 2.208 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 557935308 NVQGJEZATYOTEV-KRWDZBQOSA-N 441.553 2.472 10 20 IECD COC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)N(C)C(=O)N[C@H]1c1ccccc1 727004114 OJCXCXOQUZQEQU-KRWDZBQOSA-N 426.425 2.386 10 20 IECD O=[N+]([O-])c1cccc(-c2csc(NS(=O)(=O)c3ccc(-n4cnnn4)cc3)n2)c1 727241714 BLQYRGDNYFPIFZ-UHFFFAOYSA-N 429.443 2.495 10 20 IECD O=C(CSc1ccccc1C(=O)N1CCS(=O)CC1)Nc1ccc2c(c1)OCO2 731008455 SJGMJRYMFXNWCE-UHFFFAOYSA-N 432.523 2.351 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)OC 743228690 CMNGBJVWLIJMLS-UHFFFAOYSA-N 427.457 2.418 10 20 IECD COC(=O)Cc1sc(NS(=O)(=O)c2cc(C(=O)OC)n(C)c2)nc1-c1ccccc1 745994429 DHIYPQCPCKXSCY-UHFFFAOYSA-N 449.510 2.452 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](Cc4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 746679961 RVJNXHDGCYRVAX-QWFCFKBJSA-N 443.567 2.354 10 20 IECD C[C@@H](NC(=O)OCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 747301922 OBRKXVWINIYGAB-XLIONFOSSA-N 438.528 2.319 10 20 IECD O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NCc1ccccc1O 748349626 IUSOAMARXFZNFO-UHFFFAOYSA-N 434.514 2.319 10 20 IECD COc1ccc(N(C)CC(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)c(OC)c1 752126378 RHLHRVATSPYEDG-UHFFFAOYSA-N 437.518 2.038 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN(S(=O)(=O)c4cc[nH]n4)CC3)c2C)c1 763688173 IJDLCEDZFILPKQ-UHFFFAOYSA-N 427.530 2.272 10 20 IECD COC(=O)[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cc(OC)cc(OC)c1 764631227 XLTKHKRDZOQRNQ-VGSWGCGISA-N 441.528 2.409 10 20 IECD O=Cc1ccc(OCCn2cc(C(=O)NCCc3ccc(O)c(O)c3)nn2)c(Cl)c1 767778427 JJXGPPAFIHGQDT-UHFFFAOYSA-N 430.848 2.207 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@](C)(O)c4ccccc4)n3)CC2)cc1 771084227 YBBUASWQACSLHO-XMMPIXPASA-N 436.512 2.420 10 20 IECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 771249295 GOHMSEFEHPABFR-XMMPIXPASA-N 436.512 2.379 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)CCc3ccccc3)CC2)cc1 774538144 NOZKLSVBTMPFHZ-FQEVSTJZSA-N 438.572 2.071 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)c1O 774820256 ITGQPVPDVANNTI-UHFFFAOYSA-N 435.502 2.432 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)N3CCCCC3)cc2F)C[C@@H](C)O1 774889720 MQUAJQYWXNSVKS-QZTJIDSGSA-N 448.583 2.436 10 20 IECD CCN(CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccc(C)c1 775034803 MHSWJOTZIVTGMF-UHFFFAOYSA-N 438.572 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3(N(C)C)CCCCC3)CC2)cc1 778224979 JKNKHGWPMRGFIF-VAWYXSNFSA-N 428.577 2.281 10 20 IECD Cc1cc(Br)cc([C@@H](C)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1O 779033639 YQHLSNJAVLXDPN-GDBMZVCRSA-N 426.355 2.047 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)CC(C)(C)C)cc2)CC1 786660379 FIBZHSFWYNNBLU-OAQYLSRUSA-N 428.577 2.399 10 20 IECD C[C@@H]1CCCN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 787910588 OSGRKRXDDMPFPY-HXUWFJFHSA-N 430.593 2.110 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 788401932 NJFCGIMCLWSRMM-DYESRHJHSA-N 442.512 2.492 10 20 IECD C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949523 JJEMOXBTQMYOIN-LSDHHAIUSA-N 443.466 2.090 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](C)OC4(CCOCC4)C3)CC2)cc1 790643842 RKQZDKHZOABSIU-HXUWFJFHSA-N 446.592 2.187 10 20 IECD COC(=O)c1nc([C@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)sc1C 792555615 JBTPRWBSWSHEMV-CYBMUJFWSA-N 439.515 2.293 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 793863819 OYJYWELBPHZZSR-GOSISDBHSA-N 441.528 2.294 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 797629544 IOLBAMOSGACCDC-ZDUSSCGKSA-N 430.486 2.440 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1 802021243 QVXATJMJUSPGCD-OAQYLSRUSA-N 436.512 2.451 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCCc2c[nH]nc21 803448142 JCBLICOZDILTTE-QGZVFWFLSA-N 433.459 2.290 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CCCCN1CC 804423939 AMFUSPXBGYDICD-INIZCTEOSA-N 426.355 2.494 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ncccc3F)CC2)cc1F 804852887 PVNXHLTXERALKH-UHFFFAOYSA-N 431.487 2.171 10 20 IECD CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 804975707 RJIHUBNMADTRHK-HUUCEWRRSA-N 446.577 2.400 10 20 IECD O=C(N[C@H]1CCCC[C@H]1N1CCOCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806090351 JVVHGYRNDFMPCH-LEWJYISDSA-N 441.528 2.274 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)NC2CCCCC2)CC1 807095164 AENHDPKXYGKRSO-UHFFFAOYSA-N 443.592 2.300 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 807671445 PESHUCSSBHUFRB-BULFRSBZSA-N 425.529 2.281 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CNS(=O)(=O)c2cccc(Br)c2)c1 810347726 LTAIGCPAJXZWIW-NSHDSACASA-N 443.319 2.319 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 915328054 HZDVFVFRJWDZRI-UHFFFAOYSA-N 432.546 2.404 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc2c1OCCO2 917832775 GTJOVKLAQGJQMI-MRXNPFEDSA-N 425.485 2.098 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cccs1)CCO2 1785509052 QFHRNJWXYZDQNM-LWQICCLCSA-N 430.482 2.022 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ccnn2c1 1801062157 YSDXMFVDWYPABM-HIVYQHRXSA-N 448.479 2.416 10 20 IECD CCc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1 1804335709 GDEWFZAVKKVCBK-BJWYYQGGSA-N 431.583 2.361 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)c1ncon1 1811182940 HAVSKLJQWWPEKN-BLLLJJGKSA-N 443.847 2.163 10 20 IECD CCc1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)co1 1820749548 RHNPISNKSZHDQK-SNVBAGLBSA-N 429.458 2.039 10 20 IECD CCCNC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824405195 FJFZNFHNKCPFNQ-SFHVURJKSA-N 446.548 2.033 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(C)c(C(N)=O)c3)CC2)cc1 727594876 PBVOXHFHEWPDIA-UHFFFAOYSA-N 425.533 2.436 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)C1 730175710 UJCVQTYNVQOGCU-QZTJIDSGSA-N 438.503 2.197 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3cnc4sccc4c3=O)cc2F)CC1 730194876 RTWLTXRBAIHXAY-UHFFFAOYSA-N 429.521 2.055 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1 740812975 LSLSMQIPJYAYQJ-UHFFFAOYSA-N 442.515 2.493 10 20 IECD O=C(CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)NCc1ccccc1 740919156 DMXKUYGATMMAHK-UHFFFAOYSA-N 433.556 2.206 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(C)c2)cc1OC 741650071 VKEJYSAAUSMECX-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 742805074 FXTMALQCLHPEIV-JKSUJKDBSA-N 445.532 2.435 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CSCC(=O)N1CCOCC1 743808301 SLYYNRCQRQOYQJ-UHFFFAOYSA-N 431.352 2.095 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)C2CC2)cc1 746989719 BHSQEQYRDNKSFI-UHFFFAOYSA-N 429.542 2.427 10 20 IECD CS(=O)(=O)CC1(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 752020390 PLSNYJSANTXNCU-AWEZNQCLSA-N 431.505 2.381 10 20 IECD CC(C)(C)N1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1=O 752816640 MLLAUYAGBFXGIP-ZDUSSCGKSA-N 437.543 2.384 10 20 IECD COc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 755682017 XYCODDLBLRQFAE-UHFFFAOYSA-N 447.419 2.052 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756505490 CYXHCKNZHVBYGB-QGZVFWFLSA-N 434.514 2.427 10 20 IECD CCOC(=O)CSc1cncc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 762633150 JFSNBFFBALXZFI-MRXNPFEDSA-N 429.546 2.446 10 20 IECD CN(Cc1nnc2n1CCC2)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769657088 MJMGUYGTFMLYHD-UHFFFAOYSA-N 433.515 2.064 10 20 IECD COC(=O)c1cccc(NC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 771094586 XIYISQYOFPIDFR-UHFFFAOYSA-N 447.513 2.267 10 20 IECD C[C@@H](NCC(=O)NCc1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 775258511 CNCZTMAEEBBWIG-GOSISDBHSA-N 436.556 2.382 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H](C)C[C@@H]3C)CC2)cc1 785527015 IMQIKNVXBJSVTE-CNNODRBYSA-N 430.593 2.264 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CN3[C@@H](C)CC[C@H]3C)cc2F)C[C@@H](C)O1 785742134 OHLSUUZXUURZNG-USTZCAOPSA-N 435.540 2.472 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](C)NC(=O)C3CCCCC3)cc2)CC1 786262987 RGYYDTCADODXLQ-GOSISDBHSA-N 428.577 2.446 10 20 IECD CCc1[nH]c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)c1C(=O)OC 786655478 FBTAXCATFLNGPN-UHFFFAOYSA-N 426.517 2.271 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 789844365 FZKPSUURPNLNAM-DENIHFKCSA-N 442.629 2.331 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803308768 JRFOOFNANVJORP-ROUUACIJSA-N 441.528 2.293 10 20 IECD C[C@@H](NC(=O)C(=O)N(CCO)[C@H]1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803309858 DLVSMDZCUGGXFM-JPYJTQIMSA-N 437.540 2.209 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCS(=O)(=O)c1ccccc1 803364195 ALHFANHOKIZXGO-UHFFFAOYSA-N 431.558 2.081 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cc1 803685961 QQFLLAOWNHWMIB-UHFFFAOYSA-N 436.556 2.433 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccsc3)CC2)cc1F 804852989 QRMKUJBHKUOTTG-UHFFFAOYSA-N 446.548 2.334 10 20 IECD CN(C)c1ccc(CNC(=O)Cn2nnc(Cc3ccccc3Br)n2)cc1 804914268 PSBPKGWNKSDACD-UHFFFAOYSA-N 429.322 2.409 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC(C)(C)[C@H]3CCCCO3)cc2F)CC1 805007570 MFFGLWQFEDPSHF-OAQYLSRUSA-N 448.583 2.295 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1 805327417 FRTDTTDYUIAYOE-QFIPXVFZSA-N 439.556 2.191 10 20 IECD COc1ccc(CN2CCCN(C(=O)C(=O)NCCCSc3nccs3)CC2)cc1 806280495 GHBJAUGJNNQXKP-UHFFFAOYSA-N 448.614 2.485 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 807846153 IKLVBXVANVQPSB-OAQYLSRUSA-N 437.540 2.481 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cnn(C)c3I)CC2)cc1 815258413 HWGIRUUTCPRXSI-UHFFFAOYSA-N 440.285 2.432 10 20 IECD O=C(NCc1nccs1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 917194317 HKVRWRLNOHLTLK-UHFFFAOYSA-N 434.455 2.488 10 20 IECD CN(C)C(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918117234 AWTWTELHJXXAJH-HXUWFJFHSA-N 437.544 2.090 10 20 IECD C[C@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCCCC1 918848499 FLPCXRPMNKPONL-HNNXBMFYSA-N 448.475 2.136 10 20 IECD CC1CCC(NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)CC1 1320497256 DUVOQVGISVMZRI-UHFFFAOYSA-N 445.627 2.390 10 20 IECD COc1c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cnn1-c1ccccc1 1323028343 WVCJNROVBBFZPL-UHFFFAOYSA-N 433.512 2.479 10 20 IECD CC(C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004479 WLJZTZLYUYIZKK-HXUWFJFHSA-N 426.897 2.010 10 20 IECD COC(OC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832875455 LXXOXRBPACPITA-UGAXZCSASA-N 448.516 2.055 10 20 IECD Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 97554713 YYHDVVCRHMIHNC-AWEZNQCLSA-N 437.949 2.123 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)cc2CC1 556302996 OQBMKGSJSURBOB-UHFFFAOYSA-N 429.542 2.287 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(CCNC(C)=O)cc3)n2)c[nH]1 727247638 GXXRKKIFUOIOBP-UHFFFAOYSA-N 448.526 2.404 10 20 IECD CCc1nc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccccc1 735544004 VPSVWEJEZZVSDE-UHFFFAOYSA-N 449.511 2.344 10 20 IECD Cc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1S(N)(=O)=O 735753514 MWLWYZWZSMDOGJ-UHFFFAOYSA-N 432.546 2.173 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(C)c1F 742288552 HYEHEHUQYJIESM-UHFFFAOYSA-N 426.535 2.156 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743835225 PCOCBKGSDXBQMN-LBPRGKRZSA-N 443.447 2.473 10 20 IECD O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 746133265 GHRLDCRXKUCTFK-HKBQPEDESA-N 448.516 2.248 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCC(=O)N1CCN(c2ccccn2)CC1 748465992 TYGXRKOWMOSVFO-UHFFFAOYSA-N 438.576 2.418 10 20 IECD O=c1onc(-c2ccccc2)n1C[C@@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 749298627 QGLXVKUIEXHBCT-PMACEKPBSA-N 425.485 2.251 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C(N)=O 751374190 XECPTQNRAXOBFO-MRXNPFEDSA-N 437.949 2.396 10 20 IECD CC(C)(O)CN1CCc2c(cccc2NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 753116123 SAZAKRTWXHKNTN-UHFFFAOYSA-N 433.530 2.145 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(OC)c1 753519721 AEHGKRNYHANJAL-UHFFFAOYSA-N 445.475 2.262 10 20 IECD CCNC(=O)c1cccc(C)c1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758231461 MWOXVAFRFVPONG-FQEVSTJZSA-N 427.545 2.315 10 20 IECD CCn1cc(C(=O)C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 758865631 KFVCSHSOCWPTIR-UHFFFAOYSA-N 431.404 2.043 10 20 IECD CC(C)N(CCS(C)(=O)=O)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759231154 HPYDBCZASMGTID-UHFFFAOYSA-N 428.510 2.156 10 20 IECD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761983454 RUZXYELWDMZELC-NVXWUHKLSA-N 431.986 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(OC)c3[N+](=O)[O-])CC2)cc1 769601603 UCHVIBXAHIDQPT-UHFFFAOYSA-N 429.429 2.118 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)c1 775370926 JRCJCQFWKRHLJU-QGZVFWFLSA-N 425.529 2.331 10 20 IECD CN(Cc1cc(Br)cc(Br)c1O)C[C@H](O)CN1CCOCC1 775714615 VCFRQOCRYMLJDB-ZDUSSCGKSA-N 438.160 2.042 10 20 IECD COc1ccc(N2CCC(Nc3ccc(N4CCN(S(C)(=O)=O)CC4)nc3)CC2)cc1 777706230 ZIUKACNVHGDGPU-UHFFFAOYSA-N 445.589 2.253 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccsc4n3)cc2F)C[C@@H](C)O1 785583251 KADWBIKDSVPPMN-ZIAGYGMSSA-N 445.520 2.081 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](NC(=O)c3cccs3)C(C)C)cc2)CC1 786258545 ZSCJTYKHGVTJLL-OAQYLSRUSA-N 442.585 2.487 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788932377 MYFQOSRUAFMHIZ-GOSISDBHSA-N 443.569 2.190 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)nc12 791691326 FKLGMLJNLDNBNE-UHFFFAOYSA-N 430.373 2.194 10 20 IECD COc1cncc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 791700206 KKTCUBDCILQRBB-GFCCVEGCSA-N 431.404 2.445 10 20 IECD C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 799319920 OISBLNVQPKVDFX-WIYYLYMNSA-N 436.556 2.142 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cc(S(C)(=O)=O)ccc1OC 801686383 GPCLYUCFYZMDAR-UHFFFAOYSA-N 426.560 2.376 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(CN(C)C)cc1)c1ccc(N2CCOCC2)cc1 803302353 MLKSDSMWYKLOHI-IBGZPJMESA-N 438.572 2.421 10 20 IECD C[C@@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CN1C1CC1 803451099 DPADPPUHAFNPMK-ZBFHGGJFSA-N 436.503 2.114 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386816 KTCBOMJZRPSQBF-RUZDIDTESA-N 425.304 2.288 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cc1 808079757 TYVUTQIIFOSIKC-UHFFFAOYSA-N 439.559 2.012 10 20 IECD CN(C)CCCOc1cnccc1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 808238140 TWNNKNKBJUNZID-UHFFFAOYSA-N 445.539 2.387 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 808899834 FOWAHEVWMHRDFC-HSZRJFAPSA-N 438.572 2.118 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 917714947 XCSOIEKVMXFVBR-HZPDHXFCSA-N 441.569 2.117 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 917715650 SIYQWKVBGMARAE-VNHYZAJKSA-N 431.430 2.466 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1S(C)(=O)=O 917835556 BLFNAARVVUHSLU-GOSISDBHSA-N 429.542 2.030 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920880466 ASNDLRDXGQXNCL-QGZVFWFLSA-N 431.558 2.241 10 20 IECD CN1CCN(c2ncccc2CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 921247884 MVFAQRDBMKXLEK-NRFANRHFSA-N 439.560 2.430 10 20 IECD CN1CCN(c2ccc(CN3CCc4c(cccc4S(=O)(=O)N(C)C)C3)cc2F)CC1 1117081418 LEPUMCABEVMXRK-UHFFFAOYSA-N 446.592 2.386 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc4nnc(C(F)F)n4c3)CC2)cc1 1319623050 OAHASWZSJYHCRI-UHFFFAOYSA-N 430.459 2.228 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccsc1 1794464244 OHILSECHYXEDPH-NLVNQHKVSA-N 435.596 2.260 10 20 IECD CC[C@H](C)CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1803368048 HVYUFLANAHHTQR-UVFQYZLESA-N 448.614 2.384 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCSC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001762 QMDSDGNZHXQDOS-RZQQEMMASA-N 442.541 2.351 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@H](CNC(=O)C2(F)CC2)[C@@H]1c1cccnc1 1812462280 HUPGIZVZQUNLNP-LCGKOWBWSA-N 441.459 2.420 10 20 IECD O=C(CC1CCC1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814122983 FHBROOPUIWMFSM-OXJNMPFZSA-N 446.598 2.138 10 20 IECD Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1821726307 HUDJQPRQHGBNDM-GFCCVEGCSA-N 427.486 2.136 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2ccco2)[nH]n1 1823496708 PLUBWAFLFZZWCQ-LBPRGKRZSA-N 433.515 2.169 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)sc2C1)c1cc(O)nc(O)c1 1824654090 PQCUQFGFYPGZHZ-HKBFDHSMSA-N 430.511 2.050 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)n(C)c2ccccc12 576811459 GHRRXLATBSJMTA-JENIJYKNSA-N 426.561 2.203 10 20 IECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 728207844 VMMJIPYHONBRMP-INIZCTEOSA-N 435.528 2.206 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](c1ccccc1)N1CCC(O)CC1 729522954 AMVBBKYWCOVGRL-HSZRJFAPSA-N 427.520 2.477 10 20 IECD CCN1CCC[C@H]1CN1C[C@@H](C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1=O 729627513 MPAQGMQVROAKKJ-RXVVDRJESA-N 428.577 2.113 10 20 IECD CN(CCN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1)Cc1ccccc1 731213105 IWDFPNMZSWRTPH-UHFFFAOYSA-N 437.632 2.461 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(I)cc2)c1O 737284832 TVGRSPTYUIBVAW-UHFFFAOYSA-N 426.210 2.260 10 20 IECD NC(=O)COc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 748025646 TWHLZLWUYTWRLE-UHFFFAOYSA-N 447.494 2.371 10 20 IECD CCc1nnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1C[C@H]1CCOC1 752848283 JAQXALHOSDTDRI-MRXNPFEDSA-N 431.537 2.229 10 20 IECD CCc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCOCC1 753639966 DYNNVOQSSDXHDG-OAHLLOKOSA-N 448.541 2.042 10 20 IECD COc1cc(N2CCN(C(=O)C[C@H]3Oc4ccccc4NC3=O)CC2)cc(OC)c1OC 759240145 WMFPSWIBHIRVJT-HXUWFJFHSA-N 441.484 2.151 10 20 IECD CCN(Cc1ccccc1)S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 765170367 NRVXKQUHMBPZHL-HXUWFJFHSA-N 430.574 2.245 10 20 IECD C[C@@](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)(C(N)=O)c1ccccc1 769744910 ZTSKXIRBFNXILH-FQEVSTJZSA-N 445.522 2.385 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]2CCCC[C@@H]2N1 769984452 UNOCPPPZVQQYBI-GJZGRUSLSA-N 435.527 2.138 10 20 IECD C[C@H]1COCCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770067951 CITNLADMOCSMJK-ZDUSSCGKSA-N 435.458 2.352 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cccc(S(=O)(=O)C(C)C)c3)CC2)cc1 770222375 JROHLZTVELCJRF-UHFFFAOYSA-N 445.585 2.429 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 774730945 ZYCFIWSIHWKCIW-KRWDZBQOSA-N 441.528 2.077 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1 774865806 UQCNNAAHPPRQLR-OAQYLSRUSA-N 425.529 2.148 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)cc2F)C[C@@H](C)O1 775178780 CYROVAANSQPUQY-YRGRVCCFSA-N 432.323 2.366 10 20 IECD C[C@H](NS(=O)(=O)c1ccccc1Cn1cncn1)c1ccc(N2CCOCC2)cc1 781396626 PRJAHJULUOJFBV-KRWDZBQOSA-N 427.530 2.203 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1[N+](=O)[O-] 782623412 DBLRILXCTKTGKL-UHFFFAOYSA-N 434.474 2.160 10 20 IECD CCN1CCN(c2ccc(CNC(=O)COCCNC(=O)c3ccccc3)cc2F)CC1 783965731 UMFKELUWOMRIAP-UHFFFAOYSA-N 442.535 2.030 10 20 IECD COC[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H](C)O1 784660141 ZTZUQHZFLGNVTR-TZMCWYRMSA-N 426.516 2.130 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@H](C)C1 785295072 QNDDHOLPEOQKRI-YESZJQIVSA-N 441.528 2.393 10 20 IECD CN(CCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Cc1ccccc1 785526178 DAWLHIFEVOXVPB-UHFFFAOYSA-N 438.572 2.120 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)c1C 786120292 KYOQJVYYWOHILN-UHFFFAOYSA-N 431.558 2.459 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc(Cl)nc1 786600677 BQSOEWWIWGLQPX-UHFFFAOYSA-N 441.963 2.200 10 20 IECD C[C@@H](NC(=O)C(=O)NC1CCN(C2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 787193817 SYOUEVBWLJSTDQ-GOSISDBHSA-N 428.577 2.224 10 20 IECD Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 788153746 QBLHEMHUEGWGEY-UHFFFAOYSA-N 436.434 2.178 10 20 IECD Cc1cccc2c(CCNC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c[nH]c12 789801884 VNRDDAFISNESEW-UHFFFAOYSA-N 438.503 2.427 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@]4(CCO[C@H]4C)C3)CC2)cc1 790643032 LKDFNDFRMDRBGZ-MZLICYQSSA-N 446.592 2.185 10 20 IECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCc2ccccc21 803910209 UUFMPCUYWOLFEB-GHTZIAJQSA-N 437.540 2.467 10 20 IECD CO[C@@H]1CCC[C@@H]1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804108985 ASCJMCKKOPDCRM-RVKKMQEKSA-N 425.476 2.304 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)cc1F 805094785 QKBGMAQDXVMZNH-KRWDZBQOSA-N 428.574 2.485 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1 805327415 FRTDTTDYUIAYOE-JOCHJYFZSA-N 439.556 2.191 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc2nccnc2c1Br 807023601 BDUKOKHRSCURQY-SNVBAGLBSA-N 445.273 2.489 10 20 IECD COC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 808034079 HXBXCXNYFJFCAE-IRXDYDNUSA-N 443.500 2.497 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 918443551 WQTAGBOCJLQVFU-UHFFFAOYSA-N 439.512 2.245 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1 1115904076 ILECQLPNZFOWCO-UHFFFAOYSA-N 438.981 2.055 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(-c2ccc(F)cc2F)n1 1320393367 JBGDNTLUPXDIFC-INIZCTEOSA-N 431.395 2.466 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3=NN(c4cccc(C)c4)C(=O)CC3)cc2)CC1 1321089656 VZLAHLPTELUBBG-UHFFFAOYSA-N 447.539 2.463 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c1 1322874904 YZOAFBGECZTDBX-HNNXBMFYSA-N 437.949 2.171 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@H]1C[C@@H]1C1CC1 1783946168 YFXHLQKXLULPAC-RQDXYIEZSA-N 434.920 2.391 10 20 IECD CC(=O)NCC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1791264902 LVJCWNVVRYWBBB-UHFFFAOYSA-N 447.495 2.050 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnn2c1CCC2 1800718433 RWOBPQMANMJMSZ-BTTYYORXSA-N 430.892 2.460 10 20 IECD Cc1nc(C)c(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1810870044 QIBQFQVPJSBFKE-HNAYVOBHSA-N 437.456 2.126 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)c3cnoc3)sc2C1 1817464854 HTPXYLURCGSVBL-QSLRECBCSA-N 442.453 2.187 10 20 IECD Cc1[nH]ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818318864 QMZWBAAASATRFH-AWEZNQCLSA-N 446.558 2.212 10 20 IECD COc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccc1F 1847036768 BVWCEBUPZIQFFB-VMPITWQZSA-N 442.443 2.482 10 20 IECD C[C@H](Sc1ccccc1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056338 CMWWZYMQTRBFPD-AWEZNQCLSA-N 449.623 2.231 10 20 IECD O=C(c1cc(F)cc(Cl)c1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056482 OKJRQFSMWPULHS-UHFFFAOYSA-N 441.937 2.156 10 20 IECD Cc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccc(CN3CCOCC3)cc2)c(O)c1O 727005055 DVQLBEODJHLRNP-MRXNPFEDSA-N 428.485 2.100 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 727487903 FTKHUBQHQSWGSQ-UHFFFAOYSA-N 431.514 2.107 10 20 IECD COCCc1noc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 728991675 MZNRHBHTVUPLTQ-UHFFFAOYSA-N 437.364 2.299 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1nn(-c2ccc(F)cc2)ccc1=O 731576028 UKYJHUFLHGZCPK-UHFFFAOYSA-N 426.423 2.277 10 20 IECD Cc1cc(C(=O)NCC(=O)NCCN2CCOCC2)c(C)n1-c1ccc(C(C)C)cc1 731888311 USYZHDTVTXYSMO-UHFFFAOYSA-N 426.561 2.396 10 20 IECD CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)ccc1=O 732369658 IDCFSQDIEGOBKV-UHFFFAOYSA-N 437.452 2.482 10 20 IECD O=Cc1ccc(OCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c([N+](=O)[O-])c1 736196148 NZVBNSSZKOFOQP-UHFFFAOYSA-N 427.457 2.311 10 20 IECD COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 737108833 ZCJBRVAHYGDAEM-UHFFFAOYSA-N 449.866 2.357 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3c(C)noc3C)CC2)c1 742547444 FJBCQUSJLOXEPJ-UHFFFAOYSA-N 442.560 2.350 10 20 IECD CCOC(=O)c1ccsc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 743893292 UYAXPGCXHYGARQ-UHFFFAOYSA-N 449.504 2.280 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCN(C(=O)Cc3ccc(N)cc3)CC2)cc1OCC 746403960 XXFVEEGHOOSZFS-UHFFFAOYSA-N 447.557 2.142 10 20 IECD Cc1cc(C(=O)CN2CCN(CCS(N)(=O)=O)CC2)c(C)n1-c1ccc(C(C)C)cc1 746490286 UFANPUKBCBNCNN-UHFFFAOYSA-N 446.617 2.306 10 20 IECD COCCn1cc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 747882697 FBHCHFAFCDCKOO-AWEZNQCLSA-N 430.477 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)NC(=O)CC3CCCCC3)CC2)cc1 750234673 OOLWJMGZUWKQQY-SFHVURJKSA-N 445.560 2.362 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@](C)(O)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756331670 YBMOZTSSBAVJJJ-OAQYLSRUSA-N 434.514 2.019 10 20 IECD CN(C)CCNC(=O)Cn1cc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cn1 757910063 KRZDAADAWYWITB-UHFFFAOYSA-N 429.525 2.072 10 20 IECD Cc1c(CCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1C 758603728 MSGKTIMVEXDKCE-IYBDPMFKSA-N 446.523 2.273 10 20 IECD COc1cc(N2CCN(C(=O)NCCc3cn4c(n3)CCCC4)CC2)cc(OC)c1OC 759216811 QQWDCBPQWYGPDP-UHFFFAOYSA-N 443.548 2.320 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(COC(=O)/C=C/c1ccc(O)c(O)c1)n2CC 759590248 VWWWVNQHRMRHHI-VQHVLOKHSA-N 428.445 2.286 10 20 IECD COc1cc(N2CCN(CCC(=O)NCC(=O)c3ccccc3)CC2)cc(OC)c1OC 759879360 SIEXCRHSQYDPKW-UHFFFAOYSA-N 441.528 2.224 10 20 IECD COc1cccc([C@@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC(C)C)cc3)C2=O)c1 759928572 NPONUGLXRFCJGH-HSZRJFAPSA-N 440.500 2.417 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](C)NS(=O)(=O)c2cccnc2Cl)c1 761966888 BCQVOWQVMVHRSB-NWDGAFQWSA-N 427.910 2.384 10 20 IECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2cccc(Br)c2O)c1 765769240 KPNVXLYEOFWTTA-UHFFFAOYSA-N 429.292 2.041 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773847692 SGGDESIYEZZIDO-OAHLLOKOSA-N 434.500 2.162 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778301461 IQHJROZJTKDYBH-JNCYCUAHSA-N 437.540 2.274 10 20 IECD CC(=O)N[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 779378691 QGZRJAVYEOYRKI-RNODOKPDSA-N 436.464 2.493 10 20 IECD CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785303854 MANRTRTUGJQRSM-CQSZACIVSA-N 429.473 2.418 10 20 IECD COc1cc(OC)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1OC 786261545 VNJNRYMIZMTDTD-UHFFFAOYSA-N 427.501 2.311 10 20 IECD O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 788324915 ZQWGPLPVUGJIRM-UHFFFAOYSA-N 440.500 2.187 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1 789819917 OTYCPMDSVWHXLK-QINHECLXSA-N 435.540 2.377 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CSc2ccccc21 789845281 VNBDADOMRWVAAD-SFHVURJKSA-N 429.517 2.366 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CCC(=O)OC(C)C)CC2)cc1 792601564 YIXNIYUWOPBHEY-DOJUMQAQSA-N 431.533 2.137 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H](C)c1ccccc1 793716421 BKGLXFKGRVCJDV-WFXMLNOXSA-N 436.556 2.313 10 20 IECD Cc1nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1I 798129875 JTMFYPLEMSAATO-UHFFFAOYSA-N 447.254 2.324 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](c4ccnn4C)C3)CC2)cc1 801002422 JRUGTQQDJHGNID-LJQANCHMSA-N 426.565 2.140 10 20 IECD COCCN(CCc1ccccc1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304044 CGINQYFKMBPQOF-HXUWFJFHSA-N 439.556 2.418 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1F 803662138 HIWCMGBASMMRAS-UHFFFAOYSA-N 442.413 2.203 10 20 IECD CCN(CC)C(=O)CCC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663192 SRYACKRDRQPGPW-UHFFFAOYSA-N 434.556 2.395 10 20 IECD CNc1nc(C)cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 805621327 VPZJRPYVKCGPPT-UHFFFAOYSA-N 430.420 2.398 10 20 IECD CCO[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C12CCCC2 807199895 RAJYXFLWTXXZBI-RTWAWAEBSA-N 429.561 2.336 10 20 IECD O=C(NCC[C@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807320453 JOEBWWLNOUYDJK-NVXWUHKLSA-N 425.476 2.448 10 20 IECD CCOC[C@@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770586 NAGQSVPAFOMNEL-CVEARBPZSA-N 425.476 2.258 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc(S(=O)(=O)N2CCOCC2)o1 807836210 RUNXTTJRBPJGGK-UHFFFAOYSA-N 435.285 2.243 10 20 IECD CC(C)[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 808085460 MAWCDSZYHYRXMU-JTHBVZDNSA-N 442.604 2.155 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 808611305 BAQCNTKADZHFFV-IBGZPJMESA-N 446.910 2.425 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@@H](C)[C@H]1OC 809659524 QGRSPTYGTTZFGP-DUXKGJEZSA-N 431.577 2.438 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cnccc34)cc2)C1 918464362 SVANVZNLCMAYRN-SFHVURJKSA-N 431.496 2.191 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920922943 LBFJEFPLTWEBEE-INIZCTEOSA-N 445.541 2.051 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)no1 1779133782 WVYTZPVRBSMBDL-GMKGHPLGSA-N 447.875 2.205 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc(Cl)ccc1F 1783755490 BBNMJEIEVQUGHM-KCTSRDHCSA-N 449.866 2.192 10 20 IECD COc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795089642 PUVYHWHFHXASNA-BEVBHUTCSA-N 439.468 2.172 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)nc1 1796932533 HFLKJCRVUXSLHT-GGPHIMKMSA-N 431.496 2.435 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(O)c1 1801689942 ARPUYWXCHYOOKJ-HBCWATKFSA-N 446.887 2.282 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1C 1807993340 HYTGNEFPDVCFGD-IIBYNOLFSA-N 435.484 2.168 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H](CNC(=O)C2(F)CC2)[C@@H]1c1cccnc1 1812462282 HUPGIZVZQUNLNP-YDIIOFBBSA-N 441.459 2.420 10 20 IECD COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816727422 UHDXJBFIMULROB-ZDUSSCGKSA-N 440.481 2.498 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCCC2)[nH]n1)c1cc(O)nc(O)c1 1817848454 KLFPNVMCPIWESP-MRXNPFEDSA-N 428.493 2.008 10 20 IECD CO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822448016 CUOQUSMSKZOTNF-RDTXWAMCSA-N 438.488 2.230 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)/C=C/C3CCCC3)CC2)CC1)c1cc(O)nc(O)c1 1834987380 MXDXSAKCNZEOOE-AATRIKPKSA-N 442.560 2.424 10 20 IECD O=C(c1ccccc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030388 VKPRIDHKPLZLQO-UHFFFAOYSA-N 425.485 2.419 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2CCc3ccoc3C2)C1 1841450162 NNBFQFBKKOBCCP-SFHVURJKSA-N 446.507 2.381 10 20 IECD CC[C@@H](C)[C@@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)OC 26865167 XWPVWHGAHHVIIX-ZUOKHONESA-N 437.448 2.323 10 20 IECD COc1ccc(N2CCCN(C(=O)CCNS(=O)(=O)c3ccc(F)cc3)CC2)cc1 108580835 WGDPCPCWAXJCOR-UHFFFAOYSA-N 435.521 2.242 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3ccc([S@@](C)=O)cc3)C=C2)CC1 464001935 HFQKYQYGVQKUAV-AREMUKBSSA-N 426.585 2.030 10 20 IECD CCCC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 726235100 UOYZDEHFFQEBIH-UXHICEINSA-N 443.592 2.226 10 20 IECD O=C1CCc2cc(OC[C@H](O)CNCc3ccc(N4CCOCC4)c(F)c3)ccc2N1 727467820 ADGYHTCNHKSKLT-GOSISDBHSA-N 429.492 2.077 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cc(C)nc4c3c(O)nn4C)cc2F)CC1 730235781 MTTJXJHEBHLWRJ-UHFFFAOYSA-N 426.496 2.193 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(F)c1 737118632 WUNYWBZGKGAMAL-UHFFFAOYSA-N 429.448 2.046 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4ncccc4c3)CC2)cc1 743432815 SUCCYJHLWPOLSS-UHFFFAOYSA-N 433.512 2.120 10 20 IECD CCS(=O)(=O)N(C)CCCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743552863 TXGLSPXCPJNCQV-HNNXBMFYSA-N 448.536 2.228 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1cccc(CN2CCS(=O)(=O)CC2)c1 743717273 JXEGZVXOMACDNV-UHFFFAOYSA-N 428.554 2.431 10 20 IECD CN(C)CCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 748959917 NLMFCFCMQCBUQJ-FQEVSTJZSA-N 445.608 2.031 10 20 IECD COC(=O)C[C@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 753011508 WUBREHYEZWYTAK-YOEHRIQHSA-N 427.448 2.230 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCCN(C(=O)C4CC4)C3)CC2)cc(OC)c1OC 759221884 RQGFVLKEQMCBKE-KRWDZBQOSA-N 431.533 2.010 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@H]3COC4(CCCC4)O3)CC2)cc(OC)c1OC 759296037 ADWXUTDBMADFBW-KRWDZBQOSA-N 435.521 2.230 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(C)CCO[C@H]3C3CC3)CC2)cc1 768656392 QZHFKWZCZRDNSG-MBJLAMNJSA-N 427.545 2.221 10 20 IECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n1 768716603 MGHSFIYVIRZPMI-UHFFFAOYSA-N 442.570 2.352 10 20 IECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771062504 ACBQHTVIMWRRNQ-QGZVFWFLSA-N 448.951 2.381 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(NS(=O)(=O)C(C)C)c(F)c1 775286914 PRMSTVPZVYGFIV-UHFFFAOYSA-N 446.478 2.269 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(O)(Cc4ccc(F)cc4)CC3)nc12 775741750 OCMIVRMXMUSUGH-UHFFFAOYSA-N 428.464 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)N3CCc4ccccc43)CC2)cc1 778239130 QAMIVAUCGVHYFW-DUQGCJEPSA-N 448.567 2.467 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3cccc(N4CCN(C(C)=O)CC4)c3)ccc21 780407135 FOLPFMBESZSZRT-UHFFFAOYSA-N 444.513 2.084 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780409688 ZHAMGGHRWITDBH-UHFFFAOYSA-N 431.514 2.333 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H](C)Cc3ccsc3)CC2)cc1 785527874 GBWRTABCQLDPED-SFHVURJKSA-N 444.601 2.132 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)cc1F 787145047 VBWOJNJPTURYHU-UHFFFAOYSA-N 441.551 2.464 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)C3CN(C(=O)OC(C)(C)C)C3)cc2)CC1 787328677 SQLPCMJQMQVFJS-KRWDZBQOSA-N 444.576 2.474 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 788318629 GEZVWFBBKCHOEQ-NFBKMPQASA-N 437.540 2.424 10 20 IECD CCc1cnc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)s1 788912623 XMPMQMJDNRGDLL-UHFFFAOYSA-N 427.574 2.271 10 20 IECD Cc1nc(C)c(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789822527 WXNHGOARSKOYAP-OKILXGFUSA-N 448.564 2.488 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823076 YOZMBILDCGPZOH-QZTJIDSGSA-N 436.572 2.102 10 20 IECD CN(C[C@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950850 RKFZHMVUNUMSPF-QGZVFWFLSA-N 443.466 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nccn3-c3ccccc3)CC2)cc1 801970973 YRRYBHIYEYKSIN-VAWYXSNFSA-N 445.523 2.402 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(=O)OC)C1 802530897 GBABRYXFXIAAMK-FQEVSTJZSA-N 439.516 2.377 10 20 IECD C[C@@H](NC(=O)C(=O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccc(N2CCOCC2)cc1 803302676 SMDSMJJAVLCRBI-ZPMCFJSWSA-N 449.555 2.281 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(O[C@H]2CCOC2)c1 803685429 GTLKXVLTNIWJHX-NRFANRHFSA-N 437.540 2.478 10 20 IECD Cc1ncc(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768259 GFIYZPRKRZENIS-CQSZACIVSA-N 438.500 2.497 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4nccs4)n3)cc2F)C[C@@H](C)O1 810014862 RASZTQVJEHVUAB-ZIAGYGMSSA-N 430.509 2.471 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1CN1C(=O)CNC1=O 916689041 PYDASHAXANOAQC-UHFFFAOYSA-N 441.463 2.036 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2 918121453 HGZPTVTXKVHRDI-MAUKXSAKSA-N 435.528 2.443 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 918372201 WQIAQUPLKXSCQH-UHFFFAOYSA-N 438.509 2.393 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(Cn4cncn4)c3)CC2)cc1 918461831 OBEUGJJEAJWXQZ-UHFFFAOYSA-N 434.500 2.012 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CSc3ncnc4sccc34)nc12 919026725 IXBCKVJVYWEACU-UHFFFAOYSA-N 445.482 2.452 10 20 IECD O=C(NCCNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 919919562 SZTOUKYBOJTBOQ-UHFFFAOYSA-N 428.508 2.264 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2cccnc12 920189859 WAIRGMDAPCVQHJ-UHFFFAOYSA-N 438.459 2.474 10 20 IECD O=C(CN1CCN(c2ccc(Cl)cn2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 921192607 ZUMCEQKQAIEHLV-UHFFFAOYSA-N 447.942 2.149 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccnc1 1796314894 FKIOVSSYYUGKPB-ASYHBGTLSA-N 437.496 2.483 10 20 IECD CC[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714964 KIAQUQVFMLABGH-SFTDATJTSA-N 440.544 2.170 10 20 IECD C[C@@H](Oc1ccccc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1845243141 MBGFSJRITIHDLZ-PXUDHTSWSA-N 438.480 2.488 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4ccccn4)[nH]c3=O)CC2)cc1 116154628 OZLYHKFNERSXJR-UHFFFAOYSA-N 447.539 2.388 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2nc(-c3nc[nH]n3)no2)cc1 729351507 BJMCLQRZMJXILC-KRWDZBQOSA-N 425.493 2.061 10 20 IECD CC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 744906325 GXOSBIMQJJOGHT-UHFFFAOYSA-N 442.491 2.024 10 20 IECD CN1CCCc2cc(CNC(=O)[C@@H]3CN(Cc4nc(O)c5ccccc5n4)CCO3)ccc21 746182619 PWOXXEZZPVWBGU-QFIPXVFZSA-N 447.539 2.235 10 20 IECD Cn1cc(N2CCN(C(=O)c3ccc4c(c3[N+](=O)[O-])C(=O)c3ccccc3C4=O)CC2)cn1 746408641 JQDAQWAJMLSPSU-UHFFFAOYSA-N 445.435 2.066 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3noc(-c4cccs4)n3)CC2)cc1 750323119 SKTLXIIVBBALNQ-UHFFFAOYSA-N 442.545 2.428 10 20 IECD O=C1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c(F)cc2N1 751237125 NPSSJCZJWULUSM-UHFFFAOYSA-N 447.532 2.398 10 20 IECD O=C(NCCCO[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 757424377 GIMKXBCVVOWJOT-CQSZACIVSA-N 426.516 2.180 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCO[C@@H]([C@@H]3CCCO3)C1)c2[N+](=O)[O-] 757425648 OZCGRJKIQXDFFQ-ZWKOTPCHSA-N 436.420 2.390 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)cc1F 757851589 MYFARZAAIBVDIE-JOCHJYFZSA-N 428.464 2.245 10 20 IECD C[C@H](CCS(C)(=O)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 762013983 XJNMFZZTAUSUDA-CYBMUJFWSA-N 437.484 2.164 10 20 IECD C[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 765329412 GQLAJVXWZSSAIV-LAUBAEHRSA-N 425.529 2.498 10 20 IECD COC(=O)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(C)c1 767884731 OHONLTKJWOVSSG-QFIPXVFZSA-N 447.482 2.230 10 20 IECD COc1cc(Br)cc(CN2CCN(CC(=O)N3CCCCC3)CC2)c1O 768214967 KEBZQUQDATWUDS-UHFFFAOYSA-N 426.355 2.293 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCCO)Cc3ccccc3)CC2)cc1 769084023 URERPFWUNJWSHC-UHFFFAOYSA-N 426.561 2.411 10 20 IECD CN(C)S(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 782538970 NSXDSAGVRYVXQJ-UHFFFAOYSA-N 448.614 2.490 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3[C@H]3CCCC3=O)cc2F)C[C@@H](C)O1 784355117 DNNKCRUXMXDLIA-VALFRTSSSA-N 447.551 2.126 10 20 IECD C[C@@H](OC(=O)CCCCNC(N)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785567428 SHRNYXMUELWORB-CYBMUJFWSA-N 437.452 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CN3[C@H](C)CC[C@H]3C)cc2F)C[C@@H](C)O1 785742130 OHLSUUZXUURZNG-TVFCKZIOSA-N 435.540 2.472 10 20 IECD CN(C)CCN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 787139385 ZAKDAFZHMULMDJ-UHFFFAOYSA-N 430.593 2.196 10 20 IECD COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 788498801 OTVHTLRIDPEAGS-PZJWPPBQSA-N 444.553 2.359 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C2CC2)O1 789821558 TYCRBXJHEVYXHW-KGWSRGFLSA-N 433.524 2.081 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCn4cccc4[C@H]3C)cc2F)C[C@@H](C)O1 789822326 ABBYHFLCNQLCLS-IXDOHACOSA-N 428.508 2.460 10 20 IECD Cc1cccnc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789955468 OVMROVARGCUYLP-UHFFFAOYSA-N 436.434 2.178 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1nnnn1C1CC1 790204188 LGDFGYIIZYEPRD-LBPRGKRZSA-N 439.442 2.424 10 20 IECD C[C@H](NC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 793207451 HLDDNTKQEXHDRR-KRWDZBQOSA-N 431.558 2.193 10 20 IECD Cc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)cc1 793733328 MGVRBHQIICWBST-YADHBBJMSA-N 448.567 2.329 10 20 IECD C[C@H]1OCC[C@@]12CN(C(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)CCO2 803676556 MIKUPKUXMNFUAZ-HOYKHHGWSA-N 429.561 2.478 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(c3cccnn3)CC2)cc1)C1CCCCC1 803679161 QDIMRXDUMBJRDL-UHFFFAOYSA-N 436.560 2.211 10 20 IECD C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803680182 ZNSFYXSMXIHKCS-LJQANCHMSA-N 444.620 2.375 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3C[C@H](N4CCOCC4)C[C@@H]3C)cc2F)C[C@@H](C)O1 804969372 PSZNHRMGTHBNTP-PNYFIKQUSA-N 434.556 2.444 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 806282357 VXZJVQVFFVCAAI-AWEZNQCLSA-N 436.534 2.192 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCN1C(=O)OC(C)(C)C 807291522 XTYALNWGKADNDO-KRWDZBQOSA-N 428.533 2.147 10 20 IECD C[C@@H](O)C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 809461000 DAQJDEBYQKCMDH-KNQAVFIVSA-N 439.556 2.153 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)CC2)cc1 809542087 CHZPTXPXZVFRFH-NJDAHSKKSA-N 427.545 2.198 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3cnc([N+](=O)[O-])n3)c2C)c1 917254709 YBTRSQQMGTWWNY-UHFFFAOYSA-N 441.400 2.050 10 20 IECD Cc1cccc2c(=O)n(CCC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cnc12 917832688 FRFSMZSSPYSUIB-IBGZPJMESA-N 447.539 2.113 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 918303582 AOWYTOVZWQWUKQ-UHFFFAOYSA-N 444.557 2.134 10 20 IECD O=C(NC[C@H]1CCCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 920349077 PEUYKWBDFUEGDY-OAHLLOKOSA-N 435.458 2.400 10 20 IECD COc1ccc(CCC(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 921061307 FPQMDZHSNBJOCX-UHFFFAOYSA-N 438.572 2.154 10 20 IECD Cc1cc(C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1-c1cccc(Cl)c1 921166215 STWXJYWNIRQGFF-UHFFFAOYSA-N 438.981 2.055 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)NC4CC4)C3)cc2F)CC1 1116004175 IJNHRKSJAPDMBO-GOSISDBHSA-N 431.556 2.168 10 20 IECD CNS(=O)(=O)c1ccc(Br)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 1116670149 YJXZOJRFWNQYOO-SNVBAGLBSA-N 443.319 2.129 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1ccccc1 1789430110 RFMUDWYSZGFCTA-RLTIEFLZSA-N 438.480 2.110 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H](O)c1ccccc1 1796931747 HGNNKBMUCBGLIR-RKCFAAOBSA-N 446.507 2.151 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc(C)n1 1804333219 DLXAYVZLHOZNEN-BJWYYQGGSA-N 446.598 2.065 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cncc(F)c1 1805844579 FXQNZJVTPCPMQD-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813522536 DQGPMQACESZJKD-HTAPYJJXSA-N 436.468 2.433 10 20 IECD CCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844201 SXBJDACMNWNGMA-HNNXBMFYSA-N 425.449 2.052 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1829011772 JUYCVZZPFAPLKY-SFHVURJKSA-N 427.505 2.000 10 20 IECD Cc1ccc(SCC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056656 TYKUHKGVMZNTLP-UHFFFAOYSA-N 449.623 2.151 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3F)cc2F)CC1 730269531 ZJGFCRHPJGSFOQ-UHFFFAOYSA-N 440.472 2.493 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3ccc(C(N)=O)s3)c2C)cc1 732618000 XHPWYKSRJAXEOY-UHFFFAOYSA-N 433.511 2.382 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)c(C)cc3[N+](=O)[O-])CC2)cc1 732923363 ZORBXTWNAKEKAR-UHFFFAOYSA-N 448.545 2.321 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)NC4CC4)c3)c2)CC1 740609396 JNETZWPBGHFWPB-UHFFFAOYSA-N 442.541 2.081 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)c1 741736755 PJAIDZUQENFWJO-UHFFFAOYSA-N 440.544 2.061 10 20 IECD CCNC(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 741796661 CRHKZRKRZYEPQX-UHFFFAOYSA-N 426.517 2.395 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 742921588 UKPJXJBQBQHMFW-HXUWFJFHSA-N 434.581 2.483 10 20 IECD COC(=O)Cn1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 743165268 GCBWZVNMJGTVTH-UHFFFAOYSA-N 441.410 2.233 10 20 IECD COc1ccc(N2CCN(CCN[C@H](C)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 746049338 PNSGPKJBDHRPLC-LJQANCHMSA-N 446.617 2.418 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3nnc4ccccn34)cc2F)C[C@@H](C)O1 750822348 SBEKMNFGNTZTQR-CALCHBBNSA-N 440.523 2.230 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csnc2C(=O)OC)cc1 755974830 VUNVJZRHBBRWKU-UHFFFAOYSA-N 433.533 2.272 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 756812795 ODJOPAGDMQFAER-HZPDHXFCSA-N 439.578 2.087 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](c3ccccc3)c3nccn3C)CC2)cc1 758200486 ZGLVYPAYDUYBRP-LADGPHEKSA-N 435.572 2.291 10 20 IECD CCc1ncsc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759408987 HIDHLPYTGWERHQ-UHFFFAOYSA-N 434.518 2.019 10 20 IECD CN(C)c1ccc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1 769211124 VWZDDYGWISJRRW-UHFFFAOYSA-N 431.558 2.420 10 20 IECD C[C@H](NC(=O)N1CCC[C@@H]([C@H](O)c2nccn2C)C1)c1ccc(N2CCOCC2)cc1 769976840 ABVZKHLEMOCHJM-DSKINZAPSA-N 427.549 2.473 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 771215953 ZAFXVBJGTAGKLE-FQEVSTJZSA-N 446.507 2.269 10 20 IECD O=C(CNc1ccc(C(=O)NC2CC2)cc1)NCc1ccc(N2CCOCC2)c(F)c1 772908430 YXGGXQSTKPBGBX-UHFFFAOYSA-N 426.492 2.283 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccc(Br)cc2C1=O 773757376 SGZZRICSSBGTQK-JTQLQIEISA-N 433.258 2.204 10 20 IECD Cc1noc(C)c1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774152153 BBAAGSRXEHAYJU-UHFFFAOYSA-N 440.422 2.079 10 20 IECD COc1cc(O)c(CNCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1OC 776082075 FBJZYUXOYFNRRP-QGZVFWFLSA-N 436.530 2.157 10 20 IECD C[C@@H](NC(=O)N1CCOC[C@@H]1c1noc(-c2cnn(C)c2)n1)c1ccc(N(C)C)cc1 776237225 FSKNHFIOZSZNOQ-RDTXWAMCSA-N 425.493 2.380 10 20 IECD CCC[C@H](C)NC(=O)[C@@H]1CCCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779222173 WDOAEJGJAVLUSU-QZNHQXDQSA-N 446.636 2.195 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)N(CCC)Cc2ccccc2O)cc1 784027481 IARUJIIAEVXSTE-UHFFFAOYSA-N 433.530 2.458 10 20 IECD Cc1c(NC(=O)C(=O)NCc2cccc(Br)c2O)cccc1N1CCNC1=O 787575945 NMXHWALVMPHHME-UHFFFAOYSA-N 447.289 2.248 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](c3ccnn3C)C(C)C)CC2)cc1 788539729 VOUVKVVQGZBEDF-VFCOFNOGSA-N 439.560 2.190 10 20 IECD CC(C)c1ccnc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)n1 788937911 OMJRYVPRIGRFPR-UHFFFAOYSA-N 436.560 2.165 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ncc(-c2ccccc2)cn1 789801453 SXHKCCIPZNDVED-UHFFFAOYSA-N 449.486 2.052 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c[nH]c4cccc(F)c34)cc2)CC1 790049240 NIZJTVQRANDACZ-UHFFFAOYSA-N 430.505 2.454 10 20 IECD Cc1ccccc1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793671695 HINZTWQIHUYROR-NQIIRXRSSA-N 436.556 2.060 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCC(C)(C)CC1 793724968 PQZMOJHLJJVGNI-SFHVURJKSA-N 428.577 2.432 10 20 IECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 793908578 KADQLFSDSLLHIY-OALUTQOASA-N 430.593 2.327 10 20 IECD COc1cc2c(cc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)OCC(=O)N2 797447997 JMTRSTYRJDTZMX-OAHLLOKOSA-N 448.497 2.102 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cn(C)nc1-c1ccccc1)c1ccc(N2CCOCC2)cc1 803300164 QCUZZIDDGOXSLH-SFHVURJKSA-N 447.539 2.417 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](CNC(=O)C(C)(C)C)C3)ccc21 803686160 XQHJOISCCFCZCU-SFHVURJKSA-N 428.577 2.086 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccncc1 805010225 XWMXJLJUKHEYTJ-FQEVSTJZSA-N 427.524 2.246 10 20 IECD CN1CCC(N(C[C@@H](O)CC(C)(C)C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 857501091 FFORXKJBPNGGND-KRWDZBQOSA-N 441.594 2.097 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccc(N2C(=O)CNC2=O)c1 916688988 NLSXBZPHKTZDBQ-UHFFFAOYSA-N 441.463 2.165 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 918140413 MVIAYYLYXCPUAF-HUUCEWRRSA-N 435.521 2.277 10 20 IECD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c1 919808916 MWXRDXPYCKNMKN-UHFFFAOYSA-N 444.601 2.171 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1)c1ccc(N2CCOCC2)cc1 920923235 OXWNTKJHUCOBGH-SFHVURJKSA-N 440.544 2.280 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccnn3C[C@H]3CCOC3)CC2)cc1 1116654286 CSMLZMPOYJBEBD-LJQANCHMSA-N 442.564 2.262 10 20 IECD CCOc1ccc(N2CCN(C(=O)CSc3nnnn3CC(F)(F)F)CC2)cc1 1319734069 UNNJMIUKKZPFAD-UHFFFAOYSA-N 430.456 2.075 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2cccc(Cl)c2)nn1 1320822779 NSXHDOAPURWODY-HNNXBMFYSA-N 430.848 2.236 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1Cl)c1cc(O)nc(O)c1 1802690700 SAZKZRJBLCWLKH-ZYKCCNLVSA-N 431.876 2.132 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2)n1cccc1 1802790545 YAZJVQNQFKAFRP-IZBJGVDFSA-N 433.512 2.480 10 20 IECD CC(C)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1810433134 LOWHAGSJODTOFF-PTSWNOGYSA-N 428.489 2.021 10 20 IECD CN(C)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543121 YRELEUBABAFRMX-UHFFFAOYSA-N 439.516 2.112 10 20 IECD CCOC(=O)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827429924 WKLORWWATFIJKL-KRWDZBQOSA-N 445.516 2.069 10 20 IECD Cc1ccc2cccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2n1 727615701 QAQLRBGDFMCIQW-IBGZPJMESA-N 445.523 2.500 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1 729064517 SOMDIQSOEHYUTF-CQSZACIVSA-N 449.529 2.246 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1F 732893361 DECXKILKCVTXHE-UHFFFAOYSA-N 433.871 2.330 10 20 IECD COCCS(=O)(=O)c1ccc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 733634303 SGNJPDRAJXUBOQ-UHFFFAOYSA-N 433.530 2.469 10 20 IECD CCN(CC(=O)N(CC)[C@H]1CCS(=O)(=O)C1)Cc1cc(Br)ccc1O 743873666 PZHCBCCGJRTLPP-HNNXBMFYSA-N 433.368 2.012 10 20 IECD NC(=O)[C@@H]1c2ccccc2CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744397814 FETMYHWIZMHACB-QHCPKHFHSA-N 439.471 2.485 10 20 IECD CNC(=O)CC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751069512 NMJNNDRGQYXSBT-UHFFFAOYSA-N 437.543 2.243 10 20 IECD CCOC(=O)CC[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 752055924 YIWLFYCHWGCVJI-SFHVURJKSA-N 435.540 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC([C@H]4CCOC4)CC3)CC2)cc1 752998202 ALNGDSNLMVTYBC-HCZHMGAMSA-N 427.545 2.175 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccc(F)cc4)CC3)CC2)cc1F 753858634 ZHXZKNYJBJBVBM-UHFFFAOYSA-N 430.499 2.444 10 20 IECD COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754068176 RZSIIGZJESWWEW-FYYLOGMGSA-N 427.545 2.024 10 20 IECD COc1cc(N2CCN(c3cc(N4CCC[C@H](CO)C4)ncn3)CC2)cc(OC)c1OC 758936670 UNCYAORNRRSBAF-KRWDZBQOSA-N 443.548 2.038 10 20 IECD COc1cc(N2CCN(C(=O)Cn3cnc(-c4ccccc4)n3)CC2)cc(OC)c1OC 759221700 FLVFOBZBRPWZBA-UHFFFAOYSA-N 437.500 2.320 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 768522398 MTJQKKWRLRLBFH-XMSQKQJNSA-N 434.606 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)c3ccccc3)cc2F)C[C@H](C)O1 768651083 YXZHACHICMFRQB-PONJGIIJSA-N 430.476 2.332 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H](C)[C@@H](O)C3)c2C)c1 768765374 DLEBSRUSABCTGU-XCLFUZPHSA-N 428.485 2.163 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773845462 HCEZFTVHPFQLTG-KRWDZBQOSA-N 438.528 2.349 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 774537719 MIZVUQPRUFNPER-IAGOWNOFSA-N 443.519 2.423 10 20 IECD Cc1cc(Br)cc(CN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)c1O 775649476 SGQTWRVNJAJONL-UHFFFAOYSA-N 440.363 2.433 10 20 IECD COCCO[C@@H]1COCC[C@H]1NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776942858 NWPNAKNTCAUOMP-KFKAGJAMSA-N 443.491 2.377 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](O)(c4ccc(F)cc4)C3)cc2)C1 777720090 DQAYCFLPFFQSRM-MHECFPHRSA-N 440.519 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccn(-c4ccccc4)n3)CC2)cc1 778248613 WKNWMRXEVLVGEB-QXMHVHEDSA-N 445.523 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(-n4ccnc4)cc3)CC2)cc1 778249987 KHZWXGHAJOCVTH-KHPPLWFESA-N 445.523 2.402 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/C(=O)Nc3ccc4n[nH]cc4c3)cc2)C1 778638418 YGJKWHRRBSYASE-OAGJVSPASA-N 446.511 2.076 10 20 IECD CO[C@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2C1 784670311 IKGVJGHRIXJQAO-QHCPKHFHSA-N 437.540 2.264 10 20 IECD Cn1c(=O)c2nc(COC(=O)c3ccccc3N=Nc3ccc(O)cc3)[nH]c2n(C)c1=O 785071029 CEVRGUXOSVDDFE-UHFFFAOYSA-N 434.412 2.438 10 20 IECD C[C@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788314112 YGPAFTDSYJZZTI-GOSISDBHSA-N 442.585 2.106 10 20 IECD CCc1csc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 789708497 WDPPQAXRJLUGCE-UHFFFAOYSA-N 427.574 2.492 10 20 IECD O=C(CN1CCN(C(=O)c2cccc(O)c2O)CC1)Nc1ccc(OC(F)(F)F)cc1 790474494 GKDXPOYTMQIUMN-UHFFFAOYSA-N 439.390 2.393 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(CS(C)(=O)=O)cc1 793482125 JMZFQHNMOHGEOF-UHFFFAOYSA-N 432.542 2.382 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1F 793484781 WKPTWGSFWSQQNM-UHFFFAOYSA-N 449.548 2.149 10 20 IECD CC(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793717124 GYELERBBPTYXAX-HSALFYBXSA-N 428.577 2.336 10 20 IECD C[C@@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793730024 BMVNCOOHCCFGNF-FQRUVTKNSA-N 448.567 2.195 10 20 IECD CCS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793735001 WNWGVTFDKQEABR-QUCCMNQESA-N 446.617 2.139 10 20 IECD CO[C@@H](C)CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 800832517 WLSNKVMTPJVTIM-ZDUSSCGKSA-N 442.515 2.035 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H](OCC(F)(F)F)C3)CC2)cc1 804316782 JCQVEHRGXOLMAB-GOSISDBHSA-N 443.466 2.350 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1nc([C@@H](C)OCC(C)C)no1 807099236 OIIGVZHAZIZXBT-MRXNPFEDSA-N 431.537 2.452 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 807287282 IRYFPYUZUNDPTF-GOTSBHOMSA-N 435.524 2.030 10 20 IECD COc1ccc(-c2csc3ncnc(NNC=C4C(=O)N(C)C(=O)N(C)C4=O)c23)cc1 814319342 YRYXEMXOWLLHAA-UHFFFAOYSA-N 438.469 2.218 10 20 IECD CON(C)S(=O)(=O)c1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 915333823 QBBJRFIIGJLDAE-UHFFFAOYSA-N 448.545 2.369 10 20 IECD O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918214837 LTEQFBHXBMRXLZ-UHFFFAOYSA-N 449.548 2.201 10 20 IECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918440922 UQKKDUHTKHIYSE-UHFFFAOYSA-N 428.464 2.000 10 20 IECD COCCOc1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918461421 BLLDGYFISPFVKA-UHFFFAOYSA-N 427.501 2.398 10 20 IECD CCOCCO[C@@H](C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919620399 GRGZYOKURHGYQH-AWEZNQCLSA-N 425.437 2.385 10 20 IECD C[C@H](NC(=O)N1CCC(C(=O)Nc2nncs2)CC1)c1ccc(N2CCOCC2)cc1 920870916 IIEKNHOSKDUQLO-HNNXBMFYSA-N 444.561 2.496 10 20 IECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920926519 QONYXFKJOSBEDH-KRWDZBQOSA-N 438.528 2.477 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1343416237 ZTPDGFWPIAGSNZ-UHFFFAOYSA-N 449.485 2.039 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C1CC1)C2 1783218222 FHTBKUGJQGCRIX-UAQFAXIUSA-N 442.512 2.297 10 20 IECD Cc1csc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1 1785298599 OYCOFHOICGEUJC-WBAXXEDZSA-N 445.541 2.089 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2cc(Cl)ccc2n1)c1cc(O)nc(O)c1 1797367009 AAKROUUTMYNOTR-QDMKHBRRSA-N 441.875 2.360 10 20 IECD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cs1 1807990196 GFRLYKDFWRWNIP-LIRRHRJNSA-N 439.497 2.286 10 20 IECD O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)c1ccco1 1825058700 JUVIIMNDVFIRJJ-INIZCTEOSA-N 427.457 2.202 10 20 IECD CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847051249 RWGHCCFVZOSLJN-IBGZPJMESA-N 445.610 2.490 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 15134834 PBXYJGJXYIOABW-UHFFFAOYSA-N 431.558 2.478 10 20 IECD COc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 16134699 DDPIJXNJEKMBRK-UHFFFAOYSA-N 447.557 2.054 10 20 IECD Cc1c(CNC(=O)C(=O)NCCN2CCN(Cc3ccccc3)CC2)n(C)c2ccccc12 550409066 ZBHYGAYPHOWXMC-UHFFFAOYSA-N 447.583 2.037 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cc(C4CC4)nc4c3c(O)nc(=O)n4C)CC2)cc1 726563800 RZMMSJPHEOBDMY-UHFFFAOYSA-N 449.511 2.319 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1 730810173 BZCXKEXLIXGJMT-STQMWFEESA-N 426.466 2.297 10 20 IECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 732893783 FQYKSFIIEBVNRV-UHFFFAOYSA-N 435.521 2.470 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@@](C)(c2cccc(OC)c2)C1=O)c1ccc(OC)cc1 733794008 KXDCFFXKHPCCAF-QFIPXVFZSA-N 426.473 2.029 10 20 IECD COC(=O)NCc1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 735372240 KBDSLHVKZYALMW-UHFFFAOYSA-N 441.532 2.495 10 20 IECD Cn1c(=O)nc(O)c2cc(S(=O)(=O)Nc3nc(-c4cccc(F)c4)cs3)cnc21 740758532 WLRDNSAODPHZMY-UHFFFAOYSA-N 433.446 2.098 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCN(CC(F)(F)F)C1=O 746315930 LNRRLQBNEUULMO-SFHVURJKSA-N 442.482 2.248 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnn3CCC(C)C)cc2F)CC1 746392018 BWMGWNAQSZDIKU-UHFFFAOYSA-N 444.555 2.465 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(CN(C)C)CCCC3)CC2)cc1 760138539 YSZUZKPCMPPXGB-KHPPLWFESA-N 428.577 2.138 10 20 IECD Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc2nc(O)nc(O)c12 761981833 IOOIYLBBNTUORV-AWEZNQCLSA-N 443.891 2.498 10 20 IECD C[C@@H](NS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1ccc(N2CCOCC2)cc1 765105967 SITVFCUVRBRUDY-MRXNPFEDSA-N 441.553 2.398 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H](O)C(F)(F)F)CC3)cc2)C1 766880056 IVJXNPAYUMHSMH-FUHWJXTLSA-N 442.482 2.233 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c1 768061916 VMHXKKCKOWCUIV-GFCCVEGCSA-N 425.445 2.333 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C)nn2-c2ncccn2)cc1F 768149382 XBNDBBZDUOYCLZ-UHFFFAOYSA-N 425.468 2.211 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)N(C)CC4)cc2F)CC1 776042736 UJULTMGKQKQGMV-UHFFFAOYSA-N 439.535 2.215 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](Cn3ccnc3)C(C)(C)C)CC2)cc1 778244341 CQJQDXVHWYWHEH-LCCNJJIFSA-N 439.560 2.328 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@](C)(O)c3ccc(F)cc3)CC2)cc1 778402654 PYPGCLTZKFSBIV-UWHSVAFCSA-N 441.503 2.063 10 20 IECD Cc1cc(Br)cc([C@@H](C)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1O 779033661 YQHLSNJAVLXDPN-ZBFHGGJFSA-N 426.355 2.047 10 20 IECD CS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)cn1 782896595 RERQFXYQIHVMQI-UHFFFAOYSA-N 431.514 2.491 10 20 IECD CNC(=O)[C@H]1CN(C(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)c2ccccc2O1 784060609 GNLHOTMLPRAQHR-OAQYLSRUSA-N 436.512 2.475 10 20 IECD C[C@H]1CN(Cc2cccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)C[C@@H](C)O1 785293848 CDAFTTWBIARIBS-ZACQAIPSSA-N 441.528 2.393 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)C2CC2)cc1 786118318 SKWIMTFEFQBWEQ-UHFFFAOYSA-N 438.528 2.258 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCn3cc(Br)cn3)cc2)CC1 786263484 YBHCNPZYJBTHCW-UHFFFAOYSA-N 434.338 2.021 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cccc(OC)c3OC)CC2)cc1 787927635 ZPCGZHPQWXDFOZ-UHFFFAOYSA-N 441.528 2.110 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 788312613 KXMJPSHOUVMFHH-HXUWFJFHSA-N 425.504 2.370 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(NC(C)=O)nc3)cc2F)CC1 788979581 FLMYARYOVMRRNI-UHFFFAOYSA-N 428.512 2.320 10 20 IECD C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735909 ZPJRCAWSPIQKGY-HCLVMJGWSA-N 448.567 2.444 10 20 IECD CO[C@@H](C)c1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 803305733 OKEZMCDFCZVQPF-CABCVRRESA-N 432.546 2.181 10 20 IECD CCC(O)(CC)CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451602 QTLKISYBLUCQDN-UHFFFAOYSA-N 427.492 2.430 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)c3cccc(C)c3C)CC2)cc1 803747647 SUNDNRQMADVRGN-FQEVSTJZSA-N 438.572 2.428 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@@H]3COc4ccccc4O3)CC2)cc1 804317707 MZXFDABQEDIXID-HXUWFJFHSA-N 439.512 2.079 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)n1 807287577 KQHQSXNEVDHBCD-FQEVSTJZSA-N 447.539 2.260 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289148 KLXARIBPXZRCRR-XLIONFOSSA-N 442.560 2.441 10 20 IECD Cc1onc(N)c1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 809838671 BJCCBXKOPDBPAM-OAHLLOKOSA-N 439.538 2.176 10 20 IECD COc1cc(N2CCN(C[C@@](C)(O)CNC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 809976626 HJUKINJDPNYXHS-QFIPXVFZSA-N 439.553 2.110 10 20 IECD Cn1cc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)c(C(F)F)n1 812219373 FVTZYBZIFUYQPA-WUXMJOGZSA-N 444.510 2.407 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920866208 XTXZSFKGHWCRLO-QGZVFWFLSA-N 431.558 2.241 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@H]1Cc2ccccc2NC1=O 1254761238 LWBYNEFEBQGNJA-WMZOPIPTSA-N 426.469 2.279 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2 1782008604 FQRCAZKZDMIBHP-SQIUQIIDSA-N 436.917 2.070 10 20 IECD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1 1785510288 TVICZWMWAUFASK-RXVLNYDTSA-N 438.480 2.269 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc(Cl)n1 1796601530 USKUREQIJCNQBU-BTTYYORXSA-N 432.864 2.115 10 20 IECD COc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283964 RNYIQSASSHAFEM-BEVBHUTCSA-N 439.468 2.172 10 20 IECD Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1807990663 KAKBPUWHFORTMN-KBXCAEBGSA-N 439.497 2.286 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)[C@H](O)c3ccccc3)C2)CC1 1809459657 XEACLHLMXNCVOZ-HXUWFJFHSA-N 425.485 2.071 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2nc(O)n3c2CCCC3)C1 1844397657 VSNWWOGBQQQPKR-UHFFFAOYSA-N 446.891 2.120 10 20 IECD Cc1ccn2c(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)cnc2c1 1845697017 PLSBQXCWSLXZDH-GQCTYLIASA-N 448.479 2.290 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(F)cc1F 726727669 SNWTWAQYVUUVIO-UHFFFAOYSA-N 447.438 2.484 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OC(F)F 727176582 MSKAQOSLMHEUCX-WQLSENKSSA-N 438.499 2.047 10 20 IECD COC(=O)C[C@H]1CCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 728913713 GENHRBQUXRDKEF-GOSISDBHSA-N 447.557 2.342 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCS(=O)(=O)CC4)C3=O)c2C)cc1 729153984 XTRVCZRVSYSWOO-UHFFFAOYSA-N 443.525 2.084 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(O)nc4ccc([N+](=O)[O-])cc34)cc2)C1 732275428 WZLCYFSSYNILLQ-HNNXBMFYSA-N 449.467 2.480 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c(OC)c(OC)c1 743906208 KGPLODDPHAIGLI-LLVKDONJSA-N 432.429 2.021 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CSc3nnc(S)s3)CC2)cc1 747350882 VRKNUUMKMKEUNL-UHFFFAOYSA-N 439.632 2.256 10 20 IECD C[C@@H](OC(=O)c1ccc(C(N)=O)cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 748894236 SERQVNCMFRNUJJ-GFCCVEGCSA-N 443.415 2.140 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccccc3N3CCC(C(N)=O)CC3)ccc21 749032632 ARAMOPQPOWAUML-UHFFFAOYSA-N 449.555 2.026 10 20 IECD COc1cc(-c2noc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)ccc1C 750028459 RSGZLVPRTZBAPS-UHFFFAOYSA-N 433.442 2.488 10 20 IECD CC(C)[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCC[C@H](C(N)=O)C1 751931878 UUBPZVPJILEGIE-KXBFYZLASA-N 444.557 2.221 10 20 IECD CSCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 759379772 MWFNTBIPSRQZRD-UHFFFAOYSA-N 447.582 2.039 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 759398983 ACIVZQMPWYVUIR-UHFFFAOYSA-N 435.521 2.024 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O 767338411 OHFASDNELPHFAI-LAUBAEHRSA-N 433.574 2.137 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(OC)c(C(=O)OC)c3)c2)CC1 769846613 ADQUIBCTJSGCAC-UHFFFAOYSA-N 433.530 2.425 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 774778811 FNUVNFDJEVBBKI-LEWJYISDSA-N 425.529 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3cn4cccc(C)c4n3)CC2)cc1 778302645 SJLAKGKVMSCNPD-MDZDMXLPSA-N 447.539 2.215 10 20 IECD CN(CC(=O)OCC(=O)c1ccc(O)c(O)c1)C(=O)c1ccc(Br)s1 783079870 LNBPOEHYUPZTEX-UHFFFAOYSA-N 428.260 2.420 10 20 IECD COCc1noc(CN2CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)CC2)n1 783704131 AKTJLHWRJPMPAT-UHFFFAOYSA-N 430.509 2.432 10 20 IECD COCCOc1cccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786259447 QGNAXXCHUIJKED-UHFFFAOYSA-N 425.529 2.239 10 20 IECD CC(C)Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822398 WLJUNCRAUHXJTK-IAGOWNOFSA-N 445.539 2.224 10 20 IECD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n(-c2nc3ccccc3s2)n1 793012095 KRXMZLOBPAUPCV-UHFFFAOYSA-N 437.481 2.499 10 20 IECD C[C@@H]1CCCC[C@H]1CCNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793724957 PQLSBZKOASKVHH-YZGWKJHDSA-N 428.577 2.337 10 20 IECD CNC(=O)c1ccc(CS(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1 797330948 UFASCCOPRWVWJC-UHFFFAOYSA-N 426.498 2.109 10 20 IECD CCN1CCN(C(=O)Cc2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)CC1 799184467 MZCLVXPLDQQJEI-UHFFFAOYSA-N 445.570 2.199 10 20 IECD CN1CCC[C@H](CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448589 CRFPRFDMOTUKGY-INIZCTEOSA-N 438.519 2.173 10 20 IECD COc1ccc(COCCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803685884 NWFMLFJWWRWAEU-UHFFFAOYSA-N 425.529 2.417 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCCC[C@@H]3C(C)C)CC2)cc1 803747857 VGYPOWZGVDYBQR-FGZHOGPDSA-N 430.593 2.264 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3cscn3)CC2)cc1F 804851839 QOCDGIRVBSNOOK-UHFFFAOYSA-N 433.553 2.089 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 805202373 OOSRDDILJGNBSV-GOSISDBHSA-N 428.920 2.252 10 20 IECD C[C@H](c1cccnc1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854380 WLCDJGBERBNAOB-LJQANCHMSA-N 435.572 2.449 10 20 IECD Cc1nccc(CCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 814614970 BWUMFDCGIXQDIC-UHFFFAOYSA-N 435.507 2.290 10 20 IECD O=C(NCc1cccnc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913632527 ALTOCIGQGNPVOD-UHFFFAOYSA-N 428.426 2.426 10 20 IECD O=C(COc1ccc(F)c(Cl)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339265 DHFWRMLLSGFYLH-UHFFFAOYSA-N 426.897 2.409 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4nnc(C(F)F)n4c3)cc2)C1 1332760873 OWRMWJKVEQDQOB-AWEZNQCLSA-N 428.443 2.299 10 20 IECD Cc1noc(C)c1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794147124 PUKLQVGIJOHHCR-GGPHIMKMSA-N 449.511 2.265 10 20 IECD CCc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721164 HGDPBRBUPOPOPF-CQSZACIVSA-N 439.497 2.446 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1[C@@H]2C=CS[C@@H]12 1821706271 BMWKHFBGZOEFTA-NWHUKAGGSA-N 427.486 2.397 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)c[nH]1 1823497804 HRBCXDWKLMSOIS-AWEZNQCLSA-N 446.558 2.212 10 20 IECD O=C(c1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426798 HUDWYIWQOUCCNZ-SFHVURJKSA-N 426.473 2.141 10 20 IECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 726277402 NCUXLHVHJGZKLS-WOJBJXKFSA-N 432.565 2.026 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1 728302618 VUEKTDCCEBCPFG-WOJBJXKFSA-N 427.526 2.186 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)C3CCN(C(=O)c4ccccc4)CC3)nc12 733310075 IYCWQHCKLDKBCC-UHFFFAOYSA-N 437.500 2.348 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CNc3cc(Cl)ccc3OC)nc12 733500267 CZMHLEYCHRVWQW-UHFFFAOYSA-N 434.836 2.429 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)N4C)CC2)cc1 749930594 KUJGYXOFSOGQRG-QGZVFWFLSA-N 437.544 2.024 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(OCCO)c(OC)c3)CC2)cc1F 753930490 OEPQJQJUQQINOQ-UHFFFAOYSA-N 433.480 2.246 10 20 IECD COCc1ccccc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759414255 VXSNOYVADTZWDX-UHFFFAOYSA-N 443.500 2.146 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)CC[C@H]3C)cc2F)C[C@@H](C)O1 763196113 QWIOMKUGVPBAFA-BZUAXINKSA-N 427.542 2.158 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 764256069 YZZMZZDEBDRLMO-UHFFFAOYSA-N 425.485 2.134 10 20 IECD COc1ccc(N2CCN(CCN=c3c(Br)c[nH]cc3[N+](=O)[O-])CC2)cc1 766405675 XGBPGMAEHYSMBT-UHFFFAOYSA-N 436.310 2.417 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)c1 771567318 TYFCMEIHBIIDAW-XMHCIUCPSA-N 427.457 2.054 10 20 IECD O=C(Cn1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1)NC1CCCC1 772456166 AQOBTKMKOJFMJH-FQEVSTJZSA-N 426.517 2.469 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(F)c1I 774363746 LRLBMXPVVVONTQ-UHFFFAOYSA-N 444.200 2.139 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CCN4C(C)=O)CC2)cc1 778220343 UWACDSORUQPFGE-MDZDMXLPSA-N 448.523 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H]3C(=O)OC(C)(C)C)CC2)cc1 778311075 VKJABIVYPBOTMH-DUQGCJEPSA-N 443.544 2.233 10 20 IECD COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781453286 LZEGFPHHPUCAIS-UHFFFAOYSA-N 431.876 2.218 10 20 IECD COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NCc1cccc(OC)c1O 781518933 ZDAOCZZICMRXRL-UHFFFAOYSA-N 437.246 2.205 10 20 IECD Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 781960874 ARXINJOBDFQZHS-UHFFFAOYSA-N 443.523 2.433 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1 785438223 APRBFJLWOWCTHE-UHFFFAOYSA-N 431.496 2.333 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 785557084 ARZGZAJTPPAQCN-HSZRJFAPSA-N 438.572 2.209 10 20 IECD CN(CCNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1 785624131 OLHIDTUGZGUOBC-UHFFFAOYSA-N 449.599 2.087 10 20 IECD Cc1ccc(C(=O)NCCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1F 786662893 MTLBOTKUOBFISB-UHFFFAOYSA-N 442.535 2.483 10 20 IECD O=C(NCc1ccc(CN2CCCC2=O)cc1)C(=O)NCc1ccc(N2CCCC2)cc1 787427214 PPENGSIRGMACEI-UHFFFAOYSA-N 434.540 2.342 10 20 IECD NC(=O)[C@@H]1CCC[C@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 787820723 IHOGWZWQBZDHIG-KGLIPLIRSA-N 434.448 2.235 10 20 IECD COC(=O)c1cnc(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)[nH]1 788504990 JPHDSYIELFUGAL-UHFFFAOYSA-N 448.526 2.226 10 20 IECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789879268 TWCNVGGYTQFBDA-MRXNPFEDSA-N 449.502 2.082 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCCC4(CCCC4)C3)cc2)C1 793727889 WBJZAURXCDITAA-LJQANCHMSA-N 426.561 2.187 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@]1(N(C)C)CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 793809017 DPXNJPZCUFIZNA-IMWIBFENSA-N 430.593 2.327 10 20 IECD COc1ccc(CNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1 796349491 DIPLGCNFMLJVKI-LLVKDONJSA-N 432.420 2.403 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(O[C@@H]2CCN(C)C2=O)cc1C 799254303 SVXIPDUYYVOPDL-OAQYLSRUSA-N 438.528 2.234 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cc(Br)cc(C(N)=O)c2)cc1 799747308 XKIRZAOYLUHTJN-UHFFFAOYSA-N 426.336 2.435 10 20 IECD COCCn1cc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cn1 800074515 NHPBRFMPGKEDFM-UHFFFAOYSA-N 434.408 2.143 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3=CCN(C(=O)OC(C)(C)C)CC3)ccc21 803689261 NZKZPACOSUUZMD-UHFFFAOYSA-N 442.560 2.369 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1 805341685 OWCOAMQZWOFZEN-UHFFFAOYSA-N 447.557 2.233 10 20 IECD C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1nncn1C 805540342 OWOFSXSZMRUWPX-LLVKDONJSA-N 447.429 2.148 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(C(=O)NC2CC2)c1 807385185 DEBQFARRLPMRRL-UHFFFAOYSA-N 432.274 2.302 10 20 IECD CC(C)Oc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccn1 808794144 HCOKQCKDTRYXAT-IBGZPJMESA-N 427.501 2.398 10 20 IECD CC(C)OCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)no1 811973507 XWOIKHFQWIXFNZ-WBVHZDCISA-N 444.536 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(F)c(NC(N)=O)c3)CC2)cc1 817212985 OZYJREOEQMRASX-CMDGGOBGSA-N 441.463 2.168 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 916198971 SRZKSVDHDVBDAU-UHFFFAOYSA-N 438.576 2.134 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918462655 YTEGFPOYWQNPLU-UHFFFAOYSA-N 429.448 2.298 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1324228208 PBRIVNNJNOUABW-HOTGVXAUSA-N 436.505 2.335 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 1342434906 PLAJVRYZNPXLPS-LSDHHAIUSA-N 438.546 2.026 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnoc1)C2)c1cc(O)c(O)c(Cl)c1 1781122893 ZPWXKSJTUGUHQC-OXQOHEQNSA-N 435.864 2.181 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2 1782009502 WGHAQGFVGNYZLP-OAHLLOKOSA-N 425.215 2.026 10 20 IECD Cc1ccsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794630194 CJWQYUNHPODGBW-DZISSUGISA-N 444.509 2.090 10 20 IECD N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccc(Cl)c1 1796600450 JQJRUMIEWZIKFH-RCJHGTSTSA-N 430.892 2.098 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932993 JCWTXGCSJHDBJZ-GGPHIMKMSA-N 448.527 2.000 10 20 IECD O=C(/C=C/c1ccco1)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1807142555 YYSQABZRFKCDOB-SNAWJCMRSA-N 447.582 2.384 10 20 IECD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)n1cccc1C=O 1810543474 DYOLEKYGCBHNBI-INIZCTEOSA-N 440.500 2.213 10 20 IECD Cc1ncc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816728437 PBIFYGJTQDPTCW-LLVKDONJSA-N 445.526 2.183 10 20 IECD O=C(CC[C@@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249735 RYBRBHXFGVXFQU-INIZCTEOSA-N 436.512 2.374 10 20 IECD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251326 ULRHCDNDQJZFKV-HNNXBMFYSA-N 448.520 2.003 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 303782577 DBDFVNJJQLJRIB-UHFFFAOYSA-N 439.516 2.077 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 730292021 YKNBDJSJNDXZQB-CYBMUJFWSA-N 427.523 2.141 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1c1cccs1 745648638 SKERWDHCKLVSEO-LJQANCHMSA-N 432.521 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3COc4cc(OC)ccc4C3)CC2)cc1 747528637 VVXHNBKIEHPNKC-GOSISDBHSA-N 440.496 2.147 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1 747545545 HEYJIYCFNKKHRI-UHFFFAOYSA-N 430.530 2.286 10 20 IECD CCOC(=O)c1c(NC(=O)CN(C)c2ccc3c(c2)OCO3)sc(C(=O)NC)c1C 756644119 GXDWMMNRWRCSRE-UHFFFAOYSA-N 433.486 2.396 10 20 IECD Cc1ccc(NC(=O)COC(=O)c2cccc(O)c2O)cc1S(=O)(=O)N1CCCCC1 758560162 VILDCZKJOOTGJG-UHFFFAOYSA-N 448.497 2.376 10 20 IECD O=C(O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)NCCCSc3nccs3)cc2)C1 761297181 OSLHPDVBUVDTFA-LBPRGKRZSA-N 441.556 2.041 10 20 IECD COc1ncncc1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 761704848 DLUQMLDPWJLRKS-UHFFFAOYSA-N 438.467 2.063 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)S(=O)(=O)C1CCOCC1 764927557 ZOYNNVOCMGURBA-OAGGEKHMSA-N 442.553 2.038 10 20 IECD CS(=O)(=O)CCOc1ccc(Cl)cc1NS(=O)(=O)c1cccc2nonc12 765098778 PZTHEHGKYXHKCF-UHFFFAOYSA-N 431.879 2.100 10 20 IECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NCc1cccc(Br)c1O 765731499 JIYPGVVXYYZRCI-IPYPFGDCSA-N 428.352 2.497 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1 768716591 MEKJBYLHUJRJEK-UHFFFAOYSA-N 440.548 2.043 10 20 IECD CN1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc2C1 769024758 QKSUNVRPZUMOBH-UHFFFAOYSA-N 447.583 2.419 10 20 IECD COCCCOCCN(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 774226325 LCIALMNWBMWFGY-UHFFFAOYSA-N 426.425 2.495 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCOCC4)O3)cc2F)C[C@@H](C)O1 776897173 SSUNPCWXJXFPAZ-SOLBZPMBSA-N 437.512 2.161 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(CCO)C(C)(C)C1 781960411 ICMTUJLZFBPHQY-INIZCTEOSA-N 435.524 2.178 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1 785295079 QQBYWYUDOQKVLC-NSHDSACASA-N 449.389 2.383 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1cnn(-c2ccccc2)c1 786119625 HWKCZDKWFCFKMZ-UHFFFAOYSA-N 447.539 2.026 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 788313327 QVLJAPPSXBKNRK-IBGZPJMESA-N 442.947 2.188 10 20 IECD Cc1occc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951332 VTYMCUAWXXKUKI-UHFFFAOYSA-N 425.407 2.376 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 796732112 KTQWEVYJHRNXCQ-OAHLLOKOSA-N 441.484 2.134 10 20 IECD C[C@@H]1CN(Cc2cccc(CNC(=O)C(=O)NCCCSc3nccs3)c2)CCO1 803131626 RXNDDXIOZBLCSG-MRXNPFEDSA-N 448.614 2.279 10 20 IECD C[C@@H]1CN(Cc2cccc(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)c2)CCO1 803131661 SLGDDWULXMVQSV-QGZVFWFLSA-N 442.535 2.045 10 20 IECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803309528 ZFWOORXHUDLVLS-UXHICEINSA-N 430.593 2.185 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)cc1F 803661852 BRCQLCYPFOORDN-UHFFFAOYSA-N 447.555 2.131 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 806277223 UINGUYYFGUKMEV-DLBZAZTESA-N 435.571 2.093 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCC[C@H](N(C)C)C1 806505799 YNJYHRDHRPZPNA-HOTGVXAUSA-N 426.355 2.492 10 20 IECD O=C(CC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)NC1CCCC1 807292375 PSOHZHLJAOYFDQ-UHFFFAOYSA-N 438.572 2.367 10 20 IECD C[C@@H]1N(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOC1(C)C 807768353 HQHZPSVCFCQEQF-GJZGRUSLSA-N 425.476 2.399 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(C2CCC2)C1 808021487 PEIIWTGORBZQOU-TZIWHRDSSA-N 442.604 2.251 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nccs1 808816891 RUHOEXIQHUHMQY-QGZVFWFLSA-N 441.601 2.211 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)c4nonc34)cc2)C1 814380156 VISPZRZOYYUDMT-CYBMUJFWSA-N 449.920 2.056 10 20 IECD CCN1CCC[C@H]1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913660856 MFBLOAHXLJZMNB-INIZCTEOSA-N 448.501 2.315 10 20 IECD O=C(NCCS(=O)(=O)NCc1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 916645493 ZJPFAQMYDHTEOW-HXUWFJFHSA-N 447.557 2.202 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(N2CCCC2=O)c1 918284399 FFHJRPUIYYHOAG-UHFFFAOYSA-N 440.475 2.044 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(S(C)(=O)=O)ccc3C)CC2)cc1 1319598137 KXCFPFDRIKRBQA-UHFFFAOYSA-N 438.571 2.308 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCCn2cccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997804 DRFAYHJDWHWDRN-FDDCHVKYSA-N 449.511 2.489 10 20 IECD O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2O)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998907 PLSKCDTUYHZFMN-HXOBKFHXSA-N 448.479 2.156 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1)CC2)c1cc(O)nc(O)c1 1816726991 ARHVUGMXYNGEIJ-GFCCVEGCSA-N 426.454 2.195 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@]1(F)Cl)CC2)c1cc(O)nc(O)c1 1816728791 VFPCDSWTRHBSES-MHIIWPAESA-N 426.857 2.100 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncc(Cl)cn2)[nH]n1)c1cc(O)nc(O)c1 1817843826 CGYOGWTUEGAFQZ-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 10907282 JFKTXRMQQQTSAW-UHFFFAOYSA-N 429.542 2.236 10 20 IECD CCOC(=O)C1=S=C(NC(=O)c2ccc(-c3nnc(C)o3)cc2)C(C(=O)OCC)=C1C 468546656 DTBZGMVRYIUNRW-UHFFFAOYSA-N 443.481 2.267 10 20 IECD NC(=O)CN1C(=O)/C(=C/c2cc(Br)c3c(c2)OCCCO3)SC1=S 727176671 XOXQSSQHMHITLT-WDZFZDKYSA-N 429.317 2.297 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)c1 731130772 VYAAKYKIAZKCPG-LBPRGKRZSA-N 426.429 2.487 10 20 IECD Cc1nc(CN2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)oc1C 734270141 PGHSZRRACQLUNO-UHFFFAOYSA-N 445.539 2.419 10 20 IECD C[C@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742242851 OZZCUQPULSHRDQ-WIGAVFHRSA-N 425.529 2.186 10 20 IECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751120475 IFMFFSPNLSOLFM-LJQANCHMSA-N 448.541 2.407 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCCc3ccccc3)CC2)cc(OC)c1OC 760087409 ZBGWBCYKSIARSS-UHFFFAOYSA-N 441.528 2.110 10 20 IECD CC(C)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1CCCS1(=O)=O 761984464 ZATTUELSDHZNMJ-PKOBYXMFSA-N 443.997 2.186 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 763640216 FCKLJTUZXYRQKJ-MRXNPFEDSA-N 449.495 2.261 10 20 IECD CCC(=O)N1CCC[C@@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771068482 QNDVSRSDRJKJOP-QGZVFWFLSA-N 441.532 2.086 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](C4CCOCC4)C3)CC2)cc1 778396259 XQYZTZRXJNZGST-HCZHMGAMSA-N 427.545 2.175 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(c4cc(C)[nH]n4)CC3)cc2F)CC1 784130877 PVELENSEIXMSMA-UHFFFAOYSA-N 443.571 2.467 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1 784558914 OTNAXUHFVPZEEG-UHFFFAOYSA-N 429.517 2.469 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 784560911 ZJJIAEVGTYACOG-UHFFFAOYSA-N 427.501 2.032 10 20 IECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1 785606291 RWRDEFRNIHQUNZ-NRFANRHFSA-N 433.487 2.457 10 20 IECD COC(=O)CCc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786119106 QFDLBZFUOSAGEA-UHFFFAOYSA-N 429.492 2.496 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3nnc(-c4ccccc4)n3C)cc2)CC1 786659105 INGOOZCXEBYKLP-UHFFFAOYSA-N 432.528 2.010 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(CN4CCN(C)CC4)cc3)cc2)CC1 787320030 QQDGSKAMJQLJNM-UHFFFAOYSA-N 449.599 2.033 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCCC[C@H]1N1CCOCC1 806090257 IJSNJBOSZMGJRA-XZOQPEGZSA-N 442.604 2.395 10 20 IECD O=C(N[C@H]1CCCc2c[nH]nc21)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806427600 LJBAJFKRQIPXEH-PBHICJAKSA-N 433.459 2.290 10 20 IECD CCOc1ccc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 807290489 WTSZXKUEDGFSGJ-UHFFFAOYSA-N 448.567 2.422 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1)c1ccc(N(C)C)cc1 807674541 MQYMVXQBQYEXGE-INIZCTEOSA-N 442.947 2.454 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(S(=O)(=O)NC(C)C)cc3)CC2)cc1 914612483 JRWMSVUOGSOUEK-UHFFFAOYSA-N 446.573 2.143 10 20 IECD CCN1C[C@@H](C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914910189 AVVOERGRSGCLBX-KGLIPLIRSA-N 434.448 2.201 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)C(=O)c3ccc(Br)o3)CC2)cc1 917388231 NVWLIZHQNIUOQG-UHFFFAOYSA-N 436.306 2.472 10 20 IECD CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919968277 JJCJVFLGFMJCTF-UHFFFAOYSA-N 425.529 2.340 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1)c1ccc(N2CCOCC2)cc1 920926478 PVIVKWGOJQFEJC-INIZCTEOSA-N 438.484 2.296 10 20 IECD Cc1ccsc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785508637 IIVGRFUTZAQIAG-WTCGPSRQSA-N 444.509 2.330 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1F)C2)c1cc(O)c(O)c(Cl)c1 1799770888 SPMAWIKWFXUKSO-YVWYUNDQSA-N 448.878 2.336 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@H]21)C1=NN(c2ccccc2)C(=O)C1 1801321388 YWZNDUDMUKLKKK-VTYLBBACSA-N 436.537 2.293 10 20 IECD Cc1ncsc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805750355 DEOWUXQMTWJMBC-KDOFPFPSSA-N 439.497 2.286 10 20 IECD Cc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1807992736 ACFOWDGLPALROH-UZUQRXQVSA-N 447.495 2.154 10 20 IECD O=C(/C=C/c1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721423 KMIUVHSFGLXCCN-FNVMNULWSA-N 426.454 2.482 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)[C@@H]1C=CCN1 1817985849 BBZZYUKDTJRICS-ZFWWWQNUSA-N 431.880 2.308 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428805 KEEMXRUBRIGFIG-QGZVFWFLSA-N 447.532 2.315 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3cccs3)CC2)CC1 1837397295 NQVDDFPMFJDGCD-UHFFFAOYSA-N 431.514 2.480 10 20 IECD Nc1ccccc1/C=C/C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441747 CQYLDJZAGQXYBH-VAWYXSNFSA-N 443.507 2.278 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)C1 1845311476 OQQVTPSNRIUJRO-UHFFFAOYSA-N 447.831 2.496 10 20 IECD COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)C1 1847561735 JMLZXICJTWYPHY-APYUEPQZSA-N 436.892 2.156 10 20 IECD CCN1CCN(c2ccc(CNc3cc([N+](=O)[O-])cc(S(N)(=O)=O)c3)cc2F)CC1 301214538 ZEENECYMWBEQAX-UHFFFAOYSA-N 437.497 2.135 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)cc1 734844073 TUHVYZZOJALKCU-ZEQRLZLVSA-N 443.613 2.301 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(C4CC4)nc3)cc2F)C[C@@H](C)O1 737108443 WMGIGKVNCIWSGW-OKILXGFUSA-N 427.480 2.362 10 20 IECD CCOc1ccc(N(C)CC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)cc1 739922228 CURCHRPWSLRZJB-UHFFFAOYSA-N 447.557 2.490 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(O[C@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 748833293 RUQRHGWOBVLFAT-OPYAIIAOSA-N 449.567 2.325 10 20 IECD COC(=O)COc1ccc(N(C)Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)cc1 753590894 DZYQYTSRTSPCDQ-OAHLLOKOSA-N 441.937 2.393 10 20 IECD COC(=O)c1ccc(CN(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 754059813 IHLDPPAAMYRVHE-QFIPXVFZSA-N 427.545 2.097 10 20 IECD COC(=O)c1cn(C2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)nn1 759246035 JDCAZIDPGGMEID-MRXNPFEDSA-N 442.520 2.009 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 769024799 RCBYRFOXXBDXJP-UHFFFAOYSA-N 437.500 2.382 10 20 IECD COc1cccc([C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2nccn2C)c1 769636758 IILAEOXQCDIETJ-SFHVURJKSA-N 430.486 2.025 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1cccc(S(=O)(=O)N2CCCC2)c1 772776766 RWUFNOOWYSDVMF-CLFYSBASSA-N 446.481 2.077 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ncc1Br 772955151 QERUCOUOLQRBJK-UHFFFAOYSA-N 433.306 2.244 10 20 IECD CC(C)Oc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1 773230719 CMAJEFZCSZZFOD-UHFFFAOYSA-N 428.488 2.344 10 20 IECD CC(C)(C)[C@@H]1NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777616610 SFQQRXSKKVICNF-GOSISDBHSA-N 426.496 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nnc(C(F)(F)F)s3)CC2)cc1 778243530 JIKCQLLVDGMJIB-VOTSOKGWSA-N 441.435 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3c3ncon3)CC2)cc1 778287351 ODXMOFVYEXHSBU-JBVUFVISSA-N 425.489 2.037 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 778423159 MMUHNZDUMXKABZ-IPYQYMIDSA-N 449.551 2.370 10 20 IECD O=C(CN1CCOC[C@@H]1[C@H]1CCCC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 784355745 HTWZOBGNZGITGK-YLJYHZDGSA-N 432.476 2.471 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OC(F)F 785507225 VBEOZLCSPJXMBB-UHFFFAOYSA-N 449.454 2.066 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@@H](C)c3ccco3)CC2)cc1 785529043 UQCGOWMDPFIMEP-SFHVURJKSA-N 428.533 2.136 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1F 785602064 XBDDBQYTNNAKIV-LJQANCHMSA-N 427.455 2.286 10 20 IECD COc1cn(-c2ccccc2)nc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786258721 GSIQEHWBUGXNCP-UHFFFAOYSA-N 433.512 2.479 10 20 IECD CCc1noc(CC)c1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789823108 CUTZJAWOOGDERB-GJZGRUSLSA-N 446.523 2.485 10 20 IECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859212 AJBXFCGNIPVXSH-HXUWFJFHSA-N 425.558 2.148 10 20 IECD C[C@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCCC1 790183087 FAWKJKGPVHYBPQ-MRXNPFEDSA-N 438.519 2.221 10 20 IECD CN(CCNC(=O)NCc1ccc(N2CC=CC2)cc1)S(=O)(=O)c1ccc(F)cc1 798067583 KNDHJODSZZXRRE-UHFFFAOYSA-N 432.521 2.322 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 803309251 SMWHFDANLSJLNZ-KRWDZBQOSA-N 426.517 2.201 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc1 806087357 DUFPUGMYOPAVCK-VXKWHMMOSA-N 430.593 2.251 10 20 IECD CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(=O)NCCCSc1nccs1 806276976 YJDNVOAYAXXFAC-UHFFFAOYSA-N 447.630 2.022 10 20 IECD COC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 808787780 AAWKKGZAPQMHTK-NRFANRHFSA-N 447.482 2.264 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccc1-n1cnnn1 916457863 POJRENMOUBQODI-UHFFFAOYSA-N 432.406 2.448 10 20 IECD COCCn1c(-c2cc(O)c(O)c(OC)c2)nc2c1c(O)nc(=O)n2Cc1ccccc1 916857037 UPWRGYJYKVWLMG-UHFFFAOYSA-N 438.440 2.080 10 20 IECD CC(C)N(CC(=O)N1CCc2cc(S(N)(=O)=O)ccc21)Cc1ccc(N(C)C)cc1 917417945 OOZZZOFRLIIGFB-UHFFFAOYSA-N 430.574 2.200 10 20 IECD Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917836646 RCVKHINGBNHEBU-IBGZPJMESA-N 448.571 2.454 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3n[nH]c4c3CCC4)cc2F)C[C@@H](C)O1 919330527 HZEFHWDMFZBACK-OKILXGFUSA-N 430.480 2.124 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc(OCC)cc4)CC3)nc12 1319515725 NLTUIPLQMWOJGV-UHFFFAOYSA-N 425.489 2.333 10 20 IECD Cc1nc2ccc(S(=O)(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2o1 1320647252 QGSKOEIXUFPNKJ-INIZCTEOSA-N 428.514 2.316 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)no1 1804285590 ACWKWHNSSSJBRR-RRJKNOHSSA-N 427.457 2.319 10 20 IECD Cc1ncsc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805750359 DEOWUXQMTWJMBC-RDTXWAMCSA-N 439.497 2.286 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc(Cl)ncn1 1819978969 IYNYQCHPJSPJGM-CYBMUJFWSA-N 443.851 2.279 10 20 IECD C[C@](O)(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1827424464 XVTLNSPXBZWOAU-KUHUBIRLSA-N 445.438 2.039 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCCn2cccc2)C1 1846635041 JUHYVADFWHQCJM-VQHVLOKHSA-N 425.485 2.302 10 20 IECD COCCOc1ccc(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 727612955 NJOPXMHUUKTWCD-UHFFFAOYSA-N 445.491 2.285 10 20 IECD COc1cccc(CNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1O 727762486 LMLOKUWNFFCWDL-CQSZACIVSA-N 430.457 2.096 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)c(OC)c3OC)CC2)cc1 727948196 WCPPENXNBGGWGZ-UHFFFAOYSA-N 443.500 2.398 10 20 IECD CC(C)NC(=O)CCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729525093 BCBGFZQYEGEQDM-UHFFFAOYSA-N 442.539 2.253 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)cc2F)CC1 730194258 DBXRLZBRKWETMG-UHFFFAOYSA-N 432.500 2.396 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O 745833129 VVDRCPARXJRQBU-OAHLLOKOSA-N 436.310 2.225 10 20 IECD COC(=O)c1c(F)ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1F 749170499 LGKHLEUTRZZVLJ-UHFFFAOYSA-N 444.431 2.206 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 749340195 KOLPLDIXUFJALN-LJQANCHMSA-N 445.585 2.476 10 20 IECD CCN(CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)C1CC1 750830206 ZDPBRRAULRJWCW-LICLKQGHSA-N 433.555 2.217 10 20 IECD Cc1cc(C(=O)COC(=O)CCn2cccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750941121 UDBXTPNWIQDEOO-UHFFFAOYSA-N 429.498 2.359 10 20 IECD Cn1cc(Br)cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1=O 754923994 UUZHXKSOVULIEX-UHFFFAOYSA-N 433.306 2.003 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN1CCCc2cc(OC(F)F)ccc21 759695342 YXSQPKKYJGECAS-UHFFFAOYSA-N 441.456 2.335 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 759982844 HWYYEJPOEVQHAE-LJQANCHMSA-N 432.542 2.441 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 768656396 QZHFKWZCZRDNSG-VEJIKLGOSA-N 427.545 2.221 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)NC1CCCCC1 774472141 XCUXDAUKIQHULS-UHFFFAOYSA-N 440.523 2.007 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCN3C(=O)OC(C)(C)C)CC2)cc1 778402164 LBXRPDGLVDAYQH-ZHACJKMWSA-N 444.532 2.284 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(-n2cncn2)nc1 785195200 MAWQHUJBTBCKCH-UHFFFAOYSA-N 445.277 2.118 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)CC1 786120824 USQAXPQPTRJEMK-UHFFFAOYSA-N 432.502 2.050 10 20 IECD CCOC(=O)[C@H](CC)N(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787678197 CPBQXUREZSSGKK-SQZREULQSA-N 443.544 2.233 10 20 IECD C[C@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nccs1 789841204 UEUXTCVADRVVEK-CQSZACIVSA-N 434.537 2.122 10 20 IECD C[C@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)(N(C)C)C1 789862455 TWFCESNHYFAKFJ-FDDCHVKYSA-N 432.634 2.483 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Cl)cc(C(=O)N(C)C)c1OC 790067596 HLLCDWYMNGDPAC-UHFFFAOYSA-N 442.877 2.343 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCN2CCCC[C@H]12 790293088 SVCNVBMDBRJUGA-RBUKOAKNSA-N 436.503 2.116 10 20 IECD O=C(NCc1cccc(Cn2cccn2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793810122 JFCPHOPCIWAXDC-JOCHJYFZSA-N 448.523 2.461 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)c1 797735196 YDPCXDKYTVQQRV-UHFFFAOYSA-N 441.893 2.415 10 20 IECD CO[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771789 PKDLLJBICYBMQC-MCMMXHMISA-N 447.447 2.453 10 20 IECD C[C@H](NC(=O)C(=O)NCCN1c2ccccc2C[C@H]1C)c1ccc(N2CCOCC2)cc1 803312279 WPYHXQBCVMQXRN-MOPGFXCFSA-N 436.556 2.268 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCN(c2ccccc2F)C1 810172562 JZBKOTSLMKQETQ-GOSISDBHSA-N 431.533 2.203 10 20 IECD COc1ccc(C[C@](C)(O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 811868154 XUCLFLZNVFIPMJ-DEOSSOPVSA-N 443.544 2.333 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)cc2N1 814620709 CHPAAUUMUSHMNX-UHFFFAOYSA-N 433.512 2.153 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1 819329666 ZEISQWWRVMVYSC-UHFFFAOYSA-N 446.934 2.011 10 20 IECD COc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2C)cc1 917833528 ABSUTXRAXVFVFY-SFHVURJKSA-N 448.527 2.216 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1Cl 918295705 STBNNKOPXTZVIU-OAHLLOKOSA-N 431.876 2.291 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921089302 QEYGJNLTUDFDDG-UHFFFAOYSA-N 436.603 2.481 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1 1782740233 JPBSVDUEURVLPC-SQIUQIIDSA-N 436.917 2.070 10 20 IECD C[C@H]1C[C@@]1(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221481 ABXOWNZMSGWYIU-WYIYNHIUSA-N 444.528 2.377 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCS3)C2)C1 1784796220 IAMBDDWDZYJCHF-BEFAXECRSA-N 426.922 2.090 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1CCCCO1)C1=NN(c2ccccc2)C(=O)C1 1794020852 BOESQQAMYGBDGC-RNQOJCNYSA-N 438.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cn2ncccc2n1 1800718352 VMYSLJPUWIYKPS-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnn2c1 1801042934 YZBHJDGFRNQZSL-DVMWBXJWSA-N 448.479 2.416 10 20 IECD CCc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807991007 MIGQMCKAIZUXRM-ZHRRBRCNSA-N 447.495 2.479 10 20 IECD CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294784 QSHWOASVQKQFSZ-MEBBXXQBSA-N 449.895 2.305 10 20 IECD O=C(c1ccncc1O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428497 RKEUPHZGEONCHJ-KRWDZBQOSA-N 426.473 2.141 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)n(C)c2ccccc12 472811835 PIBLWBVLHXEPAG-UHFFFAOYSA-N 434.496 2.214 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1 728943690 BNDDRGDUKIYEDP-GFCCVEGCSA-N 427.910 2.393 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(CCN2CCOCC2)CC1 729598134 XREMFVRSPSWQCN-UHFFFAOYSA-N 448.583 2.431 10 20 IECD CC(C)(CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NC(=O)OC(C)(C)C 739701006 VWBBFHAUKVATFG-UHFFFAOYSA-N 439.578 2.231 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](c1ccccc1F)N1CCOCC1 742556840 LNDMCSAOPYOWSJ-JOCHJYFZSA-N 431.483 2.491 10 20 IECD COC(=O)CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CCOCC1 744425419 HBRPCOZCZNNCRM-UHFFFAOYSA-N 436.464 2.055 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 747394802 UJUNPYCUOPLGNH-RDPSFJRHSA-N 440.588 2.499 10 20 IECD O=c1ccc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2o1 751235881 FBBLVYYXSKIGTE-UHFFFAOYSA-N 428.510 2.480 10 20 IECD COC(=O)/C=C1\SCC(=O)N1CCCOC(=O)c1csc(Cc2ccc(N)cc2)n1 751929983 FFDSZLXFNZPGJA-ZDLGFXPLSA-N 447.538 2.453 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1 753668227 GOODKIXLJXTFLI-SFHVURJKSA-N 434.562 2.339 10 20 IECD O=C(CNc1ccn(-c2ncccc2F)n1)NCc1ccc(N2CCOCC2)c(F)c1 759123548 JFNWPVMBISIXQP-UHFFFAOYSA-N 428.443 2.110 10 20 IECD COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765078843 GCHKDMJSUXZTHP-INIZCTEOSA-N 444.469 2.191 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 773744182 OVISEBHTQVUOIG-CQSZACIVSA-N 436.505 2.385 10 20 IECD CCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 776896725 OVOONCQJRIQYOC-UHFFFAOYSA-N 435.521 2.455 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 778423161 MMUHNZDUMXKABZ-LCJITAHGSA-N 449.551 2.370 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(CCCN4CCOCC4)CC3)CC2)cc1 780331024 MFBKSYVPGZTDEN-UHFFFAOYSA-N 444.620 2.168 10 20 IECD C[C@H]1CN(CC(C)(C)O)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781941905 WQITYIIYUOMYQY-INIZCTEOSA-N 435.524 2.178 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)cc2)CC1 786656234 MIHFTIJQAURKBQ-FQEVSTJZSA-N 430.549 2.371 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCOc1ccccc1Cl 786877706 STXRCPXKTURWRE-UHFFFAOYSA-N 431.920 2.330 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccccc1N1CCCC1 789798065 FYYGIMIZGWYQPW-UHFFFAOYSA-N 440.519 2.195 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC(C)(C)O1 789948504 BKERCHGKUMMRNZ-AWEZNQCLSA-N 443.466 2.184 10 20 IECD COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3ccc(N4CCOCC4)cc3)C2)c1 792080959 GYQHNAFAZVACQF-QFIPXVFZSA-N 425.485 2.350 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NOCc3ccccc3OC)CC2)cc1 799095474 AEZUJLIXMWTALF-VAWYXSNFSA-N 425.485 2.157 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 806276378 NWAHTJWCAUNSBE-MRXNPFEDSA-N 427.592 2.318 10 20 IECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2cc(Br)ccc2O)CC1 807386651 DDPFGISHAMRWJO-UHFFFAOYSA-N 447.333 2.161 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1)N1CCC[C@H]1CO 864044735 JPCFVPQKYBDUSC-NRFANRHFSA-N 431.558 2.281 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917912369 PQEBOINMBNRUTO-UHFFFAOYSA-N 436.555 2.270 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(F)cc1F 920925353 JWYYNQPJOQCKKV-ZDUSSCGKSA-N 447.438 2.404 10 20 IECD C[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)NCC(F)(F)F 1251133543 DZXRVGHUGYODIC-SECBINFHSA-N 449.341 2.167 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1csc(-c2cccnc2)n1 1254762011 WPOQUZMGBDOIRD-INIZCTEOSA-N 427.482 2.449 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1 1799680503 YGGYFINDJOLIEA-QDMKHBRRSA-N 437.974 2.452 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1808000164 XMKCGWKUZMFETD-ZHRRBRCNSA-N 436.468 2.352 10 20 IECD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c(C)n1C 1816726994 ASQAFOCXNLVVBU-CYBMUJFWSA-N 441.513 2.444 10 20 IECD CO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717573 NHAYURQYPNCLLL-UWJYYQICSA-N 440.544 2.434 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCO1)CC2 1828197562 BBELVPQQXOEAJX-VQGGLNJCSA-N 445.497 2.064 10 20 IECD Cc1nc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(C)s1 1842106637 UDOKUARYHPWCHA-FNORWQNLSA-N 443.525 2.336 10 20 IECD O=C(c1cccc2[nH]ncc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039145 TYZNIHSBWIQUHA-SOFGYWHQSA-N 434.452 2.210 10 20 IECD COC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)N(C)C(=O)N[C@@H]1c1ccccc1 727004115 OJCXCXOQUZQEQU-QGZVFWFLSA-N 426.425 2.386 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCN([C@H]2CCC[C@H]2O)CC1 728751913 WZACKEYPTYSVPQ-VQTJNVASSA-N 438.519 2.497 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCCC[C@H]3C3OCCO3)CC2)cc1 732443665 KACCSCHWLXVMNY-NRFANRHFSA-N 432.565 2.144 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 733131737 HIIXRVVPJVCKPX-TZIWHRDSSA-N 430.618 2.189 10 20 IECD CN(CCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)OC(C)(C)C 742346147 HQPVRBPSDHMJID-UHFFFAOYSA-N 439.578 2.185 10 20 IECD Cc1nn(C)c(C)c1C[C@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 745274911 HBHFVNDUDLDIRU-HNNXBMFYSA-N 446.523 2.051 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3cccc(OCC(N)=O)c3)cc2F)C[C@H](C)O1 745649854 ZRCNFFNVKWEWIL-HOTGVXAUSA-N 444.507 2.303 10 20 IECD Cc1ccc([C@H](C)[C@H](O)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 745759509 TZBLYQIFHQANBM-SBUREZEXSA-N 444.503 2.295 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)CS(C)(=O)=O)c2C)cc1 747074605 HMLCGNOIDJDZEA-CYBMUJFWSA-N 435.498 2.287 10 20 IECD C[C@H](OC(=O)c1ccc(C(N)=O)o1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747179896 WUZOETTZPVUXGR-NSHDSACASA-N 432.388 2.338 10 20 IECD O=C(CSCC(=O)c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 748560178 HSFJYOGJATYTHY-UHFFFAOYSA-N 432.567 2.154 10 20 IECD COc1ccc(N2CCN(C(=O)c3nn(-c4ccc(F)cc4)ccc3=O)CC2)cc1F 753740927 ZCJPTEDVUQIEJM-UHFFFAOYSA-N 426.423 2.482 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(CCc4cccs4)CC3)CC2)cc1 754016305 BCYACAZSVWBTNV-QFIPXVFZSA-N 444.645 2.100 10 20 IECD Cc1ccnc2nc(C(=O)OCC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)nn12 756282753 VRCMAAOBGOQVKK-UHFFFAOYSA-N 441.403 2.004 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@H](C)C[C@@H](C)C4)C3=O)CC2)cc1F 757053902 SCUAHYWBTPVGII-HZPDHXFCSA-N 446.523 2.230 10 20 IECD Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 765170370 NTLSKBRFGMFXLK-KRWDZBQOSA-N 446.529 2.392 10 20 IECD C/C=C\C[C@H](CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770349125 HWKHYGQTMFNIAT-LHRDXKRPSA-N 428.512 2.069 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)c1 772725647 YWYMSBYIEPYEBE-CQSZACIVSA-N 440.543 2.225 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN([C@H]2CCOC2)CC1 773480420 CGGACDJLQDGETM-IRXDYDNUSA-N 433.508 2.196 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](O)(c4ccc(F)cc4)C3)cc2)C1 777720088 DQAYCFLPFFQSRM-KOSHJBKYSA-N 440.519 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3CCCCCC3)CC2)cc1 778221436 MPCGFXKYKVBUHE-VAWYXSNFSA-N 428.577 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)cc1 778394766 BTNMJCMUTWTXTC-HRBBJJPOSA-N 434.540 2.203 10 20 IECD COc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1OC 787021345 YAVZBOWNTCJABG-GOSISDBHSA-N 428.485 2.233 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc(N2CCOCC2)cc1 787297742 KJYWJEMQCRYMPN-IBGZPJMESA-N 447.539 2.262 10 20 IECD CC(C)c1nc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 789801363 RUQJPXOMFUBIOA-UHFFFAOYSA-N 434.537 2.217 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCC4)C3)cc2F)C[C@H](C)O1 789815862 BAIVDZSPISUYMW-IRXDYDNUSA-N 433.524 2.085 10 20 IECD CC[C@@]1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789950810 QSSCPOSBHQOKPX-FQEVSTJZSA-N 443.466 2.186 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H](C)c1ccccc1 793716420 BKGLXFKGRVCJDV-LVCYWYKZSA-N 436.556 2.313 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC3CCN(c4nccs4)CC3)CC2)cc1 803174362 JTEDMQQXZHWLQV-UHFFFAOYSA-N 443.573 2.022 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CN4CCC[C@H]4CO3)cc2Cl)C1 804059414 ZXJVVPLQISKKOT-NZSAHSFTSA-N 448.995 2.172 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)Oc3ccccc3OC)CC2)cc1 804315159 GDURDUWBAUGGFB-KRWDZBQOSA-N 441.528 2.373 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3cc(S(=O)(=O)N4CCCC4)ccn3)cc2)CC1 804644822 OSCVVTUADBASDZ-UHFFFAOYSA-N 443.573 2.147 10 20 IECD CC(C)(C)OC(=O)NC1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806282632 OPSPFQDGPYZIFA-UHFFFAOYSA-N 428.580 2.257 10 20 IECD COc1ccc(C)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807099185 NEIQWDVQAYSVID-UHFFFAOYSA-N 438.572 2.339 10 20 IECD CCCCN(CCO)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 914534993 WUPQUWAFBKGCKG-UHFFFAOYSA-N 437.474 2.336 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3ccccc3F)CC2)cc1 916196829 QCAWDNFJSNNCRY-JOCHJYFZSA-N 430.524 2.379 10 20 IECD Cc1cc(CN2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)no1 918219027 BWZWZPYFACIWED-UHFFFAOYSA-N 431.512 2.111 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 918303839 LDCVETWPAOMHBO-UHFFFAOYSA-N 436.512 2.389 10 20 IECD Cc1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1S(N)(=O)=O 920213560 GPADMTGXQIQZHN-UHFFFAOYSA-N 428.558 2.427 10 20 IECD Cn1cc(N2CC[C@H](NC(=O)c3ccc4c(c3[N+](=O)[O-])C(=O)c3ccccc3C4=O)C2)cn1 1322958528 WNYKNQUSUYDJHH-ZDUSSCGKSA-N 445.435 2.112 10 20 IECD CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(C)(C)O 1347484423 KSQJYHBXOMFEBX-LJQANCHMSA-N 435.565 2.176 10 20 IECD Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815942699 DXSPYEPPZFEHCG-SECBINFHSA-N 448.892 2.174 10 20 IECD CC(=O)O[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C(C)C 1819248501 KQVRYTOGBOBBCJ-KXBFYZLASA-N 445.476 2.110 10 20 IECD Cc1cc(C)n(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1846537765 FRRZKBKOTLXZEU-UHFFFAOYSA-N 432.908 2.472 10 20 IECD COc1ccc([C@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)cc1 1847396180 UKEYWWOJINPZQO-LNLFQRSKSA-N 446.887 2.309 10 20 IECD CN(C)c1ccc(CNC(=O)CSc2nnc(-c3cccs3)n2CCC(N)=O)cc1 28948310 FELWSZJSBZEALN-UHFFFAOYSA-N 444.586 2.357 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 303781720 CYOMMJUUHATSFJ-UHFFFAOYSA-N 440.435 2.206 10 20 IECD CC(C)C(=O)N1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 727930934 BZSPQBOWPYIOOB-RTBURBONSA-N 448.583 2.246 10 20 IECD CCN1C(=O)C(=CNc2ccccc2C(=O)NCC(F)(F)F)C(=O)N(CC)C1=S 730998258 QQNRLNULBQSGAN-UHFFFAOYSA-N 428.436 2.270 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 739923053 DBPLUMCWXYUHDB-UHFFFAOYSA-N 435.521 2.194 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1 740813172 WITWNCYOCWKAEK-UHFFFAOYSA-N 437.543 2.315 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)cc2F)CC1 746229197 MFZOAEYDGFMEBT-RUZDIDTESA-N 440.563 2.221 10 20 IECD CCCN1CCC[C@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749576509 IYSDNYYHGDJXQG-NRFANRHFSA-N 426.540 2.433 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc([S@](C)=O)cc3)CC2)cc1 754050940 NMNHLIYJIJSRRP-DFXYEROKSA-N 431.602 2.048 10 20 IECD Nc1ccc(S(=O)(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 758450039 RCVSGIRZTASMDJ-UHFFFAOYSA-N 442.520 2.003 10 20 IECD COc1cc(N2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)CC2)cc(OC)c1OC 759238681 OQAFQLLQGPAIGC-UHFFFAOYSA-N 445.428 2.312 10 20 IECD COc1ccc2c(c1)OC[C@H]2CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 760382736 REELDFAIDJASQB-QGZVFWFLSA-N 430.526 2.113 10 20 IECD CN1CCN(c2ncc(CN[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2)CC1 761969561 ITFJUAGOHPQBEM-FQEVSTJZSA-N 430.984 2.342 10 20 IECD CC1(C)C(=O)Nc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc21 768957805 JTGOESAFMHZHNV-UHFFFAOYSA-N 427.526 2.081 10 20 IECD O=C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]2CCCC[C@@H]2N1 769984454 UNOCPPPZVQQYBI-LSDHHAIUSA-N 435.527 2.138 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1Cl 771217156 XLOMYSMWNCJRNR-LLVKDONJSA-N 436.848 2.422 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3cccs3)N(C)C)CC2)cc1 774856388 MLDNANBIIWWBRQ-IBGZPJMESA-N 430.574 2.215 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(S(C)(=O)=O)sc1Cl 775286429 IVPGJORCRWBSMH-UHFFFAOYSA-N 425.893 2.098 10 20 IECD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785298032 UJRFAMFXMQAZIG-AWEZNQCLSA-N 441.484 2.028 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(OC)c1 785495464 QLYIBROCTQEJRQ-UHFFFAOYSA-N 448.541 2.169 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1 785575785 XAJVQZAAQJZOGJ-QHCPKHFHSA-N 438.572 2.339 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccnc2OCC(F)(F)F)cc1F 787278669 ADFIYMAPVUCFME-UHFFFAOYSA-N 428.386 2.160 10 20 IECD CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 788564914 YVQVEHXWTGXECL-OALUTQOASA-N 447.580 2.388 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789817809 ISIJEUOCCHWQBA-CALCHBBNSA-N 435.540 2.067 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCCC4)C3)cc2F)C[C@@H](C)O1 789827454 SULSSCVUMRFWKQ-HDICACEKSA-N 447.551 2.475 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](OCC4CC4)C3)cc2F)C[C@@H](C)O1 789837553 ZMKVXEQJKGXIEM-MBOZVWFJSA-N 447.551 2.473 10 20 IECD COC(=O)c1cnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c([N+](=O)[O-])c1 790772571 XKASTVORZMYLJL-UHFFFAOYSA-N 432.433 2.129 10 20 IECD C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793727897 WCXQLZCIIZEXKX-WQZMEWCLSA-N 426.561 2.184 10 20 IECD COc1ccc(C2(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CCOCC2)cc1 793939160 XDCVSRTZCNMYDR-UHFFFAOYSA-N 443.519 2.381 10 20 IECD COCCn1c([C@@H]2CCS(=O)(=O)C2)nnc1N(C)Cc1ccc(N2CCCCC2)cc1 802508152 XPGPJSNOUWZLHF-LJQANCHMSA-N 447.605 2.453 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC4(CCOCC4)CC3)CC2)cc1 803673766 FDOLFLZRPZZJSL-VOTSOKGWSA-N 427.545 2.319 10 20 IECD CNC(=O)c1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 805025708 WQUMXKQUOJNONR-UHFFFAOYSA-N 436.556 2.258 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1COC2(CCCC2)O1 806691419 BFSDTPNDFSDVAP-OAHLLOKOSA-N 441.322 2.305 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCO1 807768795 BPQDAOMUPPKSGL-JLSDUUJJSA-N 425.476 2.447 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C(=O)N(C)C)CC2)c([N+](=O)[O-])c1Br 915210980 JMSIQJUGAPSBKM-UHFFFAOYSA-N 432.231 2.078 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(CC(F)(F)F)CC3)cc2F)C[C@@H](C)O1 916974679 IPSREJQHWQJCBY-IYBDPMFKSA-N 446.489 2.235 10 20 IECD Cc1nn(C)c(C)c1CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919025064 VTFNKLXWJCANPD-GASCZTMLSA-N 446.523 2.192 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1 1781531097 LNOQSTQEAPDPPZ-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cnccc1F)CCO2 1782000820 BYRHCIYQXAIHBS-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C(F)(F)Cl)[C@@H]1c1cccnc1 1813211258 HMXSCGHVIAXTOU-ABAIWWIYSA-N 426.807 2.039 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825651135 OAXFEBVJEPDTHA-INIZCTEOSA-N 445.495 2.465 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1 1827428749 HNCRFWRARTWDPQ-BHIYHBOVSA-N 431.533 2.277 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)CC1 1828688737 QJDCUIABYBPEAL-IBGZPJMESA-N 439.516 2.183 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1844939379 AJRDGDMSXNIJKZ-UHFFFAOYSA-N 432.480 2.305 10 20 IECD CC(=O)Nc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)ccn1 1845501408 MFADKILCATZHFH-UHFFFAOYSA-N 444.875 2.235 10 20 IECD CCN(CC(=O)NCc1ccc(F)cc1)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 23814983 DLYLQJDZSCDZKD-UHFFFAOYSA-N 442.535 2.121 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3nc(-c4ccccc4)n[nH]3)cc2)C1 729814795 UUGFADFMIMVZRP-SFHVURJKSA-N 433.516 2.173 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccc([N+](=O)[O-])cc3)cc2)C1 731686582 DGPKAHAYCBQXSS-KRWDZBQOSA-N 441.488 2.175 10 20 IECD C[C@@H](NC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1)c1ccc(N2CCOCC2)cc1 733632126 URHLVQMRQASRBH-MRXNPFEDSA-N 439.516 2.011 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@](C)(O)c3ccccc3)CC2)cc1 734064933 PCUAWTUWGBGYRH-DEOSSOPVSA-N 426.561 2.414 10 20 IECD COc1cc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1O 734217000 QQAVCNLSPNIGJU-SFHVURJKSA-N 426.517 2.144 10 20 IECD COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 740491654 NKYDOBDMRGVSCY-UHFFFAOYSA-N 449.529 2.075 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1 742279497 VUGPCCIDVMEAHJ-UHFFFAOYSA-N 427.530 2.485 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1 744380834 YGMXFRXPPAQJDP-UHFFFAOYSA-N 426.336 2.110 10 20 IECD CO[C@H](C)c1noc(CN2CCCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)n1 750639704 UTFUOTYIWLWELH-OAHLLOKOSA-N 434.516 2.400 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c(C(=O)OC)s1 751106954 COVLRORZBALTME-UHFFFAOYSA-N 426.516 2.174 10 20 IECD COC(=O)c1cn(C2CCN(Cc3cc(Br)cc(OC)c3O)CC2)nn1 761220020 RYJWIMSUSVFYQB-UHFFFAOYSA-N 425.283 2.379 10 20 IECD CS(=O)(=O)C[C@@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 774176122 ADNNLYNPLKFMLF-JOCHJYFZSA-N 445.585 2.480 10 20 IECD C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)C[C@@H](C)O1 774362877 GPZQPRNBQXKDJX-IYBDPMFKSA-N 427.501 2.004 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 776904863 IXRSBBAJOOHANY-HNNXBMFYSA-N 436.528 2.453 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccccc4F)CC3)CC2)cc1 779219272 SQOSTCAITUUXCW-OAQYLSRUSA-N 428.552 2.139 10 20 IECD Cc1cc(C(=O)NCC2CN(S(C)(=O)=O)C2)c(C)n1-c1cccc(Br)c1 779334397 KLLJGRUBDNXNKF-UHFFFAOYSA-N 440.363 2.478 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 782115990 YAEDTJUYTOGZCT-UHFFFAOYSA-N 435.477 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1F 782819309 QFBAUHVBFBURQP-UHFFFAOYSA-N 432.408 2.038 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3[C@H]3CCCC3=O)cc2F)C[C@@H](C)O1 784355120 DNNKCRUXMXDLIA-ZRAXVTTISA-N 447.551 2.126 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)cc1 785438657 DHIALWFSWQWWAT-UHFFFAOYSA-N 446.910 2.146 10 20 IECD CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 787086471 YQJXXSDXVSBGFJ-OAHLLOKOSA-N 442.491 2.114 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1 788013691 IYPKXKCHOGMONB-HXUWFJFHSA-N 437.588 2.004 10 20 IECD Cc1ccc(-c2nc(CNC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)co2)cc1 788318949 JKTFMMCTTHPMEP-UHFFFAOYSA-N 434.496 2.419 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC1CCC(N2CCCCC2)CC1 789800312 NJAQKTLWYXZXLK-UHFFFAOYSA-N 446.567 2.192 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(C(C)(C)C)CC3)cc2F)C[C@H](C)O1 789822356 WCYUXZOXBVDCAZ-IRXDYDNUSA-N 448.583 2.435 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc2[nH]1 792330056 JKYQGGZUHJLKGR-HNNXBMFYSA-N 449.511 2.180 10 20 IECD COc1cccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803687911 RCIZYKDHELUUET-HXUWFJFHSA-N 436.556 2.479 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN([C@@H]4C[C@H]5CC[C@H]4C5)CC3)CC2)cc1 804317882 RPMYYQNWAOSZAM-SFYKDHMMSA-N 440.588 2.113 10 20 IECD CN(C)S(=O)(=O)C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 805768909 HIFYLSBPQWNBGQ-SNVBAGLBSA-N 438.255 2.321 10 20 IECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1F 806857200 NXCUVIMKMPEGCI-KRWDZBQOSA-N 426.492 2.345 10 20 IECD CC[C@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854564 ZYVJDSVQJKFZRZ-HXUWFJFHSA-N 432.634 2.435 10 20 IECD C[C@H]1CN(c2ccc(CNC(=N)N3CCN(c4ncccn4)CC3)cc2F)C[C@@H](C)O1 849070632 ZENPOFSJBCRMPD-CALCHBBNSA-N 427.528 2.076 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1cccnc1N1CCOCC1 916400229 XEVBXQFKJDXCLA-UHFFFAOYSA-N 427.574 2.471 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 920454919 OHIWCGBDAKPNJV-ORYQWCPZSA-N 427.545 2.075 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C 1321512417 XBLLWDAZJNPHOX-WMLDXEAASA-N 436.505 2.334 10 20 IECD C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)c1ccccc1 1783281308 RRXBIPBSURPIJQ-MWTRTKDXSA-N 425.485 2.130 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1793757865 KXNPXSXWMOFPIN-GGPHIMKMSA-N 448.527 2.082 10 20 IECD Cc1onc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1C 1803890111 VQERFWRWVZODFQ-QRWLVFNGSA-N 437.456 2.126 10 20 IECD COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cn1 1810547562 SJGZIJJIWPXUCH-UHFFFAOYSA-N 426.473 2.055 10 20 IECD Cc1noc(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815707431 BSTSELNRBSEERN-INIZCTEOSA-N 440.460 2.369 10 20 IECD CC(C)N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(C)C 1816722849 ZLROBRJCTRUAMF-UGSOOPFHSA-N 447.561 2.198 10 20 IECD Cn1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1Cl 1829494870 LYEQSEPENAPQGM-MRXNPFEDSA-N 447.923 2.427 10 20 IECD COCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877444 KYAWSMBTSBYXIK-IWHGQQBYSA-N 432.517 2.473 10 20 IECD Cc1ccc2[nH]c(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)cc2c1 1843684990 SMCLUWZMLYYJMB-UHFFFAOYSA-N 442.566 2.154 10 20 IECD CCc1cnc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1844380970 UHNWMHPEQBRFMX-UHFFFAOYSA-N 437.525 2.315 10 20 IECD O=C(c1ccc2c(n1)OCCO2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501106 AHNMBTJPNUXRIB-UHFFFAOYSA-N 445.859 2.048 10 20 IECD Cc1cccn2ncc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)c12 1847039406 LGLBSKPXALAORH-SOFGYWHQSA-N 448.479 2.290 10 20 IECD CS(=O)(=O)N1CCc2cc(C(=O)Nc3ccc(NC(=O)C4=S=CC=C4)cc3)ccc21 523335493 YOIDOBMIQKTNRR-UHFFFAOYSA-N 441.534 2.477 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc4c3OCCO4)cc2F)CC1 730268694 DKBLBJRXIAGAIK-UHFFFAOYSA-N 435.521 2.217 10 20 IECD CCN(CC)CCO[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 746757576 OYWUVCLUDCBHJS-UNMCSNQZSA-N 445.608 2.031 10 20 IECD COc1ncc(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 746783761 QJIFWXYBWRJCMA-HUUCEWRRSA-N 430.480 2.406 10 20 IECD CC(C)(C)OC(=O)N1CC(OCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 748025010 VVRRQIDGESXHIP-UHFFFAOYSA-N 437.512 2.039 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)NC(=O)CC3CCCCC3)CC2)cc1 750234672 OOLWJMGZUWKQQY-GOSISDBHSA-N 445.560 2.362 10 20 IECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccc(C(=O)O)cc4C)C3=O)CC2)cc1F 753977602 GDDMZMJDSNWGOJ-LJQANCHMSA-N 441.459 2.295 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC3(C(=O)OC(C)(C)C)CCCC3)CC2)cc1 754070529 ZDFPSDOVPNRWBX-FQEVSTJZSA-N 433.593 2.422 10 20 IECD COC(=O)[C@H](C)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 756896678 PTATXXLHTPUXRY-HXOBKFHXSA-N 443.519 2.419 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC3(O)CCN(C(C)C)CC3)cc2F)CC1 761682376 LLOMPOJPUKUEPQ-UHFFFAOYSA-N 435.588 2.002 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)Cc3ccc(F)cc3)CC2)cc1 766750448 HIJYSUVUKIESCE-NRFANRHFSA-N 444.551 2.249 10 20 IECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 767206374 KELSQUYPYWCUDM-UHFFFAOYSA-N 445.585 2.131 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3c(O)cccc3Cl)CC2)cc1[N+](=O)[O-] 768187863 XUSJYLRIPNEMJX-UHFFFAOYSA-N 441.893 2.469 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)c2)CC1 770148034 NTPNOKMOWSWCKW-UHFFFAOYSA-N 432.502 2.393 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771059495 SBYYLINWACQVQE-QGZVFWFLSA-N 437.949 2.016 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CO)[C@@H](C)c3ccccc3)CC2)cc1 771425264 YUYKOXFHDIYAMY-WMZHIEFXSA-N 426.561 2.281 10 20 IECD C[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)c1ccc(N2CCOCC2)cc1 771753310 PZNXTGLEFCPLHW-GOSISDBHSA-N 447.557 2.430 10 20 IECD CCOc1nc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)co1 772355050 HCJWUIHUBVDJRO-UHFFFAOYSA-N 426.452 2.259 10 20 IECD C[C@H](NC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccc(N(C)C)cc1 776061517 JYDXJTVVCUKRLL-HNNXBMFYSA-N 433.534 2.051 10 20 IECD CN(C)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 776504834 HEDDUHQCIMBHHR-IBGZPJMESA-N 441.555 2.035 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3c(C)nn(C)c3OC)c2C)cc1 778852167 KPXMKZWEQZLLLO-UHFFFAOYSA-N 432.502 2.272 10 20 IECD Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c(C)nn1 786014353 FUDJTVJVLHJPAV-UHFFFAOYSA-N 442.497 2.188 10 20 IECD CCOCc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 787512922 HRFSYLZCMNSRJH-UHFFFAOYSA-N 425.529 2.335 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3ccc(F)cc3)N(C)C)CC2)cc1 787643182 XQCRFBUWBMTOAO-QFIPXVFZSA-N 442.535 2.338 10 20 IECD O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(N2CCOCC2)cc1 788320870 QGUZDZVORCUPEK-UHFFFAOYSA-N 446.891 2.060 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)C1 793718825 KMQFUNSZVUWELE-CPJSRVTESA-N 438.572 2.353 10 20 IECD CCC1CCC(N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793727914 WGBGHJINUIHZAY-SKINQDTJSA-N 428.577 2.432 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)c1 798334043 LCOLXFJUURILAA-VIFPVBQESA-N 429.292 2.302 10 20 IECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 799763460 OEYQFLFPXXQFOQ-QGZVFWFLSA-N 445.541 2.044 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803297961 LDXHXJGUGYHWNB-OALUTQOASA-N 436.556 2.268 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1 803450504 JFHLYXUESKHRDR-HZPDHXFCSA-N 437.487 2.258 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1F 804853586 SEAMRXNBKKEGQZ-UHFFFAOYSA-N 440.519 2.273 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC(C)(C)OC3(C)C)cc2F)CC1 805009378 JLFJKFKOHLDEQO-LJQANCHMSA-N 434.556 2.046 10 20 IECD C[C@@H](c1nccs1)N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806281876 AWNZBIPKZKHCRE-ZDUSSCGKSA-N 425.605 2.103 10 20 IECD CC(C)[C@@H]1CN(C)CCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768639 NNFPHFFBBFKURW-APWZRJJASA-N 438.519 2.172 10 20 IECD COc1ccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(OC)n1 811971002 WGTHFOBSSZIOCJ-UHFFFAOYSA-N 446.504 2.156 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OC[C@H]2CCCO2)cc1 916676228 CQPFHVVCHKYZPR-JOCHJYFZSA-N 444.553 2.409 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3nc(N4CCCC4)ncc3Cl)cc2)C1 917837482 WUWQFTJYGUVKSK-MRXNPFEDSA-N 442.951 2.362 10 20 IECD Cc1ccc(SCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1778088658 KCPRWOVGQZXRQJ-JOCHJYFZSA-N 443.525 2.037 10 20 IECD Cc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c1F 1800715946 ZKHGQTIUMGGUEW-CLLJXQQHSA-N 436.871 2.498 10 20 IECD O=C(CCc1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729257 YIANRIKTCMNUBO-CYBMUJFWSA-N 428.470 2.401 10 20 IECD O=C(CC[C@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823028159 IQTGTLLGQDIDKY-BBRMVZONSA-N 429.477 2.339 10 20 IECD Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1825872369 AZMDQNFOWYMDFM-SFHVURJKSA-N 425.489 2.138 10 20 IECD O=C(C[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837049648 UZUQPSFVNVMFON-LJQANCHMSA-N 447.532 2.064 10 20 IECD O=C(CCc1ccc(F)nc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033834 ISHUZRCZNSIBCK-WEVVVXLNSA-N 441.459 2.187 10 20 IECD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)C1 1847561746 JMLZXICJTWYPHY-VZAMPYOESA-N 436.892 2.156 10 20 IECD Cc1cc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)c(C)c1 1847734243 FSCVRBIOPUAYIE-ROUUACIJSA-N 425.485 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)cc1 104674097 YDQAINLXNAPYSO-UHFFFAOYSA-N 430.486 2.143 10 20 IECD CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 116113125 VXVKRFZQZNMVBA-GOSISDBHSA-N 429.542 2.112 10 20 IECD COc1ccc(N2CCCN(C(=O)c3nc4ncc(Br)cn4n3)CC2)cc1 195620635 ZPVRDSVWGINPSV-UHFFFAOYSA-N 431.294 2.248 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727481987 IIJVQUBLBPRJGB-GOSISDBHSA-N 425.533 2.408 10 20 IECD COc1cccc(CNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1O 727761205 NTIWIWKCZOBXGK-HUUCEWRRSA-N 434.514 2.129 10 20 IECD COC(=O)CN(CC(=O)NC(=O)N[C@@H]1CCCC[C@@H]1C)Cc1cc(Cl)ccc1O 731845754 FFDLAJQQTDTIPS-XJKSGUPXSA-N 425.913 2.425 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 731968806 OHELAYCXDZAPNT-JOCHJYFZSA-N 430.593 2.203 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1O 737283972 JAJFWTVMJDEDQM-KBPBESRZSA-N 431.464 2.408 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cccc1S(=O)(=O)NC(C)(C)C 740491508 LRWWTPDQNFLZCI-UHFFFAOYSA-N 446.573 2.393 10 20 IECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)s3)cs2)cn1 747750183 KQDFBDNPOUJUQI-UHFFFAOYSA-N 441.560 2.151 10 20 IECD C[C@@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2N1C 749917998 ITRTWHDSMWUASS-QAPCUYQASA-N 435.528 2.095 10 20 IECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)S(=O)(=O)c1cccnc1 754551144 KXFRBIFZVIVAGA-UHFFFAOYSA-N 435.461 2.116 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(CC[S@](C)=O)CC3)c2C)cc1 755948554 DDKNUASGIRFFBR-HKBQPEDESA-N 445.585 2.060 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCC(=O)Nc1ccc(F)c(F)c1 756336578 OKICCVTXUFLVIF-QGZVFWFLSA-N 433.455 2.406 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 758211352 UEWMJXSAYGGDAA-FQEVSTJZSA-N 438.488 2.045 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccccc1N1CCOC1=O 765931646 PNSDTXBFOGDLDQ-UHFFFAOYSA-N 434.246 2.366 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(F)(F)F)cn3)cc2)C1 772946510 OMURCCNKMZHBCA-CQSZACIVSA-N 449.433 2.057 10 20 IECD Cc1noc(C)c1S(=O)(=O)NC1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCCC1 773745003 HKAALLOPCUSGOI-GFCCVEGCSA-N 437.518 2.041 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1OC 773844164 CPNFXBFKFBZGPA-CQSZACIVSA-N 448.545 2.339 10 20 IECD C[C@@H](NCC(=O)NCCOc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 775254676 MFVGNLCASKWGOB-QGZVFWFLSA-N 427.501 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(c4nnc5n4CCCC5)CC3)CC2)cc1 775824239 NNLKGWOWQRTTCR-UHFFFAOYSA-N 438.576 2.151 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccnc3-n3cccn3)CC2)cc1 778231493 COIQEJHEPRJMDD-MDZDMXLPSA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCCNc3ccccn3)CC2)cc1 778265269 VTOASHROUPMDDA-VAWYXSNFSA-N 437.544 2.304 10 20 IECD Cc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)OCO2 781450143 QOTBEDVWHFABCC-UHFFFAOYSA-N 429.448 2.079 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CN(C)c3ccccc3[N+](=O)[O-])cc2)CC1 786259406 OGCFGUOPPNENBM-UHFFFAOYSA-N 425.489 2.016 10 20 IECD CCCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656041 JSSBKQBRNYNEDG-UHFFFAOYSA-N 443.569 2.469 10 20 IECD CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786657254 WEGWKSARXBAHHW-FQEVSTJZSA-N 432.590 2.063 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cc(F)ccc1N1CCOCC1 788909250 FGSIJXXNFCYJKF-UHFFFAOYSA-N 440.519 2.195 10 20 IECD O=C(NCCCCCN1CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837566 ZUOPPEYQQOKEIF-UHFFFAOYSA-N 448.583 2.175 10 20 IECD CCOC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(C)C 789948568 CYJHJLAEWATNLP-GOSISDBHSA-N 445.482 2.336 10 20 IECD C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734975 WHQKUWNOONENOP-JZWVFAODSA-N 448.567 2.409 10 20 IECD C[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306354 SQBUNVSIBVWVEP-RBUKOAKNSA-N 425.529 2.110 10 20 IECD COCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309772 BRZYDGYPUKSMDX-FXAWDEMLSA-N 429.517 2.496 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450198 DYCHCYJAOVUDGE-UHFFFAOYSA-N 449.502 2.427 10 20 IECD CC[C@@H]1Oc2cc([C@@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc2NC1=O 803662834 HKEWMNMJQKFETC-YJYMSZOUSA-N 442.491 2.495 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccccc3OC)cc2F)CC1 805006751 DIVDXYFXUDWEKD-UHFFFAOYSA-N 442.535 2.251 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H]1Cc1ccccc1 806493691 BBAYMVNUDVSTOT-ISKFKSNPSA-N 449.599 2.457 10 20 IECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2cc(Br)ccc2O)n1 807387719 SZYVMJNBGLOWRY-UHFFFAOYSA-N 436.291 2.267 10 20 IECD CCO[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770998 QRGAYQSPFUYLDO-CRAIPNDOSA-N 425.476 2.401 10 20 IECD CCCCN(C(=O)CN1CCCN(c2ccc(OC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 917089700 FQRDQSYOUDUDTD-HXUWFJFHSA-N 437.606 2.023 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 917715647 SIYQWKVBGMARAE-GUTXKFCHSA-N 431.430 2.466 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319695040 MQHJVKMQAPZKEP-SFTDATJTSA-N 445.627 2.200 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)N4CCOCC4)CC3)ccc21 1338516673 BBUABDNCQXFURX-UHFFFAOYSA-N 428.533 2.115 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)C1CC3(CCC3)C1)CCO2 1785510507 NEVCWNXFXAFCJF-JURIHQFCSA-N 442.512 2.227 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc21 1802534171 BBGNQJQIQFMMEU-KYHPRHEASA-N 443.594 2.215 10 20 IECD COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1 1815440847 HACZSTFMKZNFCG-HNNXBMFYSA-N 438.444 2.239 10 20 IECD C[C@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822783504 GWEXMYDAPUZKLR-CJNGLKHVSA-N 439.476 2.055 10 20 IECD O=C(c1ccc(OC(F)F)cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250384 SBCJZMYHRIRYGQ-UHFFFAOYSA-N 437.374 2.364 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CCS(C)(=O)=O)C3)cc1 1845399484 CEKFTBVHHBCLPM-UHFFFAOYSA-N 443.569 2.346 10 20 IECD COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)c(Cl)c1 1848086895 XPAOONNJOKRCHE-IRXDYDNUSA-N 431.876 2.213 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3cccc(S(C)(=O)=O)c3)C=C2)cc1 466396413 RDPLMABUJCULIA-UHFFFAOYSA-N 430.507 2.073 10 20 IECD CCCC(=O)NC[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 726248669 QPGUSWGPMYYSBI-HXUWFJFHSA-N 445.608 2.155 10 20 IECD O=C1CCc2cc(OC[C@@H](O)CNCc3ccc(N4CCOCC4)c(F)c3)ccc2N1 727467824 ADGYHTCNHKSKLT-SFHVURJKSA-N 429.492 2.077 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(CC(C)(C)O)CC1 728054660 YNCBWOIMSALNQV-INIZCTEOSA-N 435.524 2.178 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)c1 728949906 VZCFOPWSPKKCBK-CQSZACIVSA-N 431.489 2.437 10 20 IECD CCN(CC)c1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1F 740167653 KBRQPEXYWBMEHQ-RVDMUPIBSA-N 431.580 2.422 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc2nc(O)nc(O)c2c1 742800424 RBAZGUNOHVETIM-LBPRGKRZSA-N 431.399 2.436 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@H]3COc4ccccc4O3)CC2)cc1 742948539 XOFFTSHYAJKODP-NRFANRHFSA-N 440.544 2.299 10 20 IECD COC(=O)NC(C)(C)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744961424 LUFNGZSABLLGJZ-LBPRGKRZSA-N 438.436 2.467 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1C 745938959 MFHMTXTWNMMDGV-ZDUSSCGKSA-N 443.472 2.360 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCN(CC(F)(F)F)C1=O 746309024 DTWZSDZERKFKMZ-INIZCTEOSA-N 446.445 2.139 10 20 IECD NC(=O)c1cc(Cl)nnc1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 747213267 LAFHOKQESJLDCE-UHFFFAOYSA-N 442.886 2.097 10 20 IECD COc1cc(N2CCN(CN3C(=O)NC4(CCCCCC4)C3=O)CC2)cc(OC)c1OC 758956260 WOVAHWVJTREWPW-UHFFFAOYSA-N 446.548 2.437 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc(OC)c1OC 759258075 LVTAVYVJRJCBDC-DLBZAZTESA-N 448.564 2.334 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCOC4(CCOCC4)C3)CC2)cc(OC)c1OC 760130525 WDHOYYSMZWSDNB-KRWDZBQOSA-N 449.548 2.272 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 762091230 GDBOKMFWWSXCOP-GOSISDBHSA-N 432.540 2.377 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccn(Cc2ccncc2)n1 765903343 JPWXLXPNAPNRAW-UHFFFAOYSA-N 430.262 2.049 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1 768226548 YIHUURWVDVJPFW-UHFFFAOYSA-N 449.511 2.304 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)c1 769766310 NMIHDQNPPJVENR-OAHLLOKOSA-N 439.490 2.057 10 20 IECD CN(C[C@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 769924498 ZJGDLMRAPKJCJK-CQSZACIVSA-N 427.523 2.235 10 20 IECD COc1ccccc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 774725985 TZEQRMONHACCHG-HZPDHXFCSA-N 429.492 2.381 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC 774730863 YVNIXWFWQUDAPO-LJQANCHMSA-N 442.512 2.276 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c(C)nn(C)c3-n3cccn3)cc2F)CC1 777655394 CICDZNGHZLCDNX-UHFFFAOYSA-N 425.512 2.125 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](c3cccc(F)c3)c3nccn3C)ccc21 785605806 RDWFMULYSHMOIA-NRFANRHFSA-N 435.503 2.464 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@@H]4C3)cc2)C1 785609130 PEAVCQYVZRPIGH-XRXFAXGQSA-N 440.588 2.480 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3C)cc2)CC1 786122101 NMLSYZUEBYAHFL-UHFFFAOYSA-N 432.502 2.050 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 786290859 QIOFAEUHJWENBO-UHFFFAOYSA-N 439.512 2.226 10 20 IECD CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 787086470 YQJXXSDXVSBGFJ-HNNXBMFYSA-N 442.491 2.114 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1 787736924 NGEZSBRQGPZVQG-JOCHJYFZSA-N 438.572 2.236 10 20 IECD CN(Cc1ccc(OC(F)F)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788319546 LSOCMZOQMBEVQD-UHFFFAOYSA-N 433.455 2.399 10 20 IECD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 789168609 KMGYMJPNSVGHKV-IEBWSBKVSA-N 442.560 2.262 10 20 IECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789824579 JJMWUTRITCUIPH-GGPKGHCWSA-N 448.583 2.292 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(C)noc1C 789845799 MFBJHNVBBXALSH-GOSISDBHSA-N 432.496 2.275 10 20 IECD CN(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951603 WTDMTLBCUCXOBF-UHFFFAOYSA-N 436.434 2.212 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC([C@@H]2CCOC2)C1 792608738 SPXKIQNRUDJZGB-CYBMUJFWSA-N 447.469 2.210 10 20 IECD CN(CCC1CCCCC1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793726215 SLDVDMXNMSALCX-HXUWFJFHSA-N 428.577 2.433 10 20 IECD Cc1noc(C)c1C(C)(C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 797507658 AUNVLOVGJYRVIH-UHFFFAOYSA-N 433.480 2.404 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(S(C)(=O)=O)s3)cc2)CC1 805024010 OCEVSNHFWYRABS-UHFFFAOYSA-N 449.598 2.321 10 20 IECD CNC(=O)OC[C@H]1CCCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 806334937 XRGIORKBCGWQAL-HXUWFJFHSA-N 447.580 2.127 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)[C@H]1Oc1ccccc1 807097564 PPIRPRUXQVKZHA-YPAWHYETSA-N 425.529 2.418 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CNC(N)=O)C3)cc2Cl)C1 807953998 DWCKRMNVPFWEPZ-WBVHZDCISA-N 449.983 2.099 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4n[nH]c5c4CCCC5)n3)CC2)cc1 809464157 AOGCFLLVXYUJEH-UHFFFAOYSA-N 436.516 2.162 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1 916687786 IPGXTQDUOGUGSP-UHFFFAOYSA-N 437.500 2.239 10 20 IECD COc1ccc(N2CCCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 917210728 RRCGOAYWLRUQFB-UHFFFAOYSA-N 426.473 2.284 10 20 IECD O=C(NCCc1cccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919783926 XNEAPSAPHOVNCQ-UHFFFAOYSA-N 435.507 2.379 10 20 IECD COc1ccccc1C(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919792205 WJXOKGXGPGHSSE-UHFFFAOYSA-N 438.528 2.199 10 20 IECD CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1 1789661349 LRPJUFYCTYPDJR-IHPCNDPISA-N 439.512 2.352 10 20 IECD Cn1cc(F)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845279 IWBNVSZHGYKELB-AWEZNQCLSA-N 428.424 2.313 10 20 IECD C[C@@H](CC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291687 ZAMXJIZOSFVNNN-HZMBPMFUSA-N 449.895 2.292 10 20 IECD CC(C)N1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827303430 CQMRFQVGECJLHP-ZFWWWQNUSA-N 445.545 2.048 10 20 IECD CS(=O)(=O)Nc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 725887820 VOPJAAZOFAXUGR-UHFFFAOYSA-N 435.521 2.336 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1 734807638 YNBUDERXCVCQQE-UHFFFAOYSA-N 425.514 2.084 10 20 IECD CC(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737245408 KMRKHCZCAKYFQE-UHFFFAOYSA-N 429.542 2.300 10 20 IECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NCc1ccc(N(C)C)cc1 742734154 NGXXNPFQUSEOIA-UHFFFAOYSA-N 425.533 2.471 10 20 IECD C[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)N1CCN(C)CC1 742749125 CVQGIDPDVHQYCW-PXNSSMCTSA-N 433.597 2.071 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1C 757657132 VYVHTNVCFOACRX-UHFFFAOYSA-N 430.479 2.483 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](c3cccc(F)c3)N(C)C)CC2)cc1 758187989 WNAOKKPXDXNPKA-VWNXMTODSA-N 430.568 2.210 10 20 IECD C[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCS1(=O)=O 758381972 NQJCLWDVVVDAFJ-AWEZNQCLSA-N 449.495 2.261 10 20 IECD CCS(=O)(=O)CCN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759367899 UFXDMFKBKQWWEO-CQSZACIVSA-N 428.510 2.156 10 20 IECD COc1cc(C)ccc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759413525 UHGZRQWGVHQGGF-UHFFFAOYSA-N 443.500 2.317 10 20 IECD COCCOCC(=O)NC1CCC(C(=O)NCc2cccc(Br)c2O)CC1 765728532 VGFYGJCCBAGQFC-UHFFFAOYSA-N 443.338 2.109 10 20 IECD CCCCn1ncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 772344176 XJJIDXIGCGWJRU-UHFFFAOYSA-N 432.496 2.441 10 20 IECD O=C(COC(=O)c1ccc(OC(F)F)cn1)NCc1ccc(N2CCOCC2)c(F)c1 772555454 JWNNADIHYKCFDJ-UHFFFAOYSA-N 439.390 2.132 10 20 IECD COC(=O)c1csc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778324056 BEYDABICGRHRLF-BQYQJAHWSA-N 429.498 2.387 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC4COC4)cc3)CC2)cc1 782107092 NGVFFMRBOGMJOJ-UHFFFAOYSA-N 425.485 2.150 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1 783317609 XQGPQFDIULOHLO-UHFFFAOYSA-N 426.517 2.253 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C 785600445 SOOUSWIWZUNQGZ-JOCHJYFZSA-N 447.539 2.121 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](c3cccc(F)c3)c3nccn3C)ccc21 785605809 RDWFMULYSHMOIA-OAQYLSRUSA-N 435.503 2.464 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C)cc2)CC1 786256081 QVUKFURFYVFDFV-QGZVFWFLSA-N 432.565 2.474 10 20 IECD COc1ccc(OC)c(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 786647180 FHIQVEVBIXMYPP-MRXNPFEDSA-N 427.501 2.034 10 20 IECD CO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 788313722 VEYHAEKSVHWMTB-FQEVSTJZSA-N 431.920 2.297 10 20 IECD CN(CCCOc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797409 COUYYRUDTXAWDU-UHFFFAOYSA-N 447.482 2.345 10 20 IECD COc1nn(C)cc1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 789862378 KXUQCBFCIKPPIE-UHFFFAOYSA-N 447.429 2.096 10 20 IECD COC(=O)Cc1cccc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)n1 792405592 BSTZORYZESGOIK-UHFFFAOYSA-N 441.532 2.140 10 20 IECD Cc1cc(C(=O)CN2C[C@H](N3CCCC3)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796427499 DHXWITJVZLLPIN-OXJNMPFZSA-N 444.601 2.483 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NC3CC(NS(C)(=O)=O)C3)cc2Cl)C1 801061018 ABIFSVCGOBXLAP-IUDNXUCKSA-N 428.986 2.456 10 20 IECD CC(C)C[C@@H](CO)N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451686 SJYFNYLDXURNQV-KRWDZBQOSA-N 427.492 2.238 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H](OCC(F)(F)F)C3)CC2)cc1 804316783 JCQVEHRGXOLMAB-SFHVURJKSA-N 443.466 2.350 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3c3nc(C)no3)CC2)cc1 804857686 HXGMRTRUHJQRTQ-JPMGXVIASA-N 439.516 2.345 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(N(C)C)cc1 807674799 RAUGPGSQIUONJG-GOSISDBHSA-N 438.572 2.203 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1 807755230 WONKYQZGKSPYQJ-UHFFFAOYSA-N 428.499 2.492 10 20 IECD CO[C@@]1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1(C)C 808854648 GTSUVUDVQDDPBQ-BWKNWUBXSA-N 442.604 2.155 10 20 IECD CC[C@H](C)[C@H](NC(C)=O)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809464630 JFMMGNMYZDBYEJ-BTYIYWSLSA-N 429.521 2.193 10 20 IECD CN(Cc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 916824884 UGRVJVKLSJGLIF-UHFFFAOYSA-N 429.523 2.009 10 20 IECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)N[C@@](C)(c2ccc(S(C)(=O)=O)cc2)C1=O 917423437 XPDSGQXKUTUMJQ-QFIPXVFZSA-N 444.557 2.013 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)C1 917834250 HFEVBVGWNQQFIZ-QGZVFWFLSA-N 425.489 2.415 10 20 IECD CS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918032477 AWEDUJQOCSPSDY-MRXNPFEDSA-N 430.530 2.114 10 20 IECD O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(N2CCC(O)CC2)c(F)c1 918216475 QDQRGVZBSGXQMU-UHFFFAOYSA-N 431.464 2.394 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2o1 918464689 ZJHHTXMUAUOLSI-INIZCTEOSA-N 435.484 2.093 10 20 IECD CCOCCO[C@H](C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919620174 BYBRJBQZBYJCQI-CQSZACIVSA-N 425.437 2.385 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@]4(CCCC[C@H]4C)C3=O)CC2)cc1 1253854354 XKNWEXMTQJYUTR-UZUQRXQVSA-N 428.533 2.235 10 20 IECD Cc1ncnc(O)c1CCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1317818471 IZLMMBPMMJNSOB-UHFFFAOYSA-N 445.431 2.381 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1F 1326766536 WPRVDZOVSQJCHU-UHFFFAOYSA-N 434.493 2.287 10 20 IECD CC(C)=CCCC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1781125255 KYTMNOAUJCCWNG-ISGGHPHESA-N 430.501 2.393 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2 1782004973 RNUKKMYZPQJMCE-GOSISDBHSA-N 442.255 2.150 10 20 IECD C[C@@H](Nc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810544087 XTBVHSWBZOQPCK-MRXNPFEDSA-N 439.516 2.233 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CCCC4)C2)CC1 1810597519 NCGYQBOVJYUOSW-UHFFFAOYSA-N 439.516 2.253 10 20 IECD CN1CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1814544618 CPBZSBQWWPHZTB-QGZVFWFLSA-N 442.520 2.254 10 20 IECD CO[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823713909 UJYXISICNQPRFI-WCBMZHEXSA-N 425.894 2.468 10 20 IECD O=C(c1ccco1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898146 BGKGFQDQFHENRN-OAHLLOKOSA-N 435.571 2.373 10 20 IECD CC(C)(F)C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834648434 KMKZRFUCAHFUKL-GQCTYLIASA-N 449.523 2.136 10 20 IECD CN(C)c1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)cc1 15134810 DUPVXVYRBMDHJE-UHFFFAOYSA-N 440.363 2.500 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 727151060 UKPJXJBQBQHMFW-FQEVSTJZSA-N 434.581 2.483 10 20 IECD CCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730132295 BMKAWYOIUJZBQZ-UHFFFAOYSA-N 433.572 2.415 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)Cc3nnc4ccccn34)cc2F)CC1 734275599 OZLUORAWDSQXLO-UHFFFAOYSA-N 425.512 2.352 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)n1cccn1 742800803 SZEBEJIBBLJNTN-JKSUJKDBSA-N 435.475 2.289 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)cc1 742927733 XPZOZYNOTAAIGC-UHFFFAOYSA-N 427.505 2.221 10 20 IECD O=C(NCCCN1C(=O)COc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 743553384 JSZJEABGSBCPPN-UHFFFAOYSA-N 442.491 2.277 10 20 IECD C[C@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ncnc2[nH]cnc12 744474080 PDAYROUEIBNVJD-NSHDSACASA-N 441.403 2.312 10 20 IECD COC[C@@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 745735889 BVRSYEHZUCQIDQ-LJQANCHMSA-N 430.528 2.413 10 20 IECD CN1CCN(Cc2cccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2)CC1 746146464 GYNYBQRXCLTSQO-HSZRJFAPSA-N 449.599 2.066 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H](C)N1CCOCC1 751060644 IEJTZNJSMJIGFM-ZIAGYGMSSA-N 439.559 2.094 10 20 IECD COC(=O)c1nscc1S(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751372823 PLABFHRAKITMDN-CYBMUJFWSA-N 445.950 2.232 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)(C)[C@@H]3[C@H]3CCCO3)CC2)cc1 752974224 BZHDNTZAZKFQPG-ITBAZWOWSA-N 427.545 2.316 10 20 IECD CC(=O)NC[C@H]1CCn2ncc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2C1 753213040 XMXHWXBJCJHIAV-PKOBYXMFSA-N 426.517 2.109 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc4c(c3)CCS4(=O)=O)CC2)cc1F 757750955 JEFHXVSLMUWTKS-UHFFFAOYSA-N 433.505 2.196 10 20 IECD COC(=O)c1ccccc1CCC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 758918105 IQRQNCDPVCCGKU-UHFFFAOYSA-N 440.496 2.306 10 20 IECD CC[C@H](C)[C@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771062535 ASLYIZHBBBGGDT-KPZWWZAWSA-N 437.474 2.238 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)c1 776042048 OCJMZGGFVHOKMK-UHFFFAOYSA-N 439.262 2.435 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)cc1 776239877 WVHNEEYDJREBQJ-HNNXBMFYSA-N 432.546 2.195 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(CCO)[C@@H]1CCCc2ccccc21 788318009 CTKWGSNXVLBFEN-HSZRJFAPSA-N 437.540 2.038 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)C1 789823386 DLLALMVHIJEIKK-WIRSXHRWSA-N 448.583 2.244 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)c3nccs3)cc2F)C[C@@H](C)O1 789834242 LGEZIUOQVHRPML-RBSFLKMASA-N 434.537 2.432 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N(CCO)[C@@H]1CCc2ccccc21 789855894 ZROHAPOPAKETIV-JOCHJYFZSA-N 439.581 2.364 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3cccc(CC(=O)OC)n3)cc2F)CC1 792412107 UHCLMORLCLPBET-UHFFFAOYSA-N 429.496 2.400 10 20 IECD CCC1CCC(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793734402 TZASJRPUXPJQRW-AFMYVXGZSA-N 428.577 2.337 10 20 IECD CC[C@@](O)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cl)c1 800436570 HMYZEZJZGPJOHQ-NRFANRHFSA-N 436.961 2.489 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H](c4ccnn4C)C3)CC2)cc1 801518182 YZSKRJZHPGJBPB-JBVUFVISSA-N 437.544 2.040 10 20 IECD CN(C)CCCCNS(=O)(=O)c1cccc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 803642140 FIZDAGLTENKQAG-LUAWRHEFSA-N 433.530 2.370 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CC2)cc1 803721725 NEWXBLFRHZVSDA-KTKRTIGZSA-N 446.507 2.391 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N(C)Cc1ccccc1 805942131 HXPNFBJJUCHNQP-FQEVSTJZSA-N 438.572 2.118 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2ccnn2)cc1 809613256 PLYJTRXJRITCSX-UWJYYQICSA-N 449.511 2.358 10 20 IECD Cn1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c(C2CC2)n1 811888768 LUKHOYRADIKQPI-UHFFFAOYSA-N 435.507 2.483 10 20 IECD Cc1cc(C(=O)OCc2c(N(C)C)n(C)c(=O)n(C)c2=O)c(C)n1-c1ccc(F)cc1 814065670 NNJVWIIZTQKQKP-UHFFFAOYSA-N 428.464 2.054 10 20 IECD CC(=O)N1CCCc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 917916788 BZIFSPQTXNILOY-UHFFFAOYSA-N 447.532 2.440 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 919792374 ZVUDRVAILPCNML-KRWDZBQOSA-N 446.573 2.334 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CC12CCS(=O)(=O)CC2 1321436956 VXBHWFVEIIGABH-QGZVFWFLSA-N 446.491 2.373 10 20 IECD Cc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782003706 LMBKYAGEZVCOGT-JOCHJYFZSA-N 445.903 2.141 10 20 IECD Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cccc1=O 1794930536 BQDPPQKDQLXOFN-BTTYYORXSA-N 431.876 2.016 10 20 IECD O=C(CCCn1cccc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729225 YAGTVFAAXMQLBS-CQSZACIVSA-N 441.513 2.457 10 20 IECD C[C@H]1CCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835505618 IISMOMQSSATQNP-KXBFYZLASA-N 430.549 2.114 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(C2CC2)on1 1847390251 DUTKFTYWSYENNU-IRJXADNDSA-N 425.441 2.198 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)[nH]1 746865833 BWSFDWCZJHHBCO-UHFFFAOYSA-N 426.448 2.016 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 747555672 YKWCVLYVUWELHB-LJQANCHMSA-N 436.512 2.392 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CC12CCOCC2 748844402 ROZYBRPTJMHYEC-SFHVURJKSA-N 425.508 2.375 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCC1(CO)CCOCC1 749176706 UBBJDOOMGJCVBA-UHFFFAOYSA-N 431.455 2.130 10 20 IECD O=C(O)c1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1Cl 751212126 BYHPTURKLJFCPC-UHFFFAOYSA-N 444.918 2.074 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNCCCN3CCc4ccccc4C3)CC2)cc1 758210773 RPYGDLVLUROOJH-RUZDIDTESA-N 438.616 2.216 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)CC2)cc1 758981006 RYTJGBNVRCGPTM-UHFFFAOYSA-N 438.463 2.092 10 20 IECD COc1cc(N2CCN(C(=O)c3cn(C)nc3-c3cccnc3)CC2)cc(OC)c1OC 759222071 XKAADJMLFGNQJW-UHFFFAOYSA-N 437.500 2.470 10 20 IECD Cc1cc(C(=O)COC(=O)c2cncc(F)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759426366 QGGYWARERKWCSP-UHFFFAOYSA-N 431.445 2.315 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(NC=O)cc3)cc2F)C[C@@H](C)O1 762859713 PZIBKXHPZJQXTK-IYBDPMFKSA-N 443.475 2.481 10 20 IECD O=C1CNC(=O)N1Cc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 771876171 AGTKMIKLAIBKGE-UHFFFAOYSA-N 428.832 2.066 10 20 IECD O=C(Cn1nc(-c2ccccc2F)ccc1=O)NCc1ccc(N2CCOCC2)c(F)c1 772895851 JGGMVSBDFJZMDV-UHFFFAOYSA-N 440.450 2.342 10 20 IECD CSCC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 773742695 ZGVJHEIBSVXSLP-MXASKKJJSA-N 434.558 2.442 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(Br)ccc1-n1cccn1 774357658 WHRBRERUHXTSOB-UHFFFAOYSA-N 445.273 2.343 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 775203974 XJGACGPXJUVDAY-INIZCTEOSA-N 432.546 2.039 10 20 IECD CN(C)[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 780094992 UYGXERQEQLONAN-JOCHJYFZSA-N 429.492 2.125 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(NC(C)=O)ccc3C)CC2)cc1 781425577 CWMUEQSRGVZOAN-UHFFFAOYSA-N 425.485 2.468 10 20 IECD COc1cccc(-c2nsc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)n2)c1 785297119 LSMVQDSSHDZLLS-LLVKDONJSA-N 428.470 2.311 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC3C[C@@H](C)C[C@H](C)C3)CC2)cc1 785529214 VZZXFGAWROYTBC-OALUTQOASA-N 430.593 2.264 10 20 IECD COc1cc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccn1 786582328 IAWRVOPXKWNPLP-UHFFFAOYSA-N 434.443 2.093 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN1CCN(c2ccccc2)CC1 788010086 HFUIZLGSGVZLHO-UHFFFAOYSA-N 437.588 2.040 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788930407 AAMCWZTVQOQSAN-KRWDZBQOSA-N 430.549 2.371 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H]1C 789826382 PUVKZRWOBIYVJD-LXZJYRNTSA-N 448.583 2.387 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC[C@H](C)C1 789844246 FDSAJUVQNCXBPX-FUHWJXTLSA-N 435.540 2.067 10 20 IECD C[C@@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)Cn1cccn1 790228927 OQGDULVNWRJQOL-HNNXBMFYSA-N 435.475 2.022 10 20 IECD CCN1CCN(S(=O)(=O)c2cccc(NCc3ccc(N4CCOCC4)cc3)c2)CC1 796400450 YDJRNEKPJWLRFN-UHFFFAOYSA-N 444.601 2.462 10 20 IECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 799833047 JJTVRYLKCOBLAN-UHFFFAOYSA-N 449.529 2.043 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 801173761 CQSSNWYNJWBIGK-UHFFFAOYSA-N 448.516 2.361 10 20 IECD CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 803298788 DWSKURPOOSDDJU-FOIQADDNSA-N 427.549 2.318 10 20 IECD CCCn1ccnc1CCCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803300993 XFMGNSADTHEKOS-LJQANCHMSA-N 441.576 2.398 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cc1F 804853906 XBPLRHMLPOOBGS-WSTZPKSXSA-N 448.583 2.388 10 20 IECD O=C(NC[C@H]1COC2(CCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806691281 AOUQSWYQLNBANT-MOPGFXCFSA-N 432.517 2.092 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(F)c(N4C(=O)CCC4=O)c3)ccc21 806878686 NTKVLWNKAHYVQK-UHFFFAOYSA-N 438.459 2.116 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807634516 HJBQGRUCUYFHCL-IEBWSBKVSA-N 442.512 2.492 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1)c1ccc(N(C)C)cc1 807678758 ZNHLRWALMQWMAJ-SNRMKQJTSA-N 431.558 2.342 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 808346717 LOBSSDCGMOFBIV-UNMCSNQZSA-N 431.577 2.405 10 20 IECD Cc1nn(C)c2cc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc12 812959227 XJOZIDOSQZGMMP-UHFFFAOYSA-N 439.491 2.237 10 20 IECD CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 815445960 LXJPVOLDKRCUEL-UHFFFAOYSA-N 431.464 2.470 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H]3CS[C@H](Cc4ccccc4F)C(=O)N3)CC2)cc1 889063362 SFDHEYMIOOJKGM-LEWJYISDSA-N 443.544 2.326 10 20 IECD CS(=O)(=O)C[C@@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 917120655 KVAMGWKLJBBXII-OAHLLOKOSA-N 440.521 2.157 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1cccnc1 917177260 KBACXIZHSZIKHY-UHFFFAOYSA-N 442.520 2.261 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCc3nc(O)c4cnn(C)c4n3)cc2F)C[C@H](C)O1 917715599 ROQJPXWPBJKISV-KBPBESRZSA-N 442.495 2.071 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(CCNS(C)(=O)=O)cc3)CC2)cc1 917822393 YYHAHALHXRADNW-UHFFFAOYSA-N 431.558 2.139 10 20 IECD CC(C)(C)c1noc(CCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 918338260 ZSEBSEIQCHONIF-UHFFFAOYSA-N 434.562 2.241 10 20 IECD C[C@H](NC(=O)N1CCN(C(=O)c2cccn2C)CC1)c1ccc(N2CCOCC2)cc1 920870500 HFPKZHZWIYMDME-SFHVURJKSA-N 425.533 2.090 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c[nH]c(C(F)(F)F)c3)cc2)CC1 1261194337 YFJLTPNJUPZUHV-UHFFFAOYSA-N 430.452 2.181 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc(N4CCNC4=O)c3)CC2)cc(OC)c1OC 1337831986 ZWTMFVLAOHZRAF-UHFFFAOYSA-N 440.500 2.204 10 20 IECD C[C@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427093 NYAZBYRVMVRZGT-CQSZACIVSA-N 436.472 2.168 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ncc[nH]1 1816247743 QZNRDTPKIDVAFU-QGZVFWFLSA-N 446.471 2.232 10 20 IECD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)n1cccc1 1838031775 LOCPAWPNDPFHCL-MRXNPFEDSA-N 442.516 2.168 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)s1 1848181944 SHQQQRMYEINIOW-GJZGRUSLSA-N 437.612 2.051 10 20 IECD CCN(CC)CC(=O)N1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728905312 IRSXQMAJPDDKQA-UHFFFAOYSA-N 425.529 2.315 10 20 IECD CC1CCN(c2ccc(CNC(=O)NCCS(=O)(=O)N3CCSCC3)cc2)CC1 731048040 DLARQBASTFCGIS-UHFFFAOYSA-N 440.635 2.101 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)cccc3NC(C)=O)CC2)cc1 734194803 XQHVGRRHCPLLGB-UHFFFAOYSA-N 429.448 2.298 10 20 IECD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751370895 DFOWMJZFCUEOIO-AWEZNQCLSA-N 426.882 2.292 10 20 IECD COc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c(OC)c1 752126517 SZYKWJSUANUNHC-UHFFFAOYSA-N 446.529 2.249 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncc(F)cn4)CC3)cc2F)C[C@@H](C)O1 759219983 AAEULHHSUSKZSR-HZPDHXFCSA-N 446.502 2.400 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc([N+](=O)[O-])c4cccnc34)nc12 766234762 XNDLWIFEIDPWDK-UHFFFAOYSA-N 437.368 2.425 10 20 IECD CS(=O)(=O)C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 774173296 WBIFGKNRCDRRHR-IBGZPJMESA-N 435.521 2.247 10 20 IECD CCCCCN(CC(N)=O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 781029300 PQLKPVHHFJOJHF-UHFFFAOYSA-N 425.532 2.372 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](C)C[C@@H]2[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785546105 MNUIXJZBYGORBJ-XXHMAFKTSA-N 433.574 2.406 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2)CC1 786050810 VHCRLORUBPUWOP-UHFFFAOYSA-N 430.530 2.080 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788932397 MYFQOSRUAFMHIZ-SFHVURJKSA-N 443.569 2.190 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1 788964378 NJDPMRUVHZWPKF-FGZHOGPDSA-N 430.593 2.033 10 20 IECD COc1ccc(CCCN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789801887 VQIZIUYEYYYNDF-UHFFFAOYSA-N 443.519 2.378 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2cc(F)ccc2C1 789845024 ILAJHBKVFBOORV-UHFFFAOYSA-N 429.467 2.127 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(N4CCC4=O)c3)CC2)cc1 791183763 GQNPGIKGGZEQLE-KTKRTIGZSA-N 434.496 2.275 10 20 IECD C[C@H](COc1cccc(F)c1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793780658 AFVUWCURFCTWMO-IAGOWNOFSA-N 429.492 2.423 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 793907895 DQUVHSLWZBPQDH-WCIQWLHISA-N 430.593 2.183 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)c(O)c1 797388324 YCRRSPHMLVHYHZ-UHFFFAOYSA-N 430.411 2.487 10 20 IECD Cc1nccnc1N1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 799326793 GRVHQJWPXSACJT-UHFFFAOYSA-N 441.491 2.321 10 20 IECD CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451549 OSYVRNYGMWFVDI-KSZLIROESA-N 437.487 2.303 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(C3CCOCC3)CC2)cc1)C1CCCCC1 803679840 WRZKNLGUAAKDKS-UHFFFAOYSA-N 442.604 2.395 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCS(=O)(=O)CCc1ccccc1 804199559 YRPMTEHLMNOUAF-UHFFFAOYSA-N 436.917 2.467 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC(OCC(C)C)CC3)cc2F)CC1 805006014 JBQFITMPCNRDCJ-UHFFFAOYSA-N 448.583 2.247 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1 805767874 PFCCUCOHYVGENR-INIZCTEOSA-N 438.516 2.497 10 20 IECD COc1ccccc1CN1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806280896 YHJIWSAQUCFMCF-UHFFFAOYSA-N 434.587 2.095 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)CS(=O)(=O)c1ccc(C)cc1 807372645 LCYGBQPUJKUFMT-GOSISDBHSA-N 445.585 2.388 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC1CCC(N2CCCCC2)CC1 807683977 KLRHGMNCPFZGNO-UHFFFAOYSA-N 442.604 2.395 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 810181453 MHOMSBXOJLMLDM-NRFANRHFSA-N 427.549 2.231 10 20 IECD CC(=O)Nc1ccc(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918902987 CHPKKBZSLQFBNE-UHFFFAOYSA-N 443.475 2.023 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CC(=O)NC4CCCC4)CC3)nc12 920088596 JKOAESXDFKOWAH-UHFFFAOYSA-N 429.521 2.273 10 20 IECD C[C@@H](NC(=O)CCC(=O)N1CC(=O)Nc2ccccc21)c1ccc(N2CCOCC2)cc1 920881299 MMISNDVYYHQRPG-QGZVFWFLSA-N 436.512 2.466 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cc(O)ccc1O 1796933114 PQVPEKUQMFJYGD-ACHSLPGTSA-N 448.479 2.143 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(F)(F)C1)C2)c1cc(O)c(O)c(Cl)c1 1799767194 ZLLDDFJVOXVMMT-YGSHXTJESA-N 444.862 2.390 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336098 UWKCJTBRJRHHPO-NOFFMGQBSA-N 447.582 2.490 10 20 IECD COC1(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1807998809 ONZASRGJYBSZNK-HRAATJIYSA-N 440.500 2.167 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)nc1F)CC2)c1cc(O)nc(O)c1 1816717960 WZIOHKMCQOGSTD-SECBINFHSA-N 447.423 2.162 10 20 IECD O=C(COc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722637 SIRVFXISBNJKEG-ZDUSSCGKSA-N 440.481 2.254 10 20 IECD O=C1CC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc(O)c(O)c3O)n[nH]2)C1 1823479311 HHHPPVAXCPDHSG-BIENSFFJSA-N 440.456 2.211 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccnc(Cl)c2)C1 1842448762 LXKZOIYXGNBIJE-HWKANZROSA-N 429.860 2.382 10 20 IECD CN(C)c1ccc(CNC(=O)CSc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1 19418156 SMBWBMXWCTVIFG-UHFFFAOYSA-N 434.587 2.341 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCO[C@H](c3nnc(C(C)C)o3)C2)n(C)c2ccccc12 576779954 GNQWNJMMFSEZRJ-SFHVURJKSA-N 425.489 2.209 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(CC(=O)N(C)C)cc3)CC2)cc1 726725487 FLJIBXINVXQMFJ-UHFFFAOYSA-N 438.528 2.050 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@@H]3CN3CCCC3=O)CC2)cc1 732456467 WHMZLFDIKFWPOH-OAQYLSRUSA-N 443.592 2.004 10 20 IECD CN(C)c1ccc(CN(C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)C2CC2)cc1 737008511 CRDWSYAQFBKVPC-UHFFFAOYSA-N 426.521 2.004 10 20 IECD CC(C)Cn1c(N)c(C(=O)CN(Cc2ccccc2O)C2CCCC2)c(=O)n(C)c1=O 744400930 RDJOSZHSBQFYEG-UHFFFAOYSA-N 428.533 2.118 10 20 IECD O=C(Nc1cnn(CCN2CCOCC2)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 747561134 FZEHQQBVECPIAW-FQEVSTJZSA-N 429.521 2.134 10 20 IECD CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748042710 MOBXGCPJRLFNEO-VXGBXAGGSA-N 425.532 2.288 10 20 IECD Cc1nn(C(C)(C)C)cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 752188620 SUXODXAPUXAWIP-UHFFFAOYSA-N 432.496 2.395 10 20 IECD COc1ccc(N2CCN(C(=O)NC3CCN(C4CCN(C)CC4)CC3)CC2)cc1F 753903852 BDNPABCAWZBWMU-UHFFFAOYSA-N 433.572 2.225 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4c(cnn4-c4ccccc4)C3)CC2)cc1 754008995 HKKTUEKQHHMSBT-DEOSSOPVSA-N 447.583 2.422 10 20 IECD COc1cc(N2CCN(C(=O)C[C@@H]3Oc4ccccc4NC3=O)CC2)cc(OC)c1OC 759240141 WMFPSWIBHIRVJT-FQEVSTJZSA-N 441.484 2.151 10 20 IECD CC(C)(C)S(=O)(=O)CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767827259 TXXITQVUMQVZIV-UHFFFAOYSA-N 443.477 2.157 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)cc1 768156025 IUJLGZMORNEQLN-UHFFFAOYSA-N 441.893 2.469 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1ccc(F)cn1 772927725 KCGCLLHMUQOIRU-UHFFFAOYSA-N 426.370 2.331 10 20 IECD C[C@H](NC(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1)c1ccc(N(C)C)cc1 773307341 RJXXQZQLIBQSFF-INIZCTEOSA-N 438.594 2.086 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN([C@@H]2CCOC2)CC1 773480341 CFTHDNGPSWMSTR-FUHWJXTLSA-N 433.508 2.196 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)c1O 774889892 WILPLVLTGDIKCE-IBGZPJMESA-N 426.473 2.232 10 20 IECD COc1ncnc(N(C)C)c1NC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 775141903 DWGMHPZRTGJCON-UHFFFAOYSA-N 426.521 2.042 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CC(C)C)C(=O)OC(C)C)CC2)cc1 778277940 SPXOKFVMOFBIGI-XPTLAUCJSA-N 445.560 2.383 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407987 SLADVXNWEWQWJB-UHFFFAOYSA-N 435.477 2.082 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CC(=O)N(C)C)CC3)cc2F)C[C@H](C)O1 781347559 YBALJNPLHDOQNB-ROUUACIJSA-N 448.583 2.246 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CN(Cc2ccccc2)CCO1 785423826 HIXUNXAMGLKMOW-XZOQPEGZSA-N 438.572 2.165 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H](C)c3ccsc3)CC2)cc1 785527054 JGKINBBQBCOJGK-KRWDZBQOSA-N 430.574 2.262 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(-n2cccn2)cc1 788381687 YHMOXDQTFPKQIU-UHFFFAOYSA-N 435.553 2.358 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 788955555 XIXZXHIRLVZPAB-INIZCTEOSA-N 446.573 2.016 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789798969 GZDCZUOLBNSOQR-QZTJIDSGSA-N 448.583 2.151 10 20 IECD CN(CCCOCc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799505 HXDBTHOFOOTIFI-UHFFFAOYSA-N 443.519 2.344 10 20 IECD CC(C)C[C@@H](CCO)CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828345 XMQYUYNUDIZNPU-ZIFCJYIRSA-N 437.556 2.216 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)C3CCN(C)CC3)cc2F)C[C@@H](C)O1 789829004 ZUZJCLVBBMGFJW-KSZLIROESA-N 448.583 2.244 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCC1CCC(F)(F)CC1 789843797 PJMUUUPRPIXCRE-UHFFFAOYSA-N 427.467 2.345 10 20 IECD CC(C)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)CC2 789867479 GIIJDHGUELQWEM-SFTDATJTSA-N 430.618 2.330 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(Br)n3)CC2)cc1F 793006389 VOMJOEACYMNIEJ-UHFFFAOYSA-N 437.269 2.279 10 20 IECD CCOC(=O)[C@@]1(COC)CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 798372905 PRMQKBDPXZMPSG-QFIPXVFZSA-N 437.512 2.164 10 20 IECD CNC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 807951818 AZZKYXJCHBPCQZ-OYHNWAKOSA-N 434.968 2.177 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1noc(-c2ccccc2)n1 808481076 GOVSACJNSNNDPL-QGZVFWFLSA-N 449.511 2.409 10 20 IECD COc1cnc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 815521669 VAVGBNSJACALIW-LBPRGKRZSA-N 431.404 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3[nH]c4c(c3C)C(=O)CCC4)CC2)cc1 916531404 LUIZCZUXNUJUOI-UHFFFAOYSA-N 425.485 2.356 10 20 IECD CCOC(=O)Cc1csc(NC(=O)CN2CCCN(c3ccc(OC)cc3)CC2)n1 917209057 QJRVMINQXCXYSP-UHFFFAOYSA-N 432.546 2.408 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](C(=O)Nc4ccccn4)C3)CC2)cc1 917397371 SQLRRCVQOKNQCL-LJQANCHMSA-N 437.544 2.090 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 917759094 DEAMKCBOEXODEV-UHFFFAOYSA-N 445.475 2.174 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@H](C)O4)CC2)cc1 918461765 KVGHDWYQWGQTAR-HNNXBMFYSA-N 438.484 2.092 10 20 IECD C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1 919789772 CFWBBKGGUMRWII-INIZCTEOSA-N 432.546 2.073 10 20 IECD O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1317907832 ITUYLDLGGKNTRK-UHFFFAOYSA-N 447.551 2.478 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)CC2)cc1 1319624431 KRMVNEYQRSTNCU-UHFFFAOYSA-N 440.456 2.068 10 20 IECD Cc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802080174 DTNRTGNLBNEXIX-HHVYCJAJSA-N 438.480 2.028 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804008856 ZXICSFGYEBYQAG-XHDPSFHLSA-N 442.369 2.108 10 20 IECD CN1CC(C(=O)N2CC[C@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1811809154 HJFOMZBXPCDOTF-AUUYWEPGSA-N 444.919 2.027 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)nc1F)CC2)c1cc(O)nc(O)c1 1816717973 WZIOHKMCQOGSTD-VIFPVBQESA-N 447.423 2.162 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)c3ccccc3)sc2C1 1821843873 DWQMMPIDZKELNO-LBPRGKRZSA-N 446.579 2.229 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423756 FWWNYTRBAKOLFF-GOSISDBHSA-N 441.532 2.390 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N3CCN(C(=O)C4CC4)CC3)ccc21 728637704 FDGUQPYQTMBBTK-UHFFFAOYSA-N 441.528 2.142 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 729526852 ILDKVASQIKMPKA-HNNXBMFYSA-N 434.500 2.204 10 20 IECD CN(CC(=O)NCc1ccc(N2CCCC2)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 737793845 INFIZVZQGFBEAX-UHFFFAOYSA-N 432.502 2.132 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1 741095376 BTGPLQBOGUMLGK-CQSZACIVSA-N 447.513 2.065 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCCN(C(N)=O)C2)NC(=O)OC(C)(C)C)cc1 742751418 UNJSOKVDNKHFGN-WMZOPIPTSA-N 433.553 2.225 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3c(O)ccc4c3CCCC4)C2=O)cc1 743719165 RMMVLQWCUCJUDH-DEOSSOPVSA-N 437.496 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@](C)(O)[C@@H](C)c3ccccc3)CC2)cc1 748483294 FXIOGRXPEOESJA-UUOWRZLLSA-N 426.513 2.442 10 20 IECD Cc1ccc(C(=O)O[C@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)c(O)c1O 750618719 LBIFLYZATIJKOF-SECBINFHSA-N 426.347 2.124 10 20 IECD O=C(Cc1cc(Cl)cc2c1OCC2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 755092407 KWFUVGZDKOIZPQ-UHFFFAOYSA-N 434.945 2.369 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3cccc4nsnc34)CC2)cc(OC)c1OC 759879076 RGVCGHUDXKXUPJ-UHFFFAOYSA-N 443.529 2.478 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 760546422 VFJLVWNGFSGMKW-INIZCTEOSA-N 438.571 2.356 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c(OC)c1 761266975 LULNGSZDIRXBLN-UHFFFAOYSA-N 428.488 2.376 10 20 IECD C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769662832 DJHQOMOTGDQBQZ-LBPRGKRZSA-N 426.516 2.000 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2o1 774144458 CXIRWZVJBXSDPW-UHFFFAOYSA-N 426.448 2.491 10 20 IECD CNS(=O)(=O)C[C@H]1CCCN1Cc1cc(Br)cc(Br)c1O 775734442 PPSBDRPWVJOGEC-LLVKDONJSA-N 442.173 2.431 10 20 IECD O=C(N[C@@H]1CCCOCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 776496688 CTDGZKUDIFURLH-CYBMUJFWSA-N 435.458 2.400 10 20 IECD COCCO[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 781699773 ISHXONDFQJDAAR-CQSZACIVSA-N 426.516 2.132 10 20 IECD CO[C@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2C1 784665101 ILIGOZYUZVSPIJ-FQEVSTJZSA-N 441.503 2.155 10 20 IECD CC[C@@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 792210618 OOCDLHYVSDTTCR-QAPCUYQASA-N 440.548 2.119 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccccc1-n1ccnc1)c1ccc(N2CCOCC2)cc1 793716524 DYGYUACMCOFNPJ-GOSISDBHSA-N 433.512 2.203 10 20 IECD O=C(NCCN1CCc2sccc2C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793869408 VBTDAHVDDWHQSY-LJQANCHMSA-N 443.569 2.136 10 20 IECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c1OC 795348561 ONUWABFMLLFVQJ-UHFFFAOYSA-N 428.850 2.001 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Br)ccc2C)cc1 797431320 LWKUVBANHPFGRK-UHFFFAOYSA-N 434.337 2.434 10 20 IECD O=S(=O)(NCCNCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F 799345483 DHVGRSXHYWGXIA-UHFFFAOYSA-N 429.464 2.009 10 20 IECD CC(C)N(C)CC1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803300722 VOIPPGQOMUJSJP-LJQANCHMSA-N 430.593 2.279 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3)ccc21 803689274 OUQUSTYQJJSZLX-ZRZAMGCNSA-N 432.568 2.276 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCO[C@H](C(=O)OC(C)(C)C)C3)cc2)CC1 805026424 NEETZSSSKIDMGT-FQEVSTJZSA-N 445.560 2.108 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 805530861 QHXZFFKOCXVWLW-UHFFFAOYSA-N 441.576 2.310 10 20 IECD CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 807772983 YRDGUMVJUUGZMB-HXUWFJFHSA-N 427.549 2.099 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)CC2)cc1 808059173 NGNUGTIYJBQVRA-PKTZIBPZSA-N 436.556 2.296 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cnn(CCF)c3)cc2F)C[C@@H](C)O1 808570146 OJFYVYGSMSAQTH-HUUCEWRRSA-N 436.459 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3C[C@@H](c4ccccc4)OC3=O)CC2)cc1 808589892 HLQJDUKYMLABQJ-SFTDATJTSA-N 438.480 2.191 10 20 IECD O=C(N[C@H]1CCOC2(CCSCC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809459450 YBUWFAKUZZMTLI-OALUTQOASA-N 448.585 2.461 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3ccc(C(=O)N4CCCC4)cc3)CC2)cc1 851752512 JEGLGMBJLIXPQR-UHFFFAOYSA-N 436.556 2.370 10 20 IECD C[C@@H](OC(=O)CN1CCCCC1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915455625 VCTOALYAJBTDDJ-CQSZACIVSA-N 434.448 2.345 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(CN4CCCC4=O)cc3)cc2)C1 917833174 NNGHZDVSPKFALD-NRFANRHFSA-N 434.540 2.441 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918294588 HFAXQCNOESTIGY-NRFANRHFSA-N 441.528 2.479 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 918307314 SLHNMLXEFMPART-UHFFFAOYSA-N 444.557 2.181 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2 918309646 CVZNFLBSLNMMCM-UHFFFAOYSA-N 440.475 2.144 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918438856 JDNNLLNNNVZXLK-UHFFFAOYSA-N 426.542 2.244 10 20 IECD COCCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 919971606 SJZCTFMKEBRCKF-UHFFFAOYSA-N 447.507 2.465 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(CCCOCC(F)(F)F)CC1 921123942 ZFUYRZHESSBZOF-UHFFFAOYSA-N 444.498 2.319 10 20 IECD O=C(NCCN1C(=O)COc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 1342971680 PLMGBAHPAGTCEA-UHFFFAOYSA-N 442.491 2.012 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nc2ccncc12 1796661693 RGLDZOGMIOJNNA-BPQKRJORSA-N 449.467 2.040 10 20 IECD CN1CC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)C1 1823003586 NUCSIXNONJEFDP-OAHLLOKOSA-N 433.896 2.342 10 20 IECD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)no1 1827428718 DWAJWAFRDAMGJH-SFHVURJKSA-N 428.489 2.265 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(Br)cc2O)C1 1845306142 YSJCZFQJAIQULT-UHFFFAOYSA-N 448.273 2.092 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3cccnc3OCCOC)cc2F)CC1 730117192 VHDFUDFQEAAUNA-UHFFFAOYSA-N 445.539 2.387 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)c1 730571889 XEAKZKBIEZXXAA-IBGZPJMESA-N 432.590 2.399 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 738991342 OZOUMHAPKHUBJB-MRXNPFEDSA-N 438.532 2.460 10 20 IECD COCCOc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1OC 741096754 FXCMAPWZSZZJMB-UHFFFAOYSA-N 425.485 2.352 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3=NN(Cc4ccccc4)C(=O)CC3)CC2)cc1 742920888 WBRQBTHAZAZWNG-UHFFFAOYSA-N 449.555 2.112 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(Cc4cccs4)CC3)CC2)cc1 742948551 YCXQOKWLDKLRLN-UHFFFAOYSA-N 443.617 2.406 10 20 IECD COc1cc(C(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc(OC)c1OC 743718673 JBWZGPSTBXPRJN-UHFFFAOYSA-N 428.485 2.343 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN(C)Cc3nc[nH]n3)c2C)c1 746477901 HTLBKAAPRNNJFR-UHFFFAOYSA-N 439.472 2.100 10 20 IECD NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)C(=O)[C@H]2C1 748692301 AJQSJNPUWLYMQB-QGZVFWFLSA-N 435.444 2.068 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 750549706 CHZSKAKZMGIFOQ-OWCLPIDISA-N 432.496 2.136 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@H]2CCOC2)n1C[C@H]1CCOC1 752848019 GDXWQGMMDYSCAX-UXHICEINSA-N 427.549 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CN(C(=O)OC(C)(C)C)C3CC3)CC2)cc1 753419717 VCWIBDKJVFSHML-UHFFFAOYSA-N 447.532 2.287 10 20 IECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 753456998 KSPLEYZFJPDNJL-BGOLNKOXSA-N 445.589 2.396 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CNS(C)(=O)=O)o3)cc2F)C[C@@H](C)O1 753586455 XWYZQTKAERUHGW-OKILXGFUSA-N 439.509 2.012 10 20 IECD COc1ccc(N2CCN(C(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)CC2)cc1F 753741154 CUQSIDPHTNTTES-UHFFFAOYSA-N 426.408 2.286 10 20 IECD CCN(CC)C(=O)CCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755221725 ZZFPFHQERNKRCF-UHFFFAOYSA-N 442.539 2.207 10 20 IECD CC1(O)CN(C(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)C1 765449732 JFUPUBDVPXMDEJ-WUXMJOGZSA-N 427.345 2.244 10 20 IECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 765659598 NLSGTHCWRWKRKQ-NVXWUHKLSA-N 428.455 2.256 10 20 IECD C[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1C(=O)NC2(CCCC2)C1=O 771055740 DDZPGBPYYVZSIB-WMLDXEAASA-N 448.951 2.379 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 774357274 QEHPLAIEXXLJRK-UHFFFAOYSA-N 425.485 2.411 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)c1 775376681 XHNDWOPEOSVJSJ-NPMXOYFQSA-N 440.500 2.026 10 20 IECD CN1CCN(c2ccc(CN3CCC(N(CC(F)(F)F)S(C)(=O)=O)CC3)cc2)CC1 775696386 JXJVPWMTXBNAAN-UHFFFAOYSA-N 448.555 2.227 10 20 IECD CC[C@@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 776040033 ZNYMIHFMZPJWEX-QAPCUYQASA-N 440.548 2.119 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781456020 CAWPKLSYTPXLAK-CYBMUJFWSA-N 447.438 2.404 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781457052 JYWLXPSHPZMOHH-AWEZNQCLSA-N 429.448 2.265 10 20 IECD C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)Nc1ncccn1 785408008 OGEXPJOECCFMQF-NSHDSACASA-N 448.482 2.229 10 20 IECD O=C(NCc1nc2cccnc2[nH]1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788165178 PACWUEGEXSFIEY-UHFFFAOYSA-N 429.483 2.456 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789828783 YLITVNXDSNMEQP-ZIFCJYIRSA-N 434.556 2.045 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H](CCCO)c1ccccc1 789841065 QZTJRBKNCYBZFU-OAQYLSRUSA-N 443.519 2.033 10 20 IECD O=C(NCCOC(F)(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 789857523 OZWSCUVAIUSFFY-UHFFFAOYSA-N 449.363 2.367 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 791249324 DYNPBRRFCRFXOM-UHFFFAOYSA-N 430.461 2.145 10 20 IECD CC(C)(C)C[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734106 PRTKOLVRYIZVHT-QUCCMNQESA-N 428.577 2.432 10 20 IECD C[C@H](NC(=O)C(=O)NCCOc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 803300559 JDLJXCSXOGDQRK-HNNXBMFYSA-N 433.455 2.174 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCN(C4CCCCC4)C3=O)ccc21 803687190 WWWMMLIDDVZCGH-HXUWFJFHSA-N 426.561 2.125 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCc3ncc(C)s3)cc2F)CC1 805009886 PSQDHZQTHUHDPG-UHFFFAOYSA-N 447.580 2.050 10 20 IECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NCc1cc(Cl)cc(Cl)c1O 805135418 SRXUVPBKZDFCDX-UHFFFAOYSA-N 439.342 2.428 10 20 IECD CCc1cnc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)s1 806280461 FBCJAXRHUAPQRU-UHFFFAOYSA-N 425.605 2.109 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C[C@@H]2O 807673624 WTOKCKPVTDCIJI-KSSFIOAISA-N 427.501 2.023 10 20 IECD CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 808096039 DLQQEDVENZPHDT-UHFFFAOYSA-N 429.495 2.078 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cn(CC2(C)COC2)nn1 819525595 KTDMVMDALRAOFA-UHFFFAOYSA-N 429.521 2.317 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1C 917758366 SKQBRWYQPBOHOC-UHFFFAOYSA-N 437.543 2.450 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCCN1S(=O)(=O)c1cccs1 919765916 PGWMCFROVYYIIO-LJQANCHMSA-N 449.598 2.444 10 20 IECD Cc1cccc(N2CCN(CCCNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 919813025 RJLCWQFXGAYFHZ-UHFFFAOYSA-N 446.573 2.014 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3[nH]cc4c3CCC4)C2)C1 1780002349 OXJXHLXZVABDEJ-JOCHJYFZSA-N 445.903 2.325 10 20 IECD O=C(c1ccnc(F)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003164 DRMBPRMTSHICIQ-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1 1784075672 QTNNZZVJEBNDDC-NBHSMZAVSA-N 433.263 2.119 10 20 IECD CC(C)N1CCC(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)CC1 1806643108 FOGJXTYELOKJDP-UHFFFAOYSA-N 444.576 2.458 10 20 IECD CC(C)(C)CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814186250 NAYOARWVAVIIIG-KXBFYZLASA-N 448.614 2.384 10 20 IECD Cc1cc(C)n(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1815926543 WWSCRMVJVJJTPA-INIZCTEOSA-N 439.476 2.035 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3CCOC3=O)C2)cc1 1841485024 YTBFIURHSMKFSU-UHFFFAOYSA-N 436.512 2.363 10 20 IECD COc1nccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1F 1845501238 PZSFQOSFOJNTJR-UHFFFAOYSA-N 435.839 2.425 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c(Cl)c1 1847056190 JSQYMKZIUPTPHE-UHFFFAOYSA-N 437.974 2.326 10 20 IECD Cc1cnc2c(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cccc2c1 726977008 VKVDCAOEUJANFW-UHFFFAOYSA-N 445.566 2.257 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1 729037397 UMDQZJKXMVJMAU-AWEZNQCLSA-N 435.502 2.304 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(=O)n3c(nc2c1)CCC3 736196700 UTRKBNYJDZOREG-UHFFFAOYSA-N 432.524 2.481 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(CC4CCOCC4)CC3)cc2F)CC1 737048742 FVHRJSVQBOLLSR-UHFFFAOYSA-N 447.599 2.221 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(F)cc1F 743387583 GNWHZEUKEKHTIP-UHFFFAOYSA-N 446.454 2.357 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(CS(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 748841841 YHBOMEZHDFSINI-HUUCEWRRSA-N 435.521 2.158 10 20 IECD CN1CCN(Cc2cccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c2)CC1 749406243 NFEDKWCBUMQKQU-UHFFFAOYSA-N 440.563 2.464 10 20 IECD CS(=O)(=O)N1CC[C@H](CNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 753418897 PYKHIGBAHCGXGO-OAHLLOKOSA-N 429.502 2.438 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCc2nc(COC)nn2C1 757778606 WIODBXPBIXBGDT-AWEZNQCLSA-N 438.326 2.439 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)N[C@](C)(C4CCCCC4)C3=O)CC2)cc1 758198261 NFRDZWFGFUYPLB-GBXCKJPGSA-N 444.576 2.069 10 20 IECD O=C(CN1CCC[C@@H]1C[C@H](O)c1ccco1)NCc1ccc(N2CCOCC2)c(F)c1 758822393 HKWPYICPYXUTFS-NQIIRXRSSA-N 431.508 2.460 10 20 IECD CC(C)Oc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 759929360 UZENFOWSGRVUFU-UHFFFAOYSA-N 431.558 2.443 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3cc(-n4nnnc4C)ccc3F)CC2)cc1 760823010 PHFWPJGHAJHFQK-UHFFFAOYSA-N 439.495 2.269 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1 761539770 CHHJMXJKRHECDA-CYBMUJFWSA-N 438.477 2.052 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cn1 765903208 HSAYINKQRMLAME-UHFFFAOYSA-N 430.262 2.299 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N(C)C)cc1 773855795 GZXJUVMYQQDZBD-CQSZACIVSA-N 430.530 2.009 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1 774355874 DOMLLJKOYJODRH-UHFFFAOYSA-N 425.485 2.458 10 20 IECD CN1CCN(c2ccc(CN3CCCN(S(=O)(=O)c4ccc(F)cc4)CC3)cc2)CC1 775644617 KSUWMBSZXMMRKG-UHFFFAOYSA-N 446.592 2.474 10 20 IECD COc1ccc(N2CCCN(c3ncc(Br)cc3S(N)(=O)=O)CC2)cc1 779892006 BSNNVYWFEQUDAA-UHFFFAOYSA-N 441.351 2.217 10 20 IECD CC(C)[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 781812680 RLJHYJYTIYDDME-MRXNPFEDSA-N 441.550 2.481 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 786711238 ZBVCUTRBCUQBGM-UHFFFAOYSA-N 441.550 2.251 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC(F)F 787298453 LKABYHVHDOGUIG-UHFFFAOYSA-N 425.407 2.434 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1cccs1)C[C@@H]1CCCO1 788309750 GXQICIZRLZLFJV-FQEVSTJZSA-N 443.569 2.409 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1 788311331 UOMMXGJLFOHLCP-IBGZPJMESA-N 443.931 2.473 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](CS(C)(=O)=O)C1 795085459 JIXYBZOXTGUMFU-HUUCEWRRSA-N 440.521 2.156 10 20 IECD CCOc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 804857074 GGTKRALLOZDXSW-UHFFFAOYSA-N 429.492 2.336 10 20 IECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1-c1ccccc1 806844222 XCRRLWWMSWPOTP-UHFFFAOYSA-N 437.475 2.318 10 20 IECD CN1CCC[C@@H](CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771964 ZOLZKJHMCIKRBZ-IAGOWNOFSA-N 438.519 2.173 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O 808564442 SKXLWNKUSKYFMK-OAQYLSRUSA-N 440.519 2.158 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN(C2CCC2)C1 813594633 LJDLKGDOAOGMSU-QUCCMNQESA-N 427.593 2.404 10 20 IECD C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1)n1cccn1 915732143 VOESIRQWMYGNFM-INIZCTEOSA-N 434.500 2.404 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN1CCCN(c2ccc(OC)cc2)CC1 917089963 QVZLVCIODHMNQI-UHFFFAOYSA-N 444.601 2.434 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccco4)CC3)cc2)C1 918118950 WQXSOTBPJDXGNE-LJQANCHMSA-N 425.533 2.009 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 920050805 HRLMXLZXJBWGLV-UHFFFAOYSA-N 449.533 2.219 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 920454913 OHIWCGBDAKPNJV-HBGVWJBISA-N 427.545 2.075 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nc(C)ncc3Br)cc2)CC1 1256346678 KNEVHQLAOFDVJO-UHFFFAOYSA-N 432.322 2.146 10 20 IECD CCOc1ccc(N2CCN(C(=O)Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 1322418835 UIQBHYFYDOONEL-UHFFFAOYSA-N 431.558 2.227 10 20 IECD CCOC(=O)/C=C/C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787653255 RJMIIMVCOLYVGF-CMDGGOBGSA-N 425.441 2.360 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)Cn2ccnc2)C3)cc1 1799620586 VEARTYPICMUYGW-RUMRUAAYSA-N 447.539 2.194 10 20 IECD CCOC(=O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291590 RSRRFTMPKFMUNC-XFLCEESOSA-N 446.500 2.044 10 20 IECD O=C(CCCC(F)(F)F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804331419 WNIJLIRBEYXJRW-ZSBIGDGJSA-N 437.509 2.218 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3ncccn3)C2)CC1 1808501453 QQDHEHSVYGNGRJ-GQCTYLIASA-N 438.484 2.152 10 20 IECD C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825113651 OODJJSGCFJZHBH-OIHBSNPPSA-N 436.584 2.048 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831906306 QJBRHFJGRNKQGU-UWJYYQICSA-N 440.544 2.434 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2nc3ccccc3[nH]2)C1 1843645482 YGKDSDSPBXIFCG-VQHVLOKHSA-N 434.452 2.210 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2nn[nH]c2C(F)(F)F)C1 1844807664 KRMVCIQSSGOUDF-UHFFFAOYSA-N 445.785 2.019 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CC23CCCN2CCC3)C1 1845118344 WKJUDJMIWJNINB-FNORWQNLSA-N 441.528 2.039 10 20 IECD COc1ccc([C@H](O)C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cc1 1845500203 BWZNBEZLEVINCT-SFHVURJKSA-N 446.887 2.310 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H](c1cccc(F)c1)N1CCOCC1 304010687 LAUPSNOFZYQZSW-QFIPXVFZSA-N 431.483 2.491 10 20 IECD Cc1ccc(CC(=O)N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1 725866793 SIPPGQXGJXCTPX-UHFFFAOYSA-N 436.556 2.428 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 726240287 VDONNLAIKXGOOO-NJDAHSKKSA-N 431.625 2.483 10 20 IECD COc1cccc(CNC(=O)[C@@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c1O 729861116 CVUQPNDSWXDIRX-MRXNPFEDSA-N 433.486 2.477 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 734491696 NHBMEWURSMFWTI-INIZCTEOSA-N 432.502 2.083 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)cc2F)C[C@@H](C)O1 734842786 XNALKHCNWQTCIE-GASCZTMLSA-N 447.532 2.204 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3CN(C)C(=O)OC(C)(C)C)nc12 744423216 FWXVRMZVSNEBCI-HNNXBMFYSA-N 433.509 2.443 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2)C1 745773403 STQCHCXRCUUZRE-HNNXBMFYSA-N 430.436 2.131 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)n(C)c2)cc1 745979013 GKWLEHNTQNWRPU-UHFFFAOYSA-N 429.520 2.154 10 20 IECD C[C@@H](O)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 747615884 BFCCEIWYUNLQME-KGLIPLIRSA-N 449.485 2.334 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 750538423 ISWQUPTYMMVJRF-AWEZNQCLSA-N 444.918 2.018 10 20 IECD COc1cc(N2CCN(CN3C[C@](C)(c4ccccn4)CC3=O)CC2)cc(OC)c1OC 758965491 QLWQJGNBIYMLEB-XMMPIXPASA-N 440.544 2.377 10 20 IECD COc1ccc(N2CCN(CCNc3cc(N4CCCC[C@@H]4CO)ncn3)CC2)cc1 764799840 MAVMFIAOCXIREV-HXUWFJFHSA-N 426.565 2.071 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c[nH]c4nccc(Cl)c34)CC2)cc1 769653567 UHMNYEUDFWBGQU-UHFFFAOYSA-N 449.964 2.325 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772886266 YMEIAZGYIVXEMA-UHFFFAOYSA-N 429.492 2.368 10 20 IECD CC[C@H](C)n1nc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1C 776042286 PYZYVQCBQDNTHX-KRWDZBQOSA-N 442.564 2.048 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778223291 KYPDTCSINVVWMX-MDZDMXLPSA-N 441.459 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4ccc(OC)cc4C3)CC2)cc1 778243299 CGZGGZBDORJBOF-KTKRTIGZSA-N 435.524 2.494 10 20 IECD O=C(CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)NCC(F)(F)F 781007214 DFGGPUMIBLKJHL-UHFFFAOYSA-N 448.353 2.012 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1[C@H](C)C1CC1 784637827 HCOMSSHNABFKDV-OAHLLOKOSA-N 429.496 2.393 10 20 IECD C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 785898617 XQUOTGAWXJYZCJ-SFHVURJKSA-N 425.529 2.325 10 20 IECD C[C@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786994672 ASPBZLLMLLYPPH-KRWDZBQOSA-N 434.556 2.182 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCCN3CCN(c4ccccc4)CC3)ccc21 787853135 VWLQDJDPNAHHIV-UHFFFAOYSA-N 449.599 2.014 10 20 IECD CSCc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789812849 OWOHSEHXYFONRC-UHFFFAOYSA-N 431.533 2.458 10 20 IECD C[C@@H](c1ccc(F)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735833 ZALOVPQXIFXNRA-LPHOPBHVSA-N 440.519 2.363 10 20 IECD CN(C)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1F 802059998 BZLBKMPGWQSIND-UHFFFAOYSA-N 446.907 2.462 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1Oc1ccccc1 807289206 LTUAPRGWTAOQAR-ZLNRFVROSA-N 435.524 2.420 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O 808568616 NMIGAEGVRDVPNO-KRWDZBQOSA-N 431.439 2.331 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364034 AKHPLQVHHRPCHQ-KRWDZBQOSA-N 436.505 2.408 10 20 IECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284668 NAFJAJCTUXMZPH-UHFFFAOYSA-N 442.491 2.055 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4ncccc4c3)cc2)C1 918464385 UHCLHKLDDSRJLE-GOSISDBHSA-N 431.496 2.191 10 20 IECD O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NCc1ccc(N2CCOCC2)cc1 919767103 CKWPTIACFUBSQY-BOPFTXTBSA-N 429.542 2.120 10 20 IECD CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc21 920636805 MCCNMVOJTREBBJ-LBPRGKRZSA-N 446.481 2.101 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3Cc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1318773152 YTXSARGHKVVVBV-UHFFFAOYSA-N 425.489 2.451 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1)C1=NN(c2ccccc2)C(=O)C1 1795819305 QDTLPWBTXMJKRU-RKCFAAOBSA-N 446.507 2.151 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc(O)n1 1796822629 JPDYMIGMDRMTGE-ZURAMSNBSA-N 439.468 2.178 10 20 IECD CNCCCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809766864 KBHTVIDRQQJBJW-UHFFFAOYSA-N 439.560 2.010 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccnc3S)CC2)C1 1810549514 STWSJRVFTSGKRQ-UHFFFAOYSA-N 428.514 2.335 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1 1814185823 GLAJDROEUXVASL-VQIMIIECSA-N 446.598 2.138 10 20 IECD CCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722559 MHZUGAUEACLAOT-SNVBAGLBSA-N 429.458 2.039 10 20 IECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827426817 ILHPUWSPUCHRLC-GOSISDBHSA-N 427.505 2.082 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832845828 MRHWXRSNHHVQHF-RTBURBONSA-N 446.548 2.031 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc(O)ccc2F)C1 1845337639 KTKNBKYPAGGPGD-UHFFFAOYSA-N 436.443 2.141 10 20 IECD Cc1cccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1847249887 MSXDXRYQUCBADI-DLPCIYJJSA-N 443.507 2.398 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1848186840 XMDPAKSTRWOKNJ-BDJRERGKSA-N 437.496 2.355 10 20 IECD Cc1ccoc1C(=O)NCCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 738975044 KOWHDMYYHIGGJI-UHFFFAOYSA-N 432.496 2.308 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(Cc4ccncc4)n3)cc2)C1 743165802 RFUODBFKJIISMI-IBGZPJMESA-N 433.516 2.350 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 750874183 GBNLVNSBQCWJQU-FQEVSTJZSA-N 431.558 2.482 10 20 IECD COc1ccc(CCN2C(=O)C[C@@H](N3CCN(c4ccc(OC)c(F)c4)CC3)C2=O)cc1 753976871 CZHSTEJKGJZJOO-OAQYLSRUSA-N 441.503 2.335 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cnn(Cc2ccccc2)c1 762415408 FSJCYOAVXJOWHI-UHFFFAOYSA-N 433.512 2.365 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)CCN(C)C(=O)OC(C)(C)C)CC2)cc1 768715407 SWVUXZNIGMCFHC-UHFFFAOYSA-N 449.596 2.326 10 20 IECD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916480 RHMBRIGCDHZMBV-KURKYZTESA-N 433.936 2.301 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(I)cn2)c1 773230950 ROVPFVGLDHSVNK-SECBINFHSA-N 441.225 2.216 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccccc3F)CC2)cc1 778227509 VYDZKEFXPCEFNA-KHPPLWFESA-N 427.476 2.234 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)cc1 780394488 ZXPFBPXQDVFJQK-CTNGQTDRSA-N 449.548 2.112 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 788012600 DNERPLUVCSRGQI-PMACEKPBSA-N 437.588 2.257 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(C[C@@H](O)c1ccc(F)cc1)C1CC1 788318530 DIVBUPGJLHJHHL-JOCHJYFZSA-N 441.503 2.003 10 20 IECD CC(C)COC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccco1 788321060 SILWBUYZFOFCMT-FQEVSTJZSA-N 429.517 2.263 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 789798096 BIKFWQRAEAVYJG-IBGZPJMESA-N 449.910 2.436 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N(C)Cc1ccccc1 789854249 GEDAVPUBRVKEPL-LJQANCHMSA-N 440.613 2.493 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 793723460 WYQMDBFMGORKKD-QGZVFWFLSA-N 442.585 2.160 10 20 IECD CCS[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793727927 WMYPGSSGSACZMM-MISYRCLQSA-N 446.617 2.185 10 20 IECD CN(C)c1ccc([C@@H](CNS(=O)(=O)N(C)CC2CC2)NC(=O)OC(C)(C)C)cc1 795250092 YPFQLRVMWFBPEQ-GOSISDBHSA-N 426.583 2.495 10 20 IECD O=C(CN1CCC[C@](O)(C(F)(F)F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 796447498 GWYUREOTSUTUGE-LJQANCHMSA-N 433.446 2.058 10 20 IECD CO[C@H](C)c1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 803305736 OKEZMCDFCZVQPF-HUUCEWRRSA-N 432.546 2.181 10 20 IECD CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 806620145 PQHNRTOKHMRJJF-FQEVSTJZSA-N 447.580 2.127 10 20 IECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 806985266 AIJXQOJHGKGZON-CQSZACIVSA-N 433.530 2.122 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCN(C(=O)c2ccsc2)CC1 807290170 RUPQHCFFHKTJJA-UHFFFAOYSA-N 438.553 2.115 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2C1=O 807387522 MMDQKXNLPYNBIC-UHFFFAOYSA-N 432.274 2.038 10 20 IECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)OC(C)(C)C 807668480 XHLUHZWWYDOSOY-KRWDZBQOSA-N 449.548 2.319 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1 807911846 CCKZRNWXHIMLSK-SFHVURJKSA-N 427.524 2.420 10 20 IECD Cc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nnn1-c1ccn(C)n1 815834984 HIKFBVQKFBJYDA-MRXNPFEDSA-N 429.912 2.063 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C 914449875 SPQWTKHJYVIZHY-UHFFFAOYSA-N 449.511 2.020 10 20 IECD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NCc1ccc(N2CCSCC2)cc1 916236831 BCUMOSGYTZNRSK-UHFFFAOYSA-N 448.614 2.490 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(N2CCCCC2=O)c1 920195287 PDLGPFQXVCUVSN-UHFFFAOYSA-N 436.512 2.295 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 1324159783 ZUOVZXQHANUZPI-HZPDHXFCSA-N 435.521 2.034 10 20 IECD C[C@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)CC1(F)F 1790245661 XVWBOEPPJPPJCE-AVGHVZBRSA-N 444.862 2.390 10 20 IECD CC(C)c1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)co1 1799767442 RZAKXXDVDLTPMC-FVCICTRLSA-N 449.891 2.380 10 20 IECD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1 1804335899 DPYHNQHXOOXGIX-BCDXTJNWSA-N 445.610 2.426 10 20 IECD COC[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1806142952 JYWMLVRIIKLNMR-GOSISDBHSA-N 440.544 2.293 10 20 IECD O=C(Cc1cnc2ccccn12)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810548795 FYAWEDUTSMJYMJ-UHFFFAOYSA-N 449.511 2.228 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810550912 XQYCHBGGEHUKLI-MRXNPFEDSA-N 427.505 2.104 10 20 IECD O=C(CCc1ccc[nH]1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722017 APHQHJATOGKVCJ-ZDUSSCGKSA-N 427.486 2.136 10 20 IECD NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830739860 DIEZOWBOVLSVHW-MRXNPFEDSA-N 437.924 2.250 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1 1838031850 RCPNABDUBRWUQI-YWZLYKJASA-N 441.887 2.030 10 20 IECD O=C(c1n[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250034 DAYSOXRWCAVYCG-UHFFFAOYSA-N 427.848 2.153 10 20 IECD CCN(CC)[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1845838528 AXXQOECCGHJJOM-NRFANRHFSA-N 438.528 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(COC)c3)cc2F)CC1 730391882 WVEMLFPNWAEOSY-UHFFFAOYSA-N 428.508 2.369 10 20 IECD C[C@H](NC(=O)N(C)[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732885121 PMPMEGKBPDEFFU-YOEHRIQHSA-N 428.455 2.389 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](CN4CCCC4)C3)cc2F)C[C@@H](C)O1 739926970 PYSPCSRZIMUGBD-SFHLNBCPSA-N 432.584 2.473 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccnn1C1CCCC1 746786393 GMVKFLGFUBPBFO-UHFFFAOYSA-N 425.533 2.462 10 20 IECD O=C(CN1CCO[C@]2(CCc3ccccc32)C1)NCc1ccc(N2CCOCC2)c(F)c1 753271729 BULOLXJGDAHACP-RUZDIDTESA-N 439.531 2.452 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3Cc3ccccc3)CC2)cc1F 756790228 KHNFMYJROLMNOY-UHFFFAOYSA-N 437.475 2.366 10 20 IECD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916485 RHMBRIGCDHZMBV-OKZBNKHCSA-N 433.936 2.301 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cccc21 769258433 DMBIMWAAZORSJT-GOSISDBHSA-N 437.496 2.448 10 20 IECD O=C1N[C@H](c2ccccn2)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 773834851 BPUVTBSEJOHQMN-HXUWFJFHSA-N 447.474 2.130 10 20 IECD C[C@@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 775836048 XUKJOAQNVGDNMD-QGZVFWFLSA-N 446.573 2.063 10 20 IECD COc1ccc(O)c(CNCCc2ccc(OCCN3CCN(C(C)=O)CC3)cc2)c1 776162937 BZKBMQPIKORVBB-UHFFFAOYSA-N 427.545 2.276 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 776906135 PIFNQALWMIRJIM-APWZRJJASA-N 445.564 2.054 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F 783316786 MUFYSJXLOZZAQF-UHFFFAOYSA-N 425.468 2.243 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2cncn2)cc1 785398758 ONKWZNGIONSWFT-UTKZUKDTSA-N 449.511 2.358 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1OC 786122546 SPRYJQLCKCSKAF-UHFFFAOYSA-N 447.557 2.159 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccsc1)N(C)C)c1ccc(N2CCOCC2)cc1 787655245 QXTQJJMRBZJCFR-OXQOHEQNSA-N 430.574 2.181 10 20 IECD CC1CCN(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 787663948 JQALRYQWTDNMQU-UHFFFAOYSA-N 438.519 2.221 10 20 IECD NC(=O)[C@@H]1CCC[C@@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 787840522 LKWAEDVWYAVVHN-ZIAGYGMSSA-N 434.448 2.235 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789825474 MCAYCQBKUAIOBN-CALCHBBNSA-N 434.556 2.045 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC[C@@H]1CCCS1 789955628 QRXUTVXIRUMWRL-HNNXBMFYSA-N 431.480 2.170 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(CCO)c3-c3ccccc3)cc2)CC1 793927838 WZWVDEPFCUAQBC-UHFFFAOYSA-N 447.539 2.141 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@]2(CCc3ccccc32)C1)c1ccc(N2CCOCC2)cc1 803301168 NFBSZRWMTCMUSC-SIBVEZHUSA-N 449.551 2.401 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(-n2ccnn2)cc1 803310619 IHRPUOKPNWAPEA-MSOLQXFVSA-N 448.527 2.159 10 20 IECD CC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCCO1 803450665 NUOLXWQUYUQRQL-QZTJIDSGSA-N 425.476 2.447 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803661628 HXFAXWDFASANIG-ZBFHGGJFSA-N 436.528 2.270 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cccnc3)cc2F)CC1 805007916 UPSWJBXNISDBBM-OAQYLSRUSA-N 439.535 2.343 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C(=O)c4ccco4)CC3)cc2)CC1 805024064 ONJVYHFANMUXDS-UHFFFAOYSA-N 438.528 2.117 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(Cn2cncn2)c1 807386735 GVEULGUAVSEJEI-UHFFFAOYSA-N 430.262 2.049 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)c(F)c3)cc2)C1 918462616 DDCOTHOWJHAWII-CQSZACIVSA-N 432.883 2.436 10 20 IECD CC(C)S(=O)(=O)CC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919605068 PHALAUXTLFEJRW-ZDUSSCGKSA-N 443.477 2.155 10 20 IECD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920882034 KREHTDHDVZLFDB-CQSZACIVSA-N 433.486 2.326 10 20 IECD C[C@H](NC(=O)NC[C@]1(N2CCOCC2)CCSC1)c1ccc(N2CCOCC2)cc1 920920903 QPPQMQCXLCQRBD-PGRDOPGGSA-N 434.606 2.091 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1 1116646354 BOHOSJAMJOQAFX-SFHVURJKSA-N 440.427 2.292 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(Cl)cccc1S(C)(=O)=O 1320399043 MJEYQJZYXVPMIQ-ZDUSSCGKSA-N 441.889 2.059 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnn([C@H]4CCOC4)c3)n2)cc1 1322899027 QEANQQFBRZZJBH-INIZCTEOSA-N 447.542 2.405 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc(F)ccc1F 1780278418 TZGPZRAPHOLGTQ-VGOFRKELSA-N 447.438 2.212 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)c(F)c3)C[C@@H]21)c1cc(O)nc(O)c1 1787295382 KYVFNLCBFVPDKS-JDFRZJQESA-N 449.866 2.192 10 20 IECD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)n1cccc1 1813311403 MQDYTSZORRURQT-LDBYXDLTSA-N 435.484 2.270 10 20 IECD COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844399 ZXFHYWOVNBIAOM-HNNXBMFYSA-N 438.444 2.239 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCC(O)CC2)[nH]n1)c1cc(O)nc(O)c1 1817848277 BUCYGNMYDZMDQI-LDZOIKDWSA-N 429.477 2.073 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc2[nH]ncc2c1 1818997434 ZAXPMFFUYXXSSD-HNNXBMFYSA-N 448.443 2.107 10 20 IECD C[C@H](CN)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826801730 FGSUJWNFRQFPGK-VYMYXMEBSA-N 431.533 2.031 10 20 IECD O=C(c1cnn2c1CCC2)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429076 FXNFYESEISRSTB-SFHVURJKSA-N 439.516 2.183 10 20 IECD Cn1cc2cc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)ccc2n1 1845600355 WZVDHMPFWOQVCJ-VMPITWQZSA-N 448.479 2.221 10 20 IECD O=C(c1cc(Cl)cnc1O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034229 AGCYUHZNENVJIC-HWKANZROSA-N 445.859 2.088 10 20 IECD C[C@@H](Cc1ccccn1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037537 RYXRTLXKEBTWIP-DYLHUKMJSA-N 437.496 2.294 10 20 IECD O=C(c1cc(O)ccc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038223 IDEIMTNUESVPSU-XVNBXDOJSA-N 428.416 2.179 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 729787378 WLLKUXAGBQNONG-UHFFFAOYSA-N 443.475 2.023 10 20 IECD COC(=O)N[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 733554437 RIWLSIOHSOOEJW-IBGZPJMESA-N 438.436 2.324 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OC)c(N3CCCCC3=O)c2)c1 734072601 JDZNCRNCBCPMSL-UHFFFAOYSA-N 427.457 2.181 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 742049914 HXMFPOSAMNPFIJ-INIZCTEOSA-N 435.594 2.207 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C[C@@H]2CCOC2)CC1 749852431 FSUPMOSWTUYMIO-MSOLQXFVSA-N 447.535 2.443 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3scnc3Br)nc12 754965216 MIISZLHDWXBMIK-UHFFFAOYSA-N 427.236 2.188 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])cc1F 755093681 VXCPUTLXWBEZCB-AWEZNQCLSA-N 435.477 2.389 10 20 IECD C[C@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc([N+](=O)[O-])ccc1O 756712964 RKAPUAKBGYCSTI-JKSUJKDBSA-N 428.493 2.247 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc(OC)c1OC 759101800 KBHIZGPUSMZEJH-UHFFFAOYSA-N 427.910 2.272 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C[C@H](CO)Oc4ccccc43)cc2F)C[C@@H](C)O1 759746040 AVDKFHXPEXCZNE-ZHALLVOQSA-N 443.519 2.315 10 20 IECD CC(C)N1CCC(N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)CC1 771215814 ZKANJQCGLJAOIC-UHFFFAOYSA-N 429.609 2.223 10 20 IECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OC)c1 773756656 LVTAOYYYPVFTRZ-KSSFIOAISA-N 428.485 2.467 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 774767441 RJNNJTMQJKZYQD-NRFANRHFSA-N 426.586 2.275 10 20 IECD C[C@H](NCC(=O)N(CCC(N)=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 775254032 GAQWTUHIWKAUCX-KRWDZBQOSA-N 428.508 2.222 10 20 IECD O=S(=O)([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCc2ccccc21 779869304 MARAQXYKJIJRQJ-DYESRHJHSA-N 430.526 2.175 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nnn(-c4cccc(C)c4)c3C)cc2)CC1 786254622 FUDNYAQMYYOBQK-UHFFFAOYSA-N 432.528 2.483 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@H]3c3cc(OC)ccc3OC)nc12 788197936 VPDQLKUMUMKKJN-HOCLYGCPSA-N 441.440 2.476 10 20 IECD CC1CCN(C[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)CC1 788312579 JKOYTLKXPPBTBF-JOCHJYFZSA-N 442.604 2.110 10 20 IECD CSc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789835711 QIXLBDXQCRSUSE-UHFFFAOYSA-N 445.560 2.484 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(OC)cc3O)CC2)cc1 794388277 UPBOESMFLXKQPF-UHFFFAOYSA-N 434.514 2.127 10 20 IECD CC[C@H](C)[C@H](NC(C)=O)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803945170 VNBRVSZYTKAQNC-ZSEKCTLFSA-N 436.464 2.495 10 20 IECD Cc1nc2c(s1)[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)CCC2 807643564 BMWZSEZGQICAQX-IBGZPJMESA-N 428.558 2.440 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCNC4=O)cc2F)C[C@H](C)O1 809982146 JSTQESPJEOTXIU-HOTGVXAUSA-N 441.503 2.420 10 20 IECD Cc1ncc2n1CC[C@H](C(=O)NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)C2 810191538 AXYSVLWEOUDKDK-IBGZPJMESA-N 449.534 2.326 10 20 IECD CCCCN(C)C(=O)C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 917068237 MGVHPUGWSMDNMN-UHFFFAOYSA-N 448.583 2.249 10 20 IECD COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)CC3 919812259 XVYIIKQLSGXFBV-UHFFFAOYSA-N 443.481 2.230 10 20 IECD CNS(=O)(=O)c1ccc(Br)c(C(=O)NCc2cccc(OC)c2O)c1 1318563158 DPCGPJIYNRQQIR-UHFFFAOYSA-N 429.292 2.001 10 20 IECD CCc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004443 FGFTYZXYPXYEDH-QFIPXVFZSA-N 445.903 2.466 10 20 IECD Cc1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243277 BYACSRIJGJGZKQ-AXHNFQJDSA-N 445.903 2.362 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H]2CCCO2)C3)cc1 1799620712 SLVZHPTVFPNHBI-IRMYBRCSSA-N 437.540 2.476 10 20 IECD Cn1ccc(C(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)n1 1808435066 LXOJJVMOPKYPGG-UHFFFAOYSA-N 448.527 2.058 10 20 IECD Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c(O)n1 1810547177 RTZIIGVXTOIIQJ-UHFFFAOYSA-N 426.473 2.060 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814186001 WKAXITFREPRNLH-YYFZDKIDSA-N 448.614 2.384 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc(-c3cnccn3)c2)C1 1844732987 UHSSOIFKIXJIAM-UHFFFAOYSA-N 431.452 2.081 10 20 IECD CN1CCN(c2cc(N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ncn2)CC1=O 302550531 IAUWESAFZDDFPC-HNNXBMFYSA-N 432.475 2.437 10 20 IECD CC(C)C(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 726234710 KSRYVGUSUCFIEO-GOSISDBHSA-N 434.556 2.481 10 20 IECD CCOCc1cccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 726722750 KNIPZAIKYPAZTP-UHFFFAOYSA-N 440.544 2.109 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)ccc21 728640841 ZMCYQXRVKHGMHU-WMZOPIPTSA-N 429.517 2.174 10 20 IECD CC(C)[C@@](C)(O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732886763 VNYLFJSQBRAJEH-QFIPXVFZSA-N 430.528 2.149 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1nnc2ccccn12 735569220 QCKLDYFHJSXZNI-UHFFFAOYSA-N 447.478 2.307 10 20 IECD CCc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1S(N)(=O)=O 737136122 FBSXTDAGNPFONE-UHFFFAOYSA-N 444.557 2.092 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccccc1N1CCCC1=O 738887619 JRXXQEXDTCYTOJ-UHFFFAOYSA-N 442.541 2.370 10 20 IECD C[C@@]1(C2CC2)NC(=O)N(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801443 ZJUYTGTYLMOTHQ-QKKBWIMNSA-N 436.459 2.094 10 20 IECD Cc1cc(C(=O)CN2CCN(CC[S@](C)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 746468538 OWECSONQVSWVJM-HKBQPEDESA-N 445.585 2.044 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1=O 754464097 GWWWUISWYJUIMH-KRWDZBQOSA-N 429.473 2.330 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](c4nccn4C)C3)CC2)cc1 756662658 WXBYGRVDCPHYMU-IBGZPJMESA-N 426.565 2.140 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@H](C)S(=O)(=O)CC2)c([N+](=O)[O-])c1Br 758224242 AOHFGROLHPWQBZ-QMMMGPOBSA-N 438.256 2.288 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 759496434 HBWIQQRAGWSEDV-UHFFFAOYSA-N 435.521 2.424 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 762642122 YRMNDELASRZEIF-GDLZYMKVSA-N 431.583 2.373 10 20 IECD C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 766972811 LUAYGAPMQUERAN-LLVKDONJSA-N 448.391 2.288 10 20 IECD CN(Cc1ccccc1O)C(=O)c1cc(I)ccc1-n1cnnn1 769281484 FYIIYAIUMHWDJP-UHFFFAOYSA-N 435.225 2.245 10 20 IECD O=C(Nc1ccc(-n2cncn2)nc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769664304 NDTWKXVRLVABRM-UHFFFAOYSA-N 442.482 2.483 10 20 IECD O=C1CNC(=O)N1Cc1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771881430 LWWJFHLLVOJFNS-UHFFFAOYSA-N 428.832 2.066 10 20 IECD CC(C)(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 772257283 ROIGXTLWVJOJIK-UHFFFAOYSA-N 438.576 2.425 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O 773769191 QLXYUCKIRNOOME-FIKIJFGZSA-N 449.866 2.405 10 20 IECD CCO[C@@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 780417886 YTTTUPVIRRIHFQ-NFBKMPQASA-N 436.572 2.333 10 20 IECD COCCN(C(=O)CN(Cc1ccccc1)c1ccc(OC)cc1)[C@H]1CCS(=O)(=O)C1 781307207 KSPIFPYFLDVWEE-NRFANRHFSA-N 446.569 2.364 10 20 IECD COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NCc1cc(OC)ccc1O 781517963 JUYNZTJLSCQIDQ-UHFFFAOYSA-N 437.246 2.205 10 20 IECD O=C(COC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl)c1ccc(O)c(O)c1 783728767 GVFYTXBFKVULKV-UHFFFAOYSA-N 425.846 2.331 10 20 IECD C[C@H](OCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 785565553 ZDBNYLSNDFYOLI-IBGZPJMESA-N 425.529 2.424 10 20 IECD O=C(COC(=O)c1coc(C2CCOCC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 786723984 OKILLWXSNHVHGP-UHFFFAOYSA-N 447.463 2.018 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cnn(Cc4ccccc4)c3)CC2)cc1 788827202 JYYYIMWTRURJSY-UHFFFAOYSA-N 447.539 2.341 10 20 IECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C12CCCC2 789802483 ZBQBRTUQSVUMFS-UXHICEINSA-N 433.524 2.133 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cc([C@@H]4CCCOC4)nn3C)CC2)cc1 790539879 TUQHXBBJGIQRKF-GOSISDBHSA-N 442.564 2.266 10 20 IECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 795053205 PWSMFTUJWWKSQF-UHFFFAOYSA-N 431.464 2.186 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc4nn[nH]c34)cc2F)C[C@H](C)O1 800205630 LIMWFGGCEVMNJH-KBPBESRZSA-N 441.463 2.184 10 20 IECD COCCN(Cc1ccccc1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803307159 XROIMDYKMWWSRS-IBGZPJMESA-N 425.529 2.376 10 20 IECD CCOC(=O)c1sc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)nc1C 803662564 XYUISRGYBUPOEC-GFCCVEGCSA-N 436.509 2.327 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1)C1CCCCC1 803676604 ARPXVDXPENYDEF-VXKWHMMOSA-N 428.577 2.051 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCCC[C@H]3C(C)C)CC2)cc1 803747856 VGYPOWZGVDYBQR-FCHUYYIVSA-N 430.593 2.264 10 20 IECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 806386962 SEMSEGVEWZIXFC-INIZCTEOSA-N 439.560 2.317 10 20 IECD CC(C)[C@@H]1CN(C)CCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768640 NNFPHFFBBFKURW-LPHOPBHVSA-N 438.519 2.172 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808816402 QJBFZVQSNCEPHA-SFHVURJKSA-N 431.558 2.080 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1nc(CN2CCOCC2)cs1 916670710 GPJLWUXXMOGHBW-UHFFFAOYSA-N 435.525 2.273 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(N4CCNC4=O)c3)cc2)C1 918035929 OTPOKDGZOBFAEF-KRWDZBQOSA-N 436.516 2.240 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2ccc(O)cc2)CC1 918224249 PHUMTYJURGJHMB-UHFFFAOYSA-N 442.491 2.036 10 20 IECD C[C@H](OC(=O)c1ccc(=O)n(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919203879 GXCFDWNHTFQQKW-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 919860361 WAYYDXNADKUKCX-RTWAWAEBSA-N 443.544 2.121 10 20 IECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3cn[nH]c3)cc2)cc1[N+](=O)[O-] 919954608 NHCZVPLEHWBKEY-UHFFFAOYSA-N 437.459 2.228 10 20 IECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(F)(F)C(F)F)C3)=NN1c1ccccc1 1796930853 FSCNICKSXPEMQU-UBSAEIQESA-N 440.397 2.318 10 20 IECD Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991229 OCKPSYYJKMCUNS-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnccc3F)sc2C1)c1cc(O)nc(O)c1 1815964405 DBILMFXEGJZGJY-SNVBAGLBSA-N 429.433 2.023 10 20 IECD CN(C)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823475389 SIFOPXYRQOJYMC-MNDMWVCDSA-N 443.504 2.184 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)on1 1844814220 UMKXHJWCUAIINW-FNORWQNLSA-N 427.457 2.445 10 20 IECD CC(C)(Cc1ccccc1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847050872 KRRVICAOXBXZDB-UHFFFAOYSA-N 445.610 2.319 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)c(OC)c(C)c3)CC2)cc1 56966095 VFVSEFRFVABROO-UHFFFAOYSA-N 433.574 2.421 10 20 IECD COc1ccc(N2CCN(C(=O)CN(Cc3nc4ccccc4c(=O)[nH]3)C(C)C)CC2)cc1 105222346 WERXVEDXVUFQKJ-UHFFFAOYSA-N 449.555 2.491 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)cc2)CC1 729064961 XAFQBDACQGNAJS-QGZVFWFLSA-N 440.544 2.354 10 20 IECD COc1cccc(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(C(C)=O)cc2)c1O 729861500 PXJKAZHDIURAFG-UHFFFAOYSA-N 434.514 2.321 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(c4cc(F)ccc4F)=NO3)CC2)cc1 732656046 POYHTFRCXIILGG-JOCHJYFZSA-N 444.482 2.405 10 20 IECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 741099531 CUSTUZGVDJYZFU-QZTJIDSGSA-N 435.528 2.326 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](CN2CCOCC2)C1 741811011 XCBSGYCLYBOFCP-MSOLQXFVSA-N 447.535 2.443 10 20 IECD Cc1cncc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 745508735 GUPOYEULUJRRPG-UHFFFAOYSA-N 427.482 2.485 10 20 IECD CC(C)CCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 746364111 NUPPXCCPYOWCTH-UHFFFAOYSA-N 427.549 2.393 10 20 IECD CCN1CC[C@H](CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 746685920 LJFXCLTUOHGBBH-CQSZACIVSA-N 448.501 2.173 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(NC(N)=O)cc1 749343753 HDFIAVKJBHTGPU-YJBOKZPZSA-N 438.532 2.439 10 20 IECD Cc1cc(C(=O)COC(=O)CC[C@H]2CCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 751708850 JOLKLEGXBHLLDH-INIZCTEOSA-N 434.514 2.284 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 754067052 NKEGVQONSLYBQJ-CTNGQTDRSA-N 438.572 2.297 10 20 IECD CC(=O)N1CC[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 755295197 XSKLFAFQWTYDAU-CQSZACIVSA-N 437.543 2.195 10 20 IECD CN(CC(=O)N1CCCc2cc(S(=O)(=O)N(C)C)ccc21)c1ccc2c(c1)OCO2 756644650 LFEMPSUGIRCBMG-UHFFFAOYSA-N 431.514 2.081 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1cn[nH]c1 757926588 ZMCCPHBQWVUJCS-NSHDSACASA-N 431.430 2.315 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)OCC(F)(F)F)CC2)cc(OC)c1OC 759223031 PKEVRBGXJGFLFR-UHFFFAOYSA-N 449.426 2.040 10 20 IECD CC[C@H](c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CCN1CCOCC1)N(C)C 764451986 NMFJFVXMMQDABU-MRXNPFEDSA-N 449.577 2.009 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(N(C)C)cc1 774809215 OHZVPQVBGHMSDA-APWZRJJASA-N 430.574 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccccc3Cn3cncn3)CC2)cc1 778247990 ZJALWQNQCQDMGS-ZHACJKMWSA-N 446.511 2.179 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 783317503 VSPPRDSYWPREFQ-UHFFFAOYSA-N 446.573 2.345 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 788281089 RFFBUCZMBJIFFU-SFHVURJKSA-N 428.533 2.195 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N(Cc1ccco1)C[C@@H]1CCCO1 789801826 VOGVQXBYJMQYMI-IBGZPJMESA-N 445.491 2.079 10 20 IECD CC[C@H]1CO[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949765 KMIYKNMUBCFZPD-HOCLYGCPSA-N 443.466 2.184 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3(NC(=O)NC(C)C)CCCCC3)cc2)CC1 792480562 ZIVXYIUMTNHLBB-UHFFFAOYSA-N 443.592 2.382 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]2CCCC[C@@H]12 793735884 ZGXOGQBNHSNBFN-GKBFQHABSA-N 426.561 2.042 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1OC 793914226 NWSKMSQJHKOYHG-UHFFFAOYSA-N 429.517 2.062 10 20 IECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)NCCF 800183749 HPYUEDVUQQBJQQ-BVRAVYJCSA-N 429.564 2.320 10 20 IECD COc1cc(N2CCN(CN3C(=O)N[C@](C)(C4CCCC4)C3=O)CC2)cc(OC)c1OC 802738245 LYCLXGUNOMITAV-HSZRJFAPSA-N 446.548 2.293 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(N2CCOCC2)cc1 803304609 GDEPJKPXEDGMRJ-VGSWGCGISA-N 441.503 2.440 10 20 IECD Cc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 803305696 OFWCGAUZARODGJ-HXUWFJFHSA-N 436.556 2.358 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCC3CCN(CC(F)(F)F)CC3)ccc21 803686982 SJVFBYSDAUYZIQ-UHFFFAOYSA-N 440.510 2.466 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC(C)(C)[C@@H]3CCCCO3)cc2F)CC1 805007569 MFFGLWQFEDPSHF-NRFANRHFSA-N 448.583 2.295 10 20 IECD CCN1CCO[C@H](C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 805473117 KGIKSJXYCWPLDA-XOBRGWDASA-N 436.464 2.053 10 20 IECD CNC(=O)c1cccc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 915328549 GKEKONRMCHFZMN-UHFFFAOYSA-N 425.533 2.389 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccc(Cl)cc2)nn1 1116669713 WNKITNMUEZMKJL-HNNXBMFYSA-N 430.848 2.236 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc(C)ncc3Br)CC2)cc1 1320734799 DQRPRQAKQQNLJX-UHFFFAOYSA-N 449.305 2.062 10 20 IECD CCOc1ccnc(N2CCCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1323330286 HFRIAIRCTPMYSU-UHFFFAOYSA-N 428.556 2.479 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(N4CCNC4=O)c3)CC2)cc1 1323722178 NXVAUSOHODYMRB-UHFFFAOYSA-N 437.544 2.167 10 20 IECD COCCS(=O)(=O)c1ccc(CNCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1324592822 RBJWTBSBZXTACO-UHFFFAOYSA-N 435.565 2.287 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245024 MVKJCYRSDVMRDK-BNLOLNQZSA-N 449.866 2.192 10 20 IECD CC(C)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1810433132 LOWHAGSJODTOFF-IIMJZQEZSA-N 428.489 2.021 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817843833 CWGKSYNWJDPWEB-CYBMUJFWSA-N 443.439 2.260 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C(O)O)[nH]n2)cc1 1821155922 LMEWSYRQPHNXQI-LJQANCHMSA-N 437.500 2.434 10 20 IECD NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821954091 SGUJKYVKCARDLC-CYBMUJFWSA-N 435.868 2.046 10 20 IECD Cn1cc2cc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)ccc2n1 1847039304 CQIGKYCUDWKRPW-VMPITWQZSA-N 448.479 2.221 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC3CCN(CC(F)(F)F)CC3)CC2)cc1 726247923 LBYBSONJPUCYKC-UHFFFAOYSA-N 443.514 2.143 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1 729062484 BYSSRGMUOVEBFW-CYBMUJFWSA-N 449.529 2.294 10 20 IECD CC(=O)N1CCC(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 729661723 KQJCMNYQPXSGJX-UHFFFAOYSA-N 435.436 2.359 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 734074588 UKKOTNNNCMZKND-UHFFFAOYSA-N 438.528 2.188 10 20 IECD COC(=O)NCc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738947807 IVLXLFILLPOZLI-UHFFFAOYSA-N 446.529 2.099 10 20 IECD CCN1CCC(N(C)CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 740874547 OLWISOYIVVPCAO-UHFFFAOYSA-N 432.590 2.340 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CNC(=O)c3cccc(Cl)c3)CC2)cc1 742948303 QPKMDNWJHHHRST-UHFFFAOYSA-N 430.936 2.017 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc(OC)c(O)c3)CC2)cc1 743363531 SQKXKTNMESHIPR-UHFFFAOYSA-N 428.533 2.373 10 20 IECD COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 744474051 NZRURKYUKDVFTO-CQSZACIVSA-N 449.459 2.419 10 20 IECD NC(=O)CC[C@H](C(=O)NCc1ccc(N2CCCCC2)cc1)N1C(=O)c2ccccc2C1=O 746172750 OMMOFPIAZAPLSK-OAQYLSRUSA-N 448.523 2.223 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 747402359 AVSJBWWVIZKRQC-WMZHIEFXSA-N 426.561 2.109 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)o1 748640006 KOPMGRZBFRRFFV-UHFFFAOYSA-N 432.476 2.027 10 20 IECD COc1ccc(N(C)CCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(OC)c1 752121249 AFZGFWBCXSEAHV-UHFFFAOYSA-N 436.530 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC([C@@H]4CCOC4)CC3)CC2)cc1 752998210 ALNGDSNLMVTYBC-ROUKRRSUSA-N 427.545 2.175 10 20 IECD CC1=CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)CC1 756632916 DBVWLKXFPPJSKN-WOJGMQOQSA-N 445.566 2.385 10 20 IECD CC(C)(C)OC(=O)N1CCOC[C@@H]1c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 758297374 WLPVKNKWXOGJBV-CYBMUJFWSA-N 440.478 2.122 10 20 IECD CS(=O)(=O)c1ccc(OCCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 761256262 MRVKMFFRPQXJGE-UHFFFAOYSA-N 438.889 2.292 10 20 IECD CCOC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 766113011 NGXVHPRWQXECEA-ZHALLVOQSA-N 435.540 2.331 10 20 IECD C[C@@H]1[C@@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 771395038 JQTMQNWNZJTNAK-ZIAGYGMSSA-N 448.501 2.266 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSC4(CCOCC4)C3)CC2)cc1 771581410 XRYSVZULBPRVQH-SREVYHEPSA-N 445.585 2.025 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1O 772481819 WYHPTARTKINQHF-IBGZPJMESA-N 449.511 2.299 10 20 IECD COC(=O)COc1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 772903546 FSTKABBKVSMPNT-UHFFFAOYSA-N 445.491 2.251 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](c3ccccc3)C3CC3)cc2)C1 774388250 LWDFEJSNVZRGGG-IFMALSPDSA-N 434.540 2.272 10 20 IECD C[S@](=O)CCN1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775716774 FWCQBZMHLHGXGP-NRFANRHFSA-N 440.201 2.413 10 20 IECD CCC[C@]1(C)C(=O)NCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 782661094 HVRUSVBMIAQRDP-HKARXFIJSA-N 434.556 2.046 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1 784553041 BZKNTMSPEBHWGA-SFHVURJKSA-N 445.560 2.172 10 20 IECD CN1CCC(N2CCC(CCN(C)C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 785432640 GIJPVVAEWKJFEE-UHFFFAOYSA-N 443.636 2.024 10 20 IECD CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786257130 NEBPZPPJEQMXRX-UHFFFAOYSA-N 443.569 2.251 10 20 IECD COc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 787869388 DBDRFEMJEQZJRT-SFHVURJKSA-N 425.529 2.286 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@H](c2ccccc2Cl)C1 788319532 LLHANLGMXOSRBD-NRFANRHFSA-N 443.931 2.393 10 20 IECD CSCc1cc(F)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788322533 HSPVMGNSYYKCTO-UHFFFAOYSA-N 431.533 2.458 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 789863859 KGDOTPSYRUUKHX-UHFFFAOYSA-N 428.558 2.356 10 20 IECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)c(O)c1 794388119 PTWCUTWPHCLIKH-UHFFFAOYSA-N 439.921 2.166 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1F 796789236 ZHFHHIXDBJFODX-UHFFFAOYSA-N 447.438 2.484 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2cnn(C)c2)n1C[C@@H]1CCOC1 802761739 URSNNBGMKLKFCP-IBGZPJMESA-N 437.548 2.188 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(N3CCSCC3)CCCCC2)cc1F 803664187 HBVHXJMNJBZTEC-UHFFFAOYSA-N 436.597 2.376 10 20 IECD CCN(CCc1cccs1)C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803747977 YPGCXMHRPDLTLJ-UHFFFAOYSA-N 444.601 2.086 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCNC(=O)C(C)(C)C)cc2Cl)C1 804098381 VCFJTTRYATVHOP-HNNXBMFYSA-N 436.984 2.471 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1 804948770 KCNSIIZCFMQZBL-UHFFFAOYSA-N 437.587 2.454 10 20 IECD CCC[C@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805010112 URGYXBWSFGPKRY-XMMPIXPASA-N 448.583 2.392 10 20 IECD CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806494135 LPPZQONXQXKURV-ICSRJNTNSA-N 445.564 2.199 10 20 IECD O=C(N[C@@H]1CCO[C@H](C2CC2)C1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771575 VXYGRNLRNKEYHI-MDZRGWNJSA-N 437.487 2.447 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)CC3(C(=O)OC)CCCC3)cc2F)CC1 809815291 DWQNDIOCFZNHDR-UHFFFAOYSA-N 441.569 2.120 10 20 IECD COc1cc(/C=C2\SC(=S)N(C3CC3)C2=O)ccc1OCC(=O)N1CCOCC1 814285675 ZRLKOTYIOJNHSJ-BOPFTXTBSA-N 434.539 2.296 10 20 IECD O=S(=O)(CCNCc1ccc2ccccc2c1O)N1CCN(c2ccccn2)CC1 816535561 SLCXBAQOKXUYMC-UHFFFAOYSA-N 426.542 2.182 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)c1 919824007 IFWVDDPZFJLQKA-UHFFFAOYSA-N 438.550 2.000 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(c4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 1318570652 LZQSEUVESDRQHM-JZXOWHBKSA-N 430.528 2.251 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cc(F)c[nH]1 1791118032 MRKYRLJKIPYBTN-SVKFGRERSA-N 437.855 2.126 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1 1798723157 GDBKSDXUCQJPQV-AKNOBNDCSA-N 427.432 2.303 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846239 MIQRRGQSLSOVON-CQSZACIVSA-N 425.449 2.176 10 20 IECD COc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1821918068 NDYJUXOHWAPJPR-GFCCVEGCSA-N 440.481 2.498 10 20 IECD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1827423743 FBOUALZCVABWHH-YJBOKZPZSA-N 427.505 2.184 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC=CCC3)CC2)CC1)c1cc(O)nc(O)c1 1834987493 WIGJCPIHCUNSLJ-INIZCTEOSA-N 428.533 2.034 10 20 IECD O=C(c1cn2ccsc2n1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441760 ORCPTDKXOAELBZ-UHFFFAOYSA-N 448.508 2.006 10 20 IECD CCOc1ncc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1844518931 JUYXRWNUUUCKEY-UHFFFAOYSA-N 432.864 2.071 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnc3snnc3c2)C1 1844677871 KUHLQTKPIOHDIB-UHFFFAOYSA-N 445.888 2.282 10 20 IECD CC[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1)N(CC)CC 1847871428 AMXCUGHSNCKXQA-HKBOAZHASA-N 439.560 2.102 10 20 IECD COc1ccc(OC)c(CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c1 302743066 CGDYKAXHKYLNEJ-UHFFFAOYSA-N 426.561 2.204 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CC(c2cc(F)ccc2F)=NO1 732657546 YAYVYTGXSARDDE-HXUWFJFHSA-N 449.479 2.009 10 20 IECD CN(Cc1cc[nH]n1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 732678236 XWOFMLAZVMIDPH-UHFFFAOYSA-N 431.430 2.097 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(-c3cccc(Cl)c3)no2)c1 734178476 YSAWXLPSEYDSOE-UHFFFAOYSA-N 436.877 2.440 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1 737117085 IKPVGNNOYHLULZ-UHFFFAOYSA-N 446.573 2.394 10 20 IECD CC(C)[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCC1 741012201 KWZKRHVTYQDSJW-JOCHJYFZSA-N 435.540 2.332 10 20 IECD CN(C)c1ccc(CNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1F 746889672 CYRSHIQYVPHMTH-QGZVFWFLSA-N 435.521 2.279 10 20 IECD CC(C)(C)OC(=O)N1CC(OCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 748544962 NWDRIXGWTPNXMD-UHFFFAOYSA-N 433.549 2.147 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c(=O)n(C)c1=O 748706852 NDDLBRPOQUPKEW-UHFFFAOYSA-N 447.325 2.315 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(Cl)cc4)n3)CC2)cc1F 753741524 JANLBRGQJTULFS-UHFFFAOYSA-N 430.871 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccnc(N4CCOCC4)c3)CC2)cc1F 753834078 PHRWMCYONGWTGG-UHFFFAOYSA-N 429.496 2.098 10 20 IECD CCn1cc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])n1 754814937 MAELIVHZKAOIBR-LBPRGKRZSA-N 445.448 2.360 10 20 IECD COC(=O)[C@]1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCOC1 755626553 OKLMQORRHFJHIJ-GFBZKKKVSA-N 440.568 2.178 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc(F)c1F 756161840 RBLQSUAZGWUXLQ-UHFFFAOYSA-N 426.441 2.067 10 20 IECD COc1cc(N2CCN([C@H]3CC(=O)N(c4ccc(C)cc4)C3=O)CC2)cc(OC)c1OC 758818270 DFPUOAQJASSKGI-IBGZPJMESA-N 439.512 2.475 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc4sc(C)cn4c3=O)CC2)cc(OC)c1OC 760084086 JPLANDHMOIXPJW-UHFFFAOYSA-N 444.513 2.053 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C(=O)[C@@H]2C1 761635103 HXEMMHVBWBRCEN-KMFMINBZSA-N 437.443 2.473 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1F)NCc1cccc(Br)c1O 765726498 HFWRNCDHOPJYRW-UHFFFAOYSA-N 431.283 2.279 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C 769496293 CITIKFRHEPTENM-UHFFFAOYSA-N 425.489 2.135 10 20 IECD Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 769974053 SJXNTNUWMOPVJL-FXAWDEMLSA-N 431.512 2.051 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(Br)cn1)c1ccc(N2CCOCC2)cc1 772991807 WBSDEQBWZUXYNF-ZDUSSCGKSA-N 433.306 2.497 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775202903 QEDGQBUPGYFTIW-SFHVURJKSA-N 433.530 2.239 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc4c(c3)COCC4)cc2F)C[C@H](C)O1 777238138 PSIBBODZBXFQHH-GJZGRUSLSA-N 442.491 2.162 10 20 IECD Cc1ccnc2c(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)cccc12 777624949 UYMXYMMOAQYCPY-UHFFFAOYSA-N 435.483 2.414 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@H](C(C)C)C3)CC2)cc1 785528176 OBUIJXBOIOTORN-FQEVSTJZSA-N 430.593 2.218 10 20 IECD CCOCCCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H](C)C1 788911476 OAQVZUZEMLYCMM-KNQAVFIVSA-N 430.593 2.156 10 20 IECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H](c2ccccc2)C1 789845059 JMMBZFNYQCVPNT-JOCHJYFZSA-N 438.597 2.371 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](CS(C)(=O)=O)C1 795091322 STERBKIHLMSSDI-CABCVRRESA-N 440.521 2.156 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)c(O)c1 797387903 QMFOEHSCRJTOTQ-UHFFFAOYSA-N 439.390 2.256 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2ccc(S(C)(=O)=O)cc2)cc1F 804851582 HTVDRVGJSCVCBI-UHFFFAOYSA-N 449.548 2.350 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3COC4(CCC(C)CC4)O3)CC2)cc1 806702795 DREAROKAQHWTQY-RUPGZQMFSA-N 445.560 2.172 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C 807246652 NQBWJBVCICPENR-FPOVZHCZSA-N 431.577 2.439 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CC(N)=O)C3)cc2Cl)C1 807955666 ABFKEIFNXKVFGW-NVXWUHKLSA-N 434.968 2.307 10 20 IECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)n2C 808810513 QCTOCIWZSQSOIY-GOSISDBHSA-N 436.512 2.411 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)Nc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 915877615 XSWPIXQXCKSTLU-KRWDZBQOSA-N 446.573 2.095 10 20 IECD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919840576 RQRPKVAIOJESQE-UHFFFAOYSA-N 444.513 2.091 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1 920482287 MANGAPSPLUOMQT-UHFFFAOYSA-N 440.547 2.203 10 20 IECD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 976858568 WWOWCPXVQMTWIQ-YDWBTVLJSA-N 425.489 2.430 10 20 IECD CC(=O)N1Cc2ccc(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C1 1116328543 AUGXMZKGOHZHSP-UHFFFAOYSA-N 426.492 2.253 10 20 IECD Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782004332 BQMXVRRWJYZSBX-JOCHJYFZSA-N 445.903 2.141 10 20 IECD Cc1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796932485 DNFAEJQJQUQACS-FNLKRUPLSA-N 431.496 2.435 10 20 IECD Cc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1801771280 WEDPIACYVBROPN-BCDXTJNWSA-N 445.610 2.426 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998208 JMDYXFPGVLJHMX-JTSKRJEESA-N 436.468 2.433 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2ccc(F)nc2)C1 1842007685 ULCDLHNUWQFPLQ-UHFFFAOYSA-N 449.486 2.150 10 20 IECD O=C([C@@H]1COc2ccccc2O1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500773 NFQVRWWUVRHUQT-SFHVURJKSA-N 444.871 2.408 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C(F)(F)c2ccco2)C1 1845794599 RKDOGNQFZAUOJY-UHFFFAOYSA-N 442.422 2.368 10 20 IECD O=C(c1cccc2c1OCC2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037272 HPHPTZJQIXEIFU-SOFGYWHQSA-N 436.464 2.269 10 20 IECD COc1ccc(OCCC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 23472439 QAUOLCPFYNKRJN-UHFFFAOYSA-N 428.485 2.365 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)cc1 71958408 SFIWXWJPYUEBQZ-UHFFFAOYSA-N 433.556 2.237 10 20 IECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)c1ccc(-n2cnnn2)cc1 727244077 RXPRRLLSHZXRSH-UHFFFAOYSA-N 442.482 2.358 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1 729536228 XLTOVGAPZVOHFE-XJLYFKRHSA-N 437.496 2.381 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCc1ccc(S(=O)(=O)NCCOC)cc1 731280688 AVNBXYQVAOWRAU-UHFFFAOYSA-N 435.546 2.439 10 20 IECD Cc1nc(S(=O)(=O)N2CCC(C(=O)NCc3c(O)ccc4c3CCCC4)CC2)cn1C 743719029 WQDSMPQELNKQIG-UHFFFAOYSA-N 446.573 2.030 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO 747579299 CFHXHKPLZFHOLW-VWNXMTODSA-N 438.572 2.205 10 20 IECD COc1ccc(N(C)CC(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)cc1F 747660767 VPDIHEMVLJEBKB-UHFFFAOYSA-N 432.471 2.193 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cnn(C3CCOCC3)c2)cc1 749772777 PGQGZYMRYNHEDD-UHFFFAOYSA-N 430.534 2.346 10 20 IECD CCC(=O)N1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751062363 DSKDUQBVEDIXNP-UHFFFAOYSA-N 437.543 2.339 10 20 IECD COC(=O)[C@@H]1COCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 752346965 MKRHLCGYJCDHQQ-ODUNQGDFSA-N 440.568 2.130 10 20 IECD COC(=O)C1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 753297409 IGOOJLMXZJLELP-KHPPLWFESA-N 443.544 2.140 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cn(Cc2cccc(F)c2)nn1 759441725 HFNNPWLSZYBEQV-UHFFFAOYSA-N 425.464 2.347 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1F 759511413 KYHVUGSIYWKBRK-UHFFFAOYSA-N 431.489 2.001 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1 764933106 UYCRCFYLVNVLDZ-UHFFFAOYSA-N 435.527 2.084 10 20 IECD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCc1c(O)ccc2c1CCCC2 769562677 KXEMPFUPSSCKRN-UHFFFAOYSA-N 433.486 2.164 10 20 IECD CN(C)C(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769616946 ZYNHHCDYYSRQIG-UHFFFAOYSA-N 436.490 2.171 10 20 IECD CN1CCN(c2ccc(-c3nc4c(c(O)nc(=O)n4Cc4ccccc4)n3C)cc2)CC1 771515149 XPKVBPIVHHFAQU-UHFFFAOYSA-N 430.512 2.303 10 20 IECD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 771621636 DDQBKCDHFJMMJR-QGZVFWFLSA-N 437.562 2.312 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)cc1 777856716 DZIBXVAMXKLJMJ-UHFFFAOYSA-N 434.474 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccnc3OC(C)C)CC2)cc1 778236631 YTEPCIATHBRDAH-ZHACJKMWSA-N 438.528 2.399 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781458433 RFCSBPNHQXDHAO-AWEZNQCLSA-N 429.448 2.265 10 20 IECD C[C@H](OC(=O)C(C)(C)S(C)(=O)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785990805 CJDYZGHKUVENAV-LBPRGKRZSA-N 443.477 2.155 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCCC3CCCC3)cc2)C1 793722688 VTEVHPCBUHHKRR-HXUWFJFHSA-N 428.577 2.481 10 20 IECD O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NCc1ccc(N2CCCCC2)cc1 795766573 BPFGUAHTEVDSLS-UHFFFAOYSA-N 427.530 2.148 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 801599721 APMBZDQPJSYFKA-JOCHJYFZSA-N 428.533 2.261 10 20 IECD C[C@@](O)(C1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1)C(F)(F)F 806278134 NLYIBEDDPSKHCE-OAHLLOKOSA-N 425.498 2.293 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCCCSc2nccs2)C1 806282048 GHYPHGQXTGREDO-KGLIPLIRSA-N 428.580 2.115 10 20 IECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290214 FCQRVEZIYUALEB-UHFFFAOYSA-N 431.496 2.377 10 20 IECD COc1ccc(N2CCCN(c3nnc(-c4nn(C)c(=O)c5ccccc45)n3C)CC2)cc1 809865578 QWHOOPVRMATDGR-UHFFFAOYSA-N 445.527 2.454 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1F 810351383 LILUZJHZIFJRFS-UHFFFAOYSA-N 447.438 2.185 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(c4ccccc4)C3=O)cc2)C1 814587902 DCWLZNYLQZOJAC-KNQAVFIVSA-N 434.540 2.448 10 20 IECD CCN1CCN(Cc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc2)CC1 918305112 BHHJLBJCHWYPND-UHFFFAOYSA-N 437.588 2.487 10 20 IECD O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NCc1ccc(N2CCOCC2)cc1 919859782 FNXIYCANBUGRRD-UHFFFAOYSA-N 428.554 2.492 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc([N+](=O)[O-])c1 920299600 JOHSTURKHGTHDC-UHFFFAOYSA-N 447.513 2.137 10 20 IECD CC1=c2c(=N)nc(C)[nH]c2=S=C1C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 1292601910 LBDNFPUPZQUHPE-UHFFFAOYSA-N 434.403 2.246 10 20 IECD CC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126277 NRJWEOVPOQCFSM-NTKDMRAZSA-N 440.544 2.339 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)n3)C2)C1 1779491071 VNWJEMNYRIXNBG-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1780411363 HALOSUFAOXKQSD-OAQYLSRUSA-N 433.892 2.155 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1[C@@H]2C=CS[C@@H]12 1796934715 HCVWMHROGRVWRZ-KICUZLOKSA-N 436.537 2.293 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998810 GCMTUCCAJVWNDO-ORDFMZHBSA-N 438.509 2.083 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nccc3nc[nH]c23)[nH]n1)c1cc(O)nc(O)c1 1817845089 YDARAOXXKRBLKE-CQSZACIVSA-N 448.443 2.107 10 20 IECD O=C([C@H](O)c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426171 NKKDWCGVXCMYLX-SIKLNZKXSA-N 439.512 2.460 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1cc(O)nc(O)c1 1828153837 YJOLIZJVCQEPRG-CMPLNLGQSA-N 434.543 2.318 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)CC2)cc1 110352549 CVLZAHKCZJGPQI-DEOSSOPVSA-N 436.512 2.247 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)CN4CCCC4)CC3)cc2)CC1 303427335 ZYHHUNLTDLWKHB-UHFFFAOYSA-N 427.593 2.373 10 20 IECD CCCN(CC(=O)NN1C(=O)N[C@](C)(c2cccc(OC)c2)C1=O)Cc1ccccc1O 733794616 NZXIWCPJFVQKQF-HSZRJFAPSA-N 440.500 2.111 10 20 IECD CN(CCCO)C1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 734487311 QFMVBCUZALPTCB-UHFFFAOYSA-N 435.524 2.179 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Cl)ccc1-n1cnnn1 736196044 LZZFYIUAVQZBCR-UHFFFAOYSA-N 426.908 2.454 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1O 737283665 DSQQSKIODFPILX-UHFFFAOYSA-N 436.468 2.041 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1 743560882 WHSIVFFSMFLCBD-PUHATCMVSA-N 434.540 2.479 10 20 IECD Cc1c(NC(=O)CSCC(=O)Nc2ccc(N)cc2)c(=O)n(-c2ccccc2)n1C 746479327 SJDRLFPLZLHBCS-UHFFFAOYSA-N 425.514 2.377 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]nc3-c3ccccc3F)nc12 756606308 URRXPJMWJARKIL-UHFFFAOYSA-N 425.376 2.498 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc(OC)c1OC 759876793 CFFVTZDOXXTJRC-UHFFFAOYSA-N 443.500 2.244 10 20 IECD COc1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1F 761116317 AAIBFPSOHLOLOU-OXQOHEQNSA-N 440.475 2.329 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc(F)ccc2Br)SC1=S 761181098 NIQVIDSOUWRZIF-XFFZJAGNSA-N 439.353 2.339 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(N(C)C)cc1 774855331 CAVTZKYBBRTYEH-JTSKRJEESA-N 442.535 2.259 10 20 IECD CCO[C@@H]1C[C@@](CO)(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 780189134 WBYOOGIIEAIATD-QPPBQGQZSA-N 448.608 2.073 10 20 IECD Cc1ccc(C(=O)NC[C@H](O)COc2ccc(I)cc2)c(O)c1O 780970666 ZDJWHZRISDUMFS-LBPRGKRZSA-N 443.237 2.181 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](c3cccs3)C3CC3)cc2)C1 785787086 IAMWLJCAHPBMQY-FXAWDEMLSA-N 440.569 2.334 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 786290404 HZOAPUUZXHRCQD-INIZCTEOSA-N 434.500 2.135 10 20 IECD CC[C@@H](C)NC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 787829748 JIUQQDBGIXHDFU-OAHLLOKOSA-N 428.508 2.353 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)n1 788931110 FLLBYJIXCCDUKE-FQEVSTJZSA-N 449.555 2.484 10 20 IECD Cc1nc(C)c(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789822521 WXNHGOARSKOYAP-KBPBESRZSA-N 448.564 2.488 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3cccc(C)c3)cc2F)CC1 793832676 XAPLOVSAGSFSMC-UHFFFAOYSA-N 426.536 2.251 10 20 IECD COc1ccc(CNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)c(O)c1 794381001 HMUVVCAFFNJRGW-UHFFFAOYSA-N 433.530 2.449 10 20 IECD CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(CC(=O)c1cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c1C)C[C@@H]3C2 796329568 LTMLVCHYNMAROL-XDCJFQGASA-N 443.569 2.279 10 20 IECD CCOC(=O)Oc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 800436953 PICADKYOKQOMFT-UHFFFAOYSA-N 432.498 2.387 10 20 IECD COc1ccc(N2CCN(c3nnc(C(=O)NC(C)C)n3C[C@@H]3CCCO3)CC2)cc1F 802692385 GBLPRXQGIVMHIM-KRWDZBQOSA-N 446.527 2.070 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCCC4(CCCC4)C3)CC2)cc1 803748263 ZXUXKWFDCBTODO-UHFFFAOYSA-N 428.577 2.116 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCO)[C@H]3CCc4ccccc43)CC2)cc1 804319196 KPTDFFKLQKWWAZ-QHCPKHFHSA-N 437.540 2.289 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 807292701 VWCGPJKMUKAFCV-ZRZAMGCNSA-N 430.552 2.269 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ncc(Cl)cc3C)CC2)cc(OC)c1OC 812980161 MMYREDJVPSUKGC-UHFFFAOYSA-N 448.907 2.357 10 20 IECD CC(=O)Nc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 917930245 NQEODGPIBAOJLQ-SFHVURJKSA-N 444.557 2.134 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)O1 918200047 UXEGTASZOCPYMS-CALCHBBNSA-N 436.572 2.474 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1[N+](=O)[O-] 918440564 SGIMRGZBAJQJRP-UHFFFAOYSA-N 430.436 2.258 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H]1C[C@@H]1c1ccccc1 1804336345 QDEOOYJDWUTULJ-CWQOZTLDSA-N 443.594 2.289 10 20 IECD O=C(C[C@@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721648 NMPHTTKXEQELLK-STQMWFEESA-N 432.502 2.134 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NC3CCN(CCS(C)(=O)=O)CC3)c2C)cc1 731650574 UOLNSWGVRDSISQ-UHFFFAOYSA-N 433.574 2.342 10 20 IECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C 733922218 QPJPWXODINUKQC-UHFFFAOYSA-N 425.501 2.162 10 20 IECD CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 742574080 QXOIHFOYFKZYBM-LJQANCHMSA-N 446.573 2.133 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 745423915 LKPVXQWNLZGYPP-HSZRJFAPSA-N 443.519 2.467 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O[C@@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 748833292 RUQRHGWOBVLFAT-LVCYWYKZSA-N 449.567 2.325 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755346765 SLJKJZZUWYBEDY-QZTJIDSGSA-N 434.581 2.483 10 20 IECD CCCCN(C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 756335183 GCZZPINQDUSZAG-UXHICEINSA-N 438.590 2.189 10 20 IECD C[C@H](c1ccccc1)[C@@](C)(O)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759563709 VDFUJQYMQIRSTE-MZNJEOGPSA-N 444.503 2.376 10 20 IECD O=C(CN1CCN(C(=O)NCCCSc2nccs2)CC1)NC1CCCCC1 759591009 SUYJEINGSPJHAY-UHFFFAOYSA-N 425.624 2.401 10 20 IECD CCC(CC)[C@H](C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)N1CCOCC1 760087376 YLTBEMCPJKABDA-JOCHJYFZSA-N 449.592 2.498 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NCc1ccc(N(C)C)cc1C 761276312 VWIATSNHDWVAMK-UHFFFAOYSA-N 441.575 2.310 10 20 IECD COC(=O)[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cc(OC)cc(OC)c1 764631225 XLTKHKRDZOQRNQ-VGOFRKELSA-N 441.528 2.409 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccn(CCc2ccncc2)n1 765925482 GJJGWZZDNDJBBQ-UHFFFAOYSA-N 444.289 2.244 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 765977710 IATDDCHWNZFBPC-OAHLLOKOSA-N 440.562 2.315 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN([C@H](C)c4nccs4)CC3)CC2)cc1 767009479 ZXCTYOHNJMSDGK-TZIWHRDSSA-N 445.633 2.013 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)c1 769915943 CYCKQHURSPSRQG-OAHLLOKOSA-N 437.905 2.343 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)N(C)OC)cc3)c2)CC1 770146992 KGEBKXYIYHLAGL-UHFFFAOYSA-N 432.546 2.263 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCc4ccccc4C3)cc2F)CC1 775120874 NQUCFKZKYFFWLA-NRFANRHFSA-N 438.547 2.258 10 20 IECD C[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(N2CCOCC2)cc1 775256079 VIPSGLXWMZFNHF-AWEZNQCLSA-N 428.445 2.449 10 20 IECD Cc1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 777197366 LLZZJXUKAANLHH-ZIAGYGMSSA-N 430.480 2.319 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H](C)C[C@H]3C)CC2)cc1 785527016 IMQIKNVXBJSVTE-NNMXDRDESA-N 430.593 2.264 10 20 IECD Cc1ccc(F)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793720329 OCXFWLIOOODRBI-GOSISDBHSA-N 440.519 2.111 10 20 IECD COc1cc(N2CCN(C(=O)Cc3ccc([S@@](C)=O)cc3)CC2)cc(OC)c1OC 797986073 HEOGCQTYPQFRDD-SSEXGKCCSA-N 432.542 2.341 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(O)(Cc4cccc(F)c4)CC3)ccc21 803686821 HUTFUJVZWBYTRH-UHFFFAOYSA-N 439.531 2.421 10 20 IECD O=C(NCCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 804969442 PWANEQPVCLAXEO-UHFFFAOYSA-N 440.475 2.148 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C12CCC2 805010069 SZCLCZLOGZOUAV-LEWJYISDSA-N 446.567 2.048 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3cc(Br)ccc3O)cccc21 807387247 FRQRRTCYCBQHNJ-UHFFFAOYSA-N 432.274 2.319 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 917708428 HHACFMQXSCXBCY-OAHLLOKOSA-N 425.460 2.272 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 918438035 DJJGXAQVNVQVKM-UHFFFAOYSA-N 446.454 2.139 10 20 IECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C1 918443294 DLRMSVHBMXTVNR-MRXNPFEDSA-N 445.541 2.410 10 20 IECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920923378 POMSJYMFBWIWGQ-QGZVFWFLSA-N 440.544 2.409 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 1116691669 NBVNPKQSWRPVRK-UHFFFAOYSA-N 430.530 2.369 10 20 IECD CCOc1ccc(N2CCN(C(=O)C3CCC(NC(=O)COCCOC)CC3)CC2)cc1 1319734392 ZTZDUAPENNWKFO-UHFFFAOYSA-N 447.576 2.072 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1782003502 RTGKCAUUMZXBIO-HXUWFJFHSA-N 449.916 2.192 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)[C@H]1CC=CCC1 1789837952 OJWUVYHMTAOHLQ-BKYPUVBMSA-N 442.512 2.153 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc2cncn2c1 1804285691 HTQJOIWABFJYLI-KJZRSFJVSA-N 448.479 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(Cl)cc1 1804336021 QYWYXMNWPOCZTB-QDMKHBRRSA-N 437.974 2.452 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c(F)c1 1804336174 ZKCGCMZYZGCYOG-BTTYYORXSA-N 435.546 2.246 10 20 IECD Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cs1 1805962343 XLEANOMHSXGUHA-IFXJQAMLSA-N 439.497 2.286 10 20 IECD CCc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807883376 LRYYYYDAWUCHRG-HTAPYJJXSA-N 447.495 2.479 10 20 IECD Cc1onc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1C 1807994420 WUOCXNPNBHMNHN-QRWLVFNGSA-N 437.456 2.126 10 20 IECD O=C(c1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898157 CIYCGZPMGZSNEE-KRWDZBQOSA-N 446.598 2.175 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCOc3ccc([N+](=O)[O-])cc3)C=C2)cc1 532065729 VAPYSRXNNAZSIO-UHFFFAOYSA-N 441.465 2.134 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccc(Cl)nc3)CC2)cc1 725819638 SGIBPHYEEIBYKI-UHFFFAOYSA-N 438.981 2.375 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1OC 726561338 OBLFXDFRSFSMGP-UHFFFAOYSA-N 433.530 2.011 10 20 IECD CN1CCC[C@H](CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 731120225 RGQSSYTVDVWENX-LJQANCHMSA-N 441.555 2.083 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 734842622 SWLHCTJZPJEHNT-MRXNPFEDSA-N 438.571 2.107 10 20 IECD COC(=O)CCc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738930485 DKETYOZDQXBYMX-UHFFFAOYSA-N 445.541 2.349 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](CN2CCOCC2)C1 741811435 ZNLBDDVEMJMGRX-ZWKOTPCHSA-N 447.535 2.443 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](c1ccccc1F)N1CCOCC1 745501783 XKTOKEFEXBNTFS-HSZRJFAPSA-N 443.519 2.467 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1 746272575 PYISXGXWPMGEAD-UHFFFAOYSA-N 432.477 2.487 10 20 IECD NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 748631974 GDZLFSRDCKOLGN-SFHVURJKSA-N 443.415 2.197 10 20 IECD O=c1onc(-c2ccccc2)n1C[C@@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 749298632 QGLXVKUIEXHBCT-VQTJNVASSA-N 425.485 2.251 10 20 IECD O=C(CN1CCC[C@H](Cn2ccnn2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 752063314 OBWMFCYPNOPVKK-INIZCTEOSA-N 429.480 2.404 10 20 IECD O=C(NCC1CCS(=O)(=O)CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 756128802 RIRXBWBQGLYRKM-HNNXBMFYSA-N 431.505 2.381 10 20 IECD O=C(CN1CCN(c2ncc(F)cn2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 759916967 AVCHSRMBGQWGRA-UHFFFAOYSA-N 445.454 2.152 10 20 IECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 761054600 OSKMEUKAFSWWNP-UHFFFAOYSA-N 433.505 2.257 10 20 IECD C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 768243987 SRBIPLJAWBUHBE-WMLDXEAASA-N 431.455 2.223 10 20 IECD CCN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H](C)CS(C)(=O)=O 769838825 KPPCOQZEKOHNCW-LBPRGKRZSA-N 446.572 2.150 10 20 IECD C[C@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCO1 770266407 REKKUNUEVWAFNP-STQMWFEESA-N 435.458 2.399 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)CC2)cc1 778408543 BZGXLANGTCXWLC-NFOIHXSLSA-N 447.626 2.396 10 20 IECD O=C(CCn1cnc2ccc(Br)cc2c1=O)OCC(=O)c1ccc(O)c(O)c1 782652811 RVRQQKIJXCAOIQ-UHFFFAOYSA-N 447.241 2.386 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N(C)CC(=O)Nc2ccccc2Cl)cc1 784556776 QLYWHYVBXOTUQS-UHFFFAOYSA-N 433.892 2.425 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1 785297904 UGSALUYSYPIWBD-OAHLLOKOSA-N 425.485 2.296 10 20 IECD O=C(NCCCn1cnc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785413390 YDRQQANCYDDPQS-IBGZPJMESA-N 436.512 2.456 10 20 IECD CC1CCN([C@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)C)CC1 787616765 OTLBBFLFHQEFJO-JOCHJYFZSA-N 448.583 2.151 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN1C[C@H](C)C[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 787705010 IPGANHSQYHTDHA-AQNXPRMDSA-N 430.593 2.185 10 20 IECD CCCOc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789811771 HORVPMRKIDLFPR-UHFFFAOYSA-N 443.519 2.426 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856982 ZWMUKICQQBOJLP-KRWDZBQOSA-N 443.569 2.448 10 20 IECD COc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789862508 UIAHXDXGSSTYIT-UHFFFAOYSA-N 443.569 2.402 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc2[nH]1 792372009 QZWIUGFFSRSYDM-UHFFFAOYSA-N 445.273 2.251 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](Cc3ccccc3)CN(C)C)CC2)cc1 793721773 ZISKVLIGZKBZKB-NRFANRHFSA-N 438.572 2.069 10 20 IECD Cc1cccc([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793734691 VTRJIRFSLWBXTJ-NQIIRXRSSA-N 436.556 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cncnc3)cc2F)C[C@H](C)O1 796166087 RHMKYHVBLDQAMS-HOTGVXAUSA-N 430.480 2.022 10 20 IECD COC(=O)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 797298142 GBASCBRNURJLNI-LBPRGKRZSA-N 443.319 2.478 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 799260419 VMJBEHFMNVTOKQ-IIBYNOLFSA-N 438.528 2.486 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1 801548117 NPPBBYGICBSZCE-KRWDZBQOSA-N 445.541 2.221 10 20 IECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803975616 JRBMMWILSICYHN-RXVVDRJESA-N 437.540 2.467 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O 808227746 GMOYCLHYCONAOZ-KRWDZBQOSA-N 442.482 2.159 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 808582142 UMOLXLARPCPMHN-LJQANCHMSA-N 428.920 2.252 10 20 IECD O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809541778 XMVXSWHIUMDZGN-KOUHRCEDSA-N 428.529 2.364 10 20 IECD Cc1cc(Cl)cnc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 812959577 JTHIDYCKCQNFNV-OAHLLOKOSA-N 429.908 2.000 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)cc1C(N)=O 914789547 GWBPVPKCXVJGBJ-UHFFFAOYSA-N 447.494 2.490 10 20 IECD CCCN(C(=O)[C@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 914903518 MWXZVKICPQHBFQ-ZWKOTPCHSA-N 447.557 2.460 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1 917928155 YGIHFAOYDFRTFU-UHFFFAOYSA-N 433.530 2.166 10 20 IECD CS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918118134 WGXMHPNZTIBABN-INIZCTEOSA-N 445.545 2.082 10 20 IECD Cc1nc(CN2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)cs1 918222872 AMOGGZIAIPBVIS-UHFFFAOYSA-N 433.553 2.455 10 20 IECD O=C(Nc1cccc(Cn2cncn2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918296371 JMDQHVUVWPDUBC-HXUWFJFHSA-N 435.484 2.178 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OCC(F)(F)F)nc1 918340536 RKNAMPKPXQDZFU-UHFFFAOYSA-N 443.447 2.188 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc([N+](=O)[O-])cn3C)cc2F)C[C@@H](C)O1 919027916 UIWNAHDBMFXYQO-OKILXGFUSA-N 448.451 2.159 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCCN(CC(F)(F)F)C3)CC2)cc1 920650558 ZCAICQXHKNGBPZ-INIZCTEOSA-N 443.466 2.161 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)Nc2c(Cl)ccc3nonc23)cc1 1117546649 AFIXITWNKVQIBW-UHFFFAOYSA-N 437.865 2.094 10 20 IECD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781833401 YRFJTQDAEYWGMV-FKGOBVFQSA-N 443.544 2.447 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](N)CN)[nH]n2)cc1 1821157653 OFBUCVDNEUKPST-FPOVZHCZSA-N 449.559 2.409 10 20 IECD CO[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccc1 1842669334 PKOZNPKCOONMOC-JOCHJYFZSA-N 446.507 2.370 10 20 IECD O=C(c1ccc(Cl)cn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441958 UWUXTROJNXHIGA-UHFFFAOYSA-N 437.887 2.345 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2nc3ccccc3o2)C1 1845596204 SIRONWTWUVFQJK-UHFFFAOYSA-N 443.463 2.438 10 20 IECD O=C(Nc1ccc(NC(=O)C2=S=CC=C2)cc1)C(=O)N1CCN(c2ccccc2)CC1 462018817 YLVZCKXAVITGPA-UHFFFAOYSA-N 434.521 2.190 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1 727947644 YGQYHMUKPONVGJ-UHFFFAOYSA-N 425.468 2.211 10 20 IECD CN(CCn1cccn1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 732301426 CPSOQXPOVHYGKT-UHFFFAOYSA-N 445.457 2.070 10 20 IECD CCS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 732537531 YDOICXSKPYNJGR-MRXNPFEDSA-N 447.532 2.251 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCO)CCc3ccccc3)CC2)cc1 733038706 LUVRNMPJWNEROA-UHFFFAOYSA-N 426.561 2.064 10 20 IECD O=C(Cn1c(=O)nc(O)c2ccccc21)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743737171 ZTRYFKMPPTUEKW-AWEZNQCLSA-N 444.438 2.489 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)c1C 756334736 ANUGFJCMZWPTFA-GOSISDBHSA-N 447.557 2.276 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC3CCN(Cc4ccccc4)CC3)CC2)cc1 758184953 GRSWYYSDWIQHJA-VWLOTQADSA-N 438.616 2.432 10 20 IECD COc1cc(N2CCN(C[C@@H](O)COc3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759886629 NYVAASFHPQAZMN-QGZVFWFLSA-N 447.488 2.183 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 760743373 DWEAUMMYPQDNRS-XLIONFOSSA-N 448.564 2.347 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(S(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 760745415 VRTWCYROBYBZNT-GASCZTMLSA-N 427.542 2.158 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3C(=O)c3ccc(F)cc3)CC2)cc1 767367917 VUJDTGZYWDIRQA-OAQYLSRUSA-N 438.503 2.445 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cccc21 769260056 IWYIIFRYKMUMQF-INIZCTEOSA-N 436.512 2.248 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccc(N(C)C)cc1 773845398 IQWZHCAHQQEIDD-OAHLLOKOSA-N 430.530 2.108 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc(N(C)C)cc1 773849610 WRDUPKGPQITUEN-HNNXBMFYSA-N 439.516 2.038 10 20 IECD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1OCc1cccnc1 774362835 FRBWTHBQUXIYDH-UHFFFAOYSA-N 437.452 2.378 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@@H]3CCCc4c3cnn4C)CC2)cc1 778393134 YWKDRZNGWXDRBH-AXUYNXDZSA-N 437.544 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@H](C)C3CCN(C)CC3)CC2)cc1 778411418 RSYRMUAOWWHRMK-JBVUFVISSA-N 428.577 2.089 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)NC4CC4)c3)c2)CC1 781048593 ZCYIUEOZBMRSKR-UHFFFAOYSA-N 442.541 2.048 10 20 IECD CC(C)n1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1N 783197441 JUZSPMAWADIJMV-GASCZTMLSA-N 447.511 2.272 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)nn(CC(C)C)c3C)CC2)cc1 784322183 XPSORHHJSNVRGF-UHFFFAOYSA-N 449.621 2.265 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc4c(=O)n5ccccc5nc4n3C)CC2)cc1F 784431866 ZBPMNNNPSJATML-UHFFFAOYSA-N 435.459 2.296 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)nn1 786018806 DMIMDSFXCFJQBJ-HUUCEWRRSA-N 430.480 2.319 10 20 IECD Cc1nccn1-c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 787480221 CADJYDWEKKRGKU-FQEVSTJZSA-N 449.511 2.105 10 20 IECD Cc1cnc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 787878280 FWLQLDPLIJCXPB-HNNXBMFYSA-N 429.908 2.000 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NCC1CCSCC1 789948551 CIWQOEWMZGYXGH-UHFFFAOYSA-N 445.507 2.418 10 20 IECD COCCN(C)c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cn1 790106860 YAQFYMJVJGCUBA-SAPNQHFASA-N 436.603 2.088 10 20 IECD COc1cc(Cl)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)O 792590846 UUUYTTFUDYSPDK-UHFFFAOYSA-N 440.905 2.362 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)C(=O)N3CCCC3)cc2F)C[C@@H](C)O1 796591206 BVIICIJKSKVBRU-CALCHBBNSA-N 434.556 2.046 10 20 IECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H](C)C1 804380310 HJRODZZZBVLGFC-CQSZACIVSA-N 448.501 2.267 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807291773 NHTDLRDOFKULKD-AZUAARDMSA-N 426.561 2.222 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC[C@@H]1C 807771059 RGIFDVHWOWEWFB-HDMKZQKVSA-N 425.476 2.256 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(CCN(C)C)cc3)CC2)cc1 809801402 VEQUUDDWZOGPNP-UHFFFAOYSA-N 438.572 2.154 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cn2n1 810369333 RATKSRZIZUSSGT-AWEZNQCLSA-N 444.442 2.363 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 815420600 UMCUMWRLFJPZPR-OAHLLOKOSA-N 426.473 2.057 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 914793076 WFORVIWIJQHTRS-QGZVFWFLSA-N 445.541 2.401 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914846930 CBYSAXTUDXKDEN-UHFFFAOYSA-N 443.529 2.241 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1ccco1 917163096 BURLTLYNTISIRU-UHFFFAOYSA-N 431.493 2.459 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 918220220 IHRBQVGDUGKFIZ-SOLBZPMBSA-N 441.569 2.406 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)c1 919816737 FTYZFJLENUHQFS-UHFFFAOYSA-N 440.481 2.341 10 20 IECD Cn1ncc2cc(S(=O)(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)cnc21 1320428589 HNURWPOFFQBTGJ-UHFFFAOYSA-N 426.546 2.301 10 20 IECD Cc1csc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1 1787290214 JFKZMZLTYXXFGM-WBAXXEDZSA-N 445.541 2.089 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)cn1C 1790243596 ZYOBUKURMSWALO-AXHNFQJDSA-N 447.919 2.305 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2c1OCCC2)c1cc(O)c(O)c(Cl)c1 1800944197 REFVYSQTCZGPQG-BTTYYORXSA-N 446.891 2.296 10 20 IECD CC(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828247241 QWACEUAUWLNEKQ-NSHDSACASA-N 440.616 2.352 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(O)c2)CC1 1831698606 HGCZNDWBZJVFLI-SFHVURJKSA-N 426.473 2.141 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1832185508 AYNBYYLDMMQKIU-APWZRJJASA-N 441.532 2.492 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2nccc3occc23)C1 1843157677 ZAORFRZWZYPETH-UHFFFAOYSA-N 443.463 2.438 10 20 IECD C=CC(=O)NCc1ccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 115785084 YKJDJUYRMSNUMX-UHFFFAOYSA-N 436.556 2.440 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 726727149 FRZQMBNOUWBPSK-UHFFFAOYSA-N 427.501 2.444 10 20 IECD CCCN(CC(=O)N1CCN(S(=O)(=O)c2ccccc2F)CC1)Cc1ccccc1O 727831322 VYKNIYNJGSQBBY-UHFFFAOYSA-N 449.548 2.276 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)cc1 732666766 CJXFLETZTYUPLM-JOCHJYFZSA-N 430.980 2.373 10 20 IECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800492 SMQJUUHVQSCIOD-QPUUTROZSA-N 445.466 2.180 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccnn3CC3CC3)cc2F)C[C@H](C)O1 746354735 KHYMUXWIZAJTRO-GJZGRUSLSA-N 429.496 2.301 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CC[C@H]3Cc4ccccc4NC3=O)nc12 746922512 FFCCSEIFJFIRTN-AWEZNQCLSA-N 438.440 2.246 10 20 IECD COc1ccc(C(=O)CNC(=O)CCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 751291344 VNUCORCERQSXLJ-UHFFFAOYSA-N 439.512 2.132 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc(OC)c(OC)c3)CC2)cc1 753998356 BDIMCVZPMHEHQV-OAQYLSRUSA-N 429.561 2.327 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc(OC)c1OC 759239516 MJEABACZHZOWIR-UHFFFAOYSA-N 434.514 2.078 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1 760918063 JTBOUSQBWMZSAR-YOEHRIQHSA-N 435.521 2.484 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 767937704 RLVGWKXOLWVAEQ-VXKWHMMOSA-N 434.556 2.229 10 20 IECD CCc1noc(CCCc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)n1 771069888 YMDVQJPASVFQLN-UHFFFAOYSA-N 440.504 2.090 10 20 IECD Cc1ccc(-n2nccc2NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)nn1 773213041 QJOOXHZJOHLWSP-UHFFFAOYSA-N 432.440 2.437 10 20 IECD CN(C)c1nccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 775850933 NTMXNQGEWNASPK-UHFFFAOYSA-N 433.515 2.041 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 780398245 UCYLPUMDGHYVJU-UHFFFAOYSA-N 439.389 2.273 10 20 IECD Cn1cc(-c2nc([C@@H]3COCCN3C(=O)NCc3ccc(N4CCCC4)cc3)no2)cn1 780820043 BXVFQCSSIVBAKK-IBGZPJMESA-N 437.504 2.353 10 20 IECD CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 783505403 WHGHIGRWWULNIP-KRWDZBQOSA-N 449.567 2.457 10 20 IECD Cc1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1S(N)(=O)=O 784109766 XNEVVWSKBYKOSX-UHFFFAOYSA-N 430.530 2.387 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCC3CCCCC3)CC2)cc(OC)c1OC 788431854 KOYYVDHXNBBHNE-UHFFFAOYSA-N 433.549 2.448 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCCN3C3CC3)cc2F)C[C@@H](C)O1 789823001 CCENJSKUSOQQCY-MBOZVWFJSA-N 446.567 2.189 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccncc3)cc2F)C[C@H](C)O1 789826227 PAGIVTYVCADGAJ-IKGGRYGDSA-N 428.508 2.198 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cnc4n3CCCC4)CC2)cc(OC)c1OC 790972619 RXFKIESMFFTQGU-UHFFFAOYSA-N 429.521 2.277 10 20 IECD CC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCCCC1 793728336 YBJKXPSJPKADID-LJQANCHMSA-N 428.577 2.481 10 20 IECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC(C)(C)O1 803448484 ATBBVSQEYFDEIX-AWEZNQCLSA-N 425.476 2.399 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)cc1F 803663551 RZWAQAAGTDXCGS-QUCCMNQESA-N 434.462 2.348 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCC(OCCCO)CC2)cc1)C1CCCCC1 803680035 YODPFANTCRJCSE-UHFFFAOYSA-N 431.577 2.462 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)O[C@@]4(CCCOC4)C3)cc2)CC1 805023364 GFBZGUSERPSRNC-DVECYGJZSA-N 429.561 2.336 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806327540 CCIKWZGRJXAHIG-IAGOWNOFSA-N 438.519 2.364 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(c2ncnc3ccsc23)CC1 807101161 VCLQVRAWYALWEV-UHFFFAOYSA-N 438.557 2.031 10 20 IECD CC[C@@H]1CO[C@@H](C)CN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768225 FXFMMZDLIAHXHM-ARFHVFGLSA-N 425.476 2.399 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1nnc(SC)s1 809608345 MTEXKPOOOZRSBX-UHFFFAOYSA-N 445.364 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C(N)=O)[C@@H](C)c3ccccc3)cc2F)CC1 813632484 HBHATYRAAAAZOC-HTAPYJJXSA-N 441.551 2.424 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)CCn2cnccc2=O)NC(=O)OC(C)(C)C)cc1 815710828 WTXHHXMGEJPPFC-SFHVURJKSA-N 429.521 2.082 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H](CO)CC1 819239820 KPJQGFDBTVYNGA-CQSZACIVSA-N 449.485 2.336 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 916234789 RWXOUUZJWOPLFE-QFIPXVFZSA-N 437.588 2.391 10 20 IECD CN(CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)CC1CC1 917153510 PTMRRXPTWVFHBY-RQZCQDPDSA-N 433.555 2.075 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(-n2ccnc2)c1 918762873 DXDHYIDLKOHAKD-UHFFFAOYSA-N 437.475 2.227 10 20 IECD CCCc1n[nH]cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 1317946515 JBWRQQAYXNDTGW-UHFFFAOYSA-N 444.513 2.457 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(S(C)(=O)=O)cc(C)c1C 1320399073 MVDYNUNGXYIHAN-KRWDZBQOSA-N 435.498 2.022 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S[C@@H]2CCOC2=O)cc1 1321366058 DPFWYSKREBWLNR-QFBILLFUSA-N 445.493 2.410 10 20 IECD COC1(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1782007056 AKOBWHXTDKLKTO-OAQYLSRUSA-N 438.908 2.154 10 20 IECD CCC1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCC1 1785505444 IIHIIZOMFMVZJN-NKOINVLESA-N 430.501 2.227 10 20 IECD CC[C@H](NC)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804241 SXVMCYLEQNZZNX-FNHZYXHNSA-N 446.935 2.464 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 302972411 BOCDOXGWHYHGRO-UHFFFAOYSA-N 447.605 2.244 10 20 IECD COc1cc(NC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)cc(S(C)(=O)=O)c1 557132397 AJZMFMFWPQSYJD-UHFFFAOYSA-N 434.495 2.056 10 20 IECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCCCSc2nccs2)c1 733972946 BHDWZQRWIKPPLU-UHFFFAOYSA-N 429.589 2.288 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2 734687193 NGKOLTKULOHSCI-IBGZPJMESA-N 426.517 2.185 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)c3ccc(F)cc3)CC2)cc1 734938856 NTMFCXMFCVRWBD-QFIPXVFZSA-N 430.524 2.379 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 741673797 OQKQMSOYNWOLHN-UHFFFAOYSA-N 435.521 2.032 10 20 IECD COCCNC(=O)Cn1cc(NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1 747570252 IAWIAGOLJPAFHD-UHFFFAOYSA-N 428.537 2.204 10 20 IECD CC(=O)N1CCC(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751060948 OVBDVWWMPFNGHD-UHFFFAOYSA-N 437.543 2.243 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(N(C)C(C)=O)c3)CC2)cc1F 754213415 RXZNUZOMHFZQCL-UHFFFAOYSA-N 428.464 2.104 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](c3ccco3)N3CCCC3)CC2)cc1 758186826 SBNXYZYUSJFQGJ-GGAORHGYSA-N 428.577 2.198 10 20 IECD COC(=O)c1ccccc1CCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 758800071 TWKVCKSPVYIPLN-UHFFFAOYSA-N 425.529 2.353 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 760972919 MDXAGTYJLVIATO-PXNSSMCTSA-N 434.581 2.325 10 20 IECD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NCc1cccc(Br)c1O 764759331 YBHRACVDHLANSV-UHFFFAOYSA-N 442.335 2.404 10 20 IECD Cc1ccc([N+](=O)[O-])c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1C 765080130 KJKYUKXNHALXBC-UHFFFAOYSA-N 439.515 2.247 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCN(CC(F)F)CC3)cc2F)C[C@@H](C)O1 767119597 LXNSOGKPGZWLCZ-CALCHBBNSA-N 442.526 2.328 10 20 IECD Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 769974070 SJXNTNUWMOPVJL-YLJYHZDGSA-N 431.512 2.051 10 20 IECD Cc1cc(C(=O)CN2CCO[C@H](COC(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 770707525 UPNONNUQLQAGMY-IBGZPJMESA-N 449.573 2.050 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)c1O 774836423 MWIDJAVJNJYILH-UHFFFAOYSA-N 425.445 2.276 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(F)F)c3)n2)o1 777665912 BTSWUJKUVIBELR-UHFFFAOYSA-N 431.446 2.302 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4oc(=O)ccc4c3)c2)CC1 780407137 FUFWVUHJHQEGQL-UHFFFAOYSA-N 427.482 2.262 10 20 IECD COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781451609 DNPNQCQYCCJICY-UHFFFAOYSA-N 431.876 2.218 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCCN(C(=O)C4CCCC4)C3)CC2)cc1 781521960 SJNSZGOBLSNPPI-OAQYLSRUSA-N 435.590 2.328 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(OC2COC2)cc1 782104773 KWTPQUQOSFVHQV-UHFFFAOYSA-N 427.526 2.272 10 20 IECD CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 784692752 NHWFAQHNQJUXRL-UHFFFAOYSA-N 425.468 2.381 10 20 IECD CN(C)c1ncccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 787634293 YIJNVHQFTSPHAK-UHFFFAOYSA-N 447.486 2.150 10 20 IECD Cc1cc(C(=O)COC(=O)c2cccnc2F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 789013024 YAKILXGJXNVLER-UHFFFAOYSA-N 431.445 2.315 10 20 IECD CCN(C)c1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844164 QBLROHVPHDUZCF-UHFFFAOYSA-N 442.535 2.176 10 20 IECD CN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789865017 URQJWQXGJLZXEG-UHFFFAOYSA-N 427.526 2.243 10 20 IECD C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793727896 WCXQLZCIIZEXKX-SAJDGTNDSA-N 426.561 2.184 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1 793733223 LUPMABRNJKCTTN-APWZRJJASA-N 440.519 2.064 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2nn(C)c(=O)c3ccccc23)n1C 800762628 CQQIZPXAEUXXCV-UHFFFAOYSA-N 445.527 2.202 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(OC(F)F)nc1 801954887 MUXYVBMPRKDGFI-UHFFFAOYSA-N 426.445 2.240 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1F 804005512 ZKXANDACCYZKKI-FQEVSTJZSA-N 440.519 2.205 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 806279664 VUNUWWAWACNPKH-INIZCTEOSA-N 446.598 2.410 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1)c1ccc(N(C)C)cc1 807678757 ZNHLRWALMQWMAJ-KFKAGJAMSA-N 431.558 2.342 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cccc2c1OCC(=O)N2 810400481 HLCNDLCSNCXGKB-UHFFFAOYSA-N 448.273 2.473 10 20 IECD Cn1cc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)c(C(F)F)n1 812219372 FVTZYBZIFUYQPA-SDQBBNPISA-N 444.510 2.407 10 20 IECD Cc1nc(C)n(C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)n1 816517513 SRZKNMNAGVQWJU-UHFFFAOYSA-N 433.515 2.160 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(N4CCOCC4)c(F)c3)cc2)CC1 863993534 JVWNKTXAKZMSLZ-UHFFFAOYSA-N 448.564 2.211 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc(C(C)=O)cc4F)CC3)nc12 917069999 NSLOQYOOWIPVPM-UHFFFAOYSA-N 441.463 2.276 10 20 IECD O=C(NCCCn1ccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919778590 FIMDBFWWAVSBMV-UHFFFAOYSA-N 438.511 2.028 10 20 IECD CN1CCN(c2ncccc2CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 921199015 GIUFCTJYSKCAFQ-UHFFFAOYSA-N 438.576 2.012 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)c1 1323742717 KYFGHHZHQNQHHL-UHFFFAOYSA-N 441.875 2.378 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC(F)(F)C1)C1=NN(c2ccccc2)C(=O)C1 1792678108 GLOZGCXBKCNBBP-ACHSLPGTSA-N 430.455 2.463 10 20 IECD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1794459803 UJCRDUJSUIRCNP-ASYHBGTLSA-N 437.496 2.401 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1796931738 GSQZWBNDZARECC-VBUUOAMHSA-N 434.500 2.017 10 20 IECD O=C(CCc1ccc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285704 OWFZQJJSYWWRIB-QGHCGXIDSA-N 425.485 2.416 10 20 IECD CCOCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823474715 AEOVBOJIZADSLF-LOWQCSRCSA-N 430.461 2.269 10 20 IECD COCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826619113 VSDKBCRBJXKHTQ-JHTBKMLMSA-N 432.517 2.473 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1ccon1 1834302025 FRLFKXJVRLITRC-UHFFFAOYSA-N 448.907 2.238 10 20 IECD CC(C)n1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1844816984 ZGACEJOXHIZBEJ-FNORWQNLSA-N 426.473 2.111 10 20 IECD Cc1cncc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1848196433 IWTWGKDYFIVWGO-WYTIROKMSA-N 437.496 2.355 10 20 IECD O=C(NCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)c1cccs1 1848219051 AXAZBPNUULHUSP-KBPBESRZSA-N 449.916 2.058 10 20 IECD CCN(CC)C[C@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726244492 ICZAWWOLBUEULS-SFHVURJKSA-N 443.571 2.472 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@H](C)O4)CC2)cc1 726726241 QIFNPBPQMDTZNR-AWEZNQCLSA-N 438.484 2.138 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)NCc3cccc(OC)c3O)cc2)CC1 729571861 OMIFCHNMZMSHSD-UHFFFAOYSA-N 428.489 2.018 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2)CC1 746237563 OVDLUVUQUSXHIE-IWUPYOBGSA-N 425.529 2.090 10 20 IECD C[C@@H](Oc1cccc(C=O)c1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 746751535 SRYDLBZIBHUXKR-MRXNPFEDSA-N 444.459 2.102 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c(C)n1-c1cccc(Br)c1 749252193 FSJIWDMKVQJELN-MRXNPFEDSA-N 431.290 2.233 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](Cn4ccnn4)C3)cc2F)C[C@@H](C)O1 752064668 KKDZHJFFUIOOBS-QWFCFKBJSA-N 444.555 2.059 10 20 IECD COc1ccc(N2CCN(CN3C(=O)C(=O)c4cc(OC)c(OC)cc43)CC2)cc1F 754010888 GUZRTMTUCZSFRA-UHFFFAOYSA-N 429.448 2.161 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 759094649 KFGQNLBJWFJDHA-UHFFFAOYSA-N 436.870 2.438 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(CS(C)(=O)=O)cc3)CC2)cc(OC)c1OC 759219770 DKFYIYHPOMHPGQ-UHFFFAOYSA-N 448.541 2.219 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)[C@@]12CCCO2 759319638 CSQJTMUYVJVQFK-MZKRTTBSSA-N 449.548 2.271 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H](C)NC(=O)c3cccs3)CC2)cc(OC)c1OC 759405277 KZAHQFXGWRGTQP-CQSZACIVSA-N 433.530 2.241 10 20 IECD COc1cc(N2CCN(Cc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc(OC)c1OC 759880129 XLTLEZFWCXOEDY-UHFFFAOYSA-N 449.573 2.285 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@H](NC(=O)NC3CC3)C2)c([N+](=O)[O-])c1Br 760603023 SVFRQOOWEKZJBE-VIFPVBQESA-N 444.242 2.314 10 20 IECD C[C@@H](NS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1)c1ccc(N(C)C)cc1 773088885 PTJSTEZWEGHSAB-GFCCVEGCSA-N 432.468 2.423 10 20 IECD CCOC(=O)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 782740663 RZDGAAIBEZZOSG-KHPPLWFESA-N 438.484 2.110 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCNC4=O)C3)cc2F)C[C@@H](C)O1 782937093 CHEKTDUAPPXNFG-JFIYKMOQSA-N 433.528 2.139 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788931482 GZRRJAVYMCSMQI-HKUYNNGSSA-N 430.549 2.276 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789376864 AYXSJIGBIFVIRF-GOSISDBHSA-N 429.546 2.080 10 20 IECD C[C@H]1COc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797692 CVEZYRYNXJRDAI-INIZCTEOSA-N 427.476 2.088 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 789855129 KIKHXABIMUUNKD-KRWDZBQOSA-N 443.569 2.448 10 20 IECD COCC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 790421071 LNAUSUXPIYBMGO-UHFFFAOYSA-N 435.458 2.210 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c(O)c1 797390713 OBZQYINCHSMRQV-UHFFFAOYSA-N 426.517 2.186 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)NC(=O)OC(C)(C)C 803685382 FLIPEKFKJDFMCO-GOSISDBHSA-N 432.565 2.351 10 20 IECD CCN(CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 804256978 UKUDJRBIIZASBF-UHFFFAOYSA-N 448.564 2.153 10 20 IECD CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 804967188 KCDLDKCJNWVDRA-UHFFFAOYSA-N 439.578 2.185 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccn(Cc2ccncc2)n1 807386585 BDRKKBTWBDQWOS-UHFFFAOYSA-N 430.262 2.049 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 808283872 YTKPWNBEPKFTHP-UHFFFAOYSA-N 435.521 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](CC(C)C)NC(C)=O)n3)CC2)cc1 809465798 ZHSAPWWUMAHLSG-IBGZPJMESA-N 429.521 2.193 10 20 IECD C[C@@H](OC(=O)[C@@H]1CCN(C)C(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 912704737 WBEHYXSRVAUKSI-ZIAGYGMSSA-N 434.448 2.201 10 20 IECD O=C(COC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc(O)c(O)c1 916595545 PWHQYCODDMTQQR-UHFFFAOYSA-N 437.445 2.064 10 20 IECD CCOC(=O)[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917043423 YEIFXEKKRNKKJH-LLGFUMIMSA-N 435.540 2.473 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCN(CC(F)(F)F)C3)cc2)C1 918116903 CAKANGITHQKOHF-SJORKVTESA-N 441.498 2.072 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918438686 GQVZRRHASRJOJV-UHFFFAOYSA-N 443.525 2.047 10 20 IECD O[C@@H](CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)COc1ccccc1 920091979 AWCPYHXBBLUHHK-FQEVSTJZSA-N 437.519 2.472 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3cccc(F)c3)CC2)cc1 920256073 PSQCMABQDPGWSF-KTKRTIGZSA-N 427.476 2.234 10 20 IECD CC1=CC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1778748179 MEJJIGOAWZFXFE-JTUHZDRVSA-N 429.517 2.367 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCO1)C2)c1cc(O)c(O)c(Cl)c1 1781123116 VDXDRDPGLHGNMY-CSODHUTKSA-N 438.908 2.058 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nc2ncccc12 1796667678 HGZTUITXCOVJHW-RRJKNOHSSA-N 449.467 2.040 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccn1 1798773484 KOFSBIXOUZYPCD-FNLKRUPLSA-N 431.496 2.435 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803972837 WDRMEAPCMZKYDH-GZHDQSLTSA-N 449.486 2.238 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)nn1C 1804289218 ZKCIAYROASXZRA-BGYGVLGPSA-N 440.500 2.065 10 20 IECD CC(C)(C)NCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809731346 AQRNIBAVQVNVFO-SOFGYWHQSA-N 445.560 2.436 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)C1 1810551079 AUIJSJYAGHCJNJ-IBGZPJMESA-N 437.496 2.341 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@@]1(F)Cl 1813154149 XQINSIYZBHYSRH-AJRGADBESA-N 434.855 2.132 10 20 IECD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827424245 VFBYECIXKLUVSZ-LJQANCHMSA-N 441.532 2.011 10 20 IECD Cc1cc(Cl)ccc1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841154248 PZZCKHSQIUYVMM-UHFFFAOYSA-N 437.974 2.326 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2cccc(F)c2)C1 1842706389 VKNFUAHTELPMGK-UHFFFAOYSA-N 434.471 2.365 10 20 IECD O=C(Cn1cc(Cl)cn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500923 FLYNSQRGKFGVBM-UHFFFAOYSA-N 425.272 2.118 10 20 IECD O=C(c1ccn(C(F)F)n1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501546 AHUUFFJSCIXMSO-UHFFFAOYSA-N 426.807 2.474 10 20 IECD C[C@H](Oc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846606492 UKQADKKZQCDSKK-ZDUSSCGKSA-N 431.876 2.431 10 20 IECD O=C(CCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1)Nc1ccccc1 1847538600 LSEBCEJLLZDSEB-ROUUACIJSA-N 438.484 2.117 10 20 IECD Cc1cc(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 97554715 YYHDVVCRHMIHNC-CQSZACIVSA-N 437.949 2.123 10 20 IECD CN(C)[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 729600548 SIJDXXGUWGJHGP-IBGZPJMESA-N 441.555 2.178 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3COC)cc2F)CC1 730391714 SUTMKGBWPVXDCS-UHFFFAOYSA-N 428.508 2.369 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1OC 737117279 LVTAJKRDQKDANX-UHFFFAOYSA-N 448.545 2.120 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2 740739492 DPNWOTGQEUPQTG-WJOKGBTCSA-N 444.553 2.451 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3nc(-c4ccccn4)no3)CC2)cc1 742921077 WNUITGRLYLIZFY-UHFFFAOYSA-N 436.516 2.011 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3COc4cc(OC)ccc4C3)CC2)cc1 747421738 DBRKSOXBPSFDGB-LJQANCHMSA-N 425.529 2.193 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1O 748046118 DNTMWISPHDULRY-UHFFFAOYSA-N 437.449 2.149 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]3C)nc12 749490624 UZUSWNWIDZLYSB-UONOGXRCSA-N 433.509 2.489 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](c4ccccc4F)C3)CC2)cc1 754030176 LWXHEQSGJHHVDV-GBXCKJPGSA-N 429.536 2.391 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cnc(Cl)cc3C)CC2)cc1 766285113 BNJYUWANBJNJFJ-UHFFFAOYSA-N 445.951 2.319 10 20 IECD CS(=O)(=O)CC1(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 767497313 ZSGDWPNJCXCZFK-UHFFFAOYSA-N 443.433 2.352 10 20 IECD COC(=O)/C=C/c1ccc(OCCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 767513528 HBLBESYTBKRYBA-BJMVGYQFSA-N 435.454 2.186 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(Cl)ccc3O)CC2)cc1[N+](=O)[O-] 768187865 XVAMNJKGAWFYTK-UHFFFAOYSA-N 441.893 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)CC2)cc1F 771463412 WBUUDBJFHHNMBZ-UHFFFAOYSA-N 426.452 2.073 10 20 IECD CN(C)C(=O)NCCN(C)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 775811452 PCAXTVUWCWVFCM-OWBHPGMISA-N 440.616 2.459 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cnc4c(c3)COCC4)CC2)cc1 777739348 UNZROZMXPIHRSZ-UHFFFAOYSA-N 425.533 2.497 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc(-c4ccccc4)n[nH]3)CC2)cc1 778255860 HDVUBRURFLZWKY-QXMHVHEDSA-N 446.511 2.002 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1F 779529202 RMZBCKVLQODKBU-MOPGFXCFSA-N 431.489 2.187 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Oc3ccc4c(c3)NC(=O)CC4)CC2)cc1 781145887 YTHRJXMDXYZGCD-KHPPLWFESA-N 435.480 2.390 10 20 IECD O=C1CN(c2ccnc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2)CCN1 786864927 HHWVQVGRTKVKHL-UHFFFAOYSA-N 445.470 2.018 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 787198074 MWMCQKAJCWFDDB-QZTJIDSGSA-N 440.544 2.456 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 788313328 QVLJAPPSXBKNRK-LJQANCHMSA-N 442.947 2.188 10 20 IECD Cc1nn(C)c(C)c1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788359212 YIGRMHXNDWWYCM-OAHLLOKOSA-N 435.475 2.040 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820419 QPAAWAYRAHPPAN-CALCHBBNSA-N 445.539 2.109 10 20 IECD CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCO1 802681434 CJCQILFXHNIQHF-FQEVSTJZSA-N 442.564 2.068 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CCO1 803131179 JWROXTOVJMKZCS-IBGZPJMESA-N 438.572 2.248 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803146769 UNEPZAWCHVGHGT-KRWDZBQOSA-N 426.517 2.201 10 20 IECD CCc1cnc(N2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)s1 803686752 PGRNPEUYTLWYMN-UHFFFAOYSA-N 427.574 2.053 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCO)[C@@H]3CCc4ccccc43)CC2)cc1 804319195 KPTDFFKLQKWWAZ-HSZRJFAPSA-N 437.540 2.289 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C)cc3OC)cc2F)CC1 805006687 BLZSZLNCNDDYNZ-UHFFFAOYSA-N 442.535 2.217 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](SC)C(C)(C)C)cc2F)CC1 805007929 VKAWNDLGTIPQBS-LJQANCHMSA-N 438.613 2.478 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O 806215501 CTXCSKLAXHPIDE-LJQANCHMSA-N 426.492 2.162 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCCCSc2nccs2)c(N2CCOCC2)c1 806276236 ACPRGHWIQWBXEH-UHFFFAOYSA-N 434.587 2.203 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807771622 WIYASSLZBGKCMZ-QGZVFWFLSA-N 438.519 2.362 10 20 IECD CC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 807953845 ZCDVPKAAZDBXRR-INIZCTEOSA-N 434.968 2.273 10 20 IECD O=C(CN1C(=O)CCC1=O)N1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809550507 SWOGAGXWFXNWSW-UHFFFAOYSA-N 446.551 2.043 10 20 IECD CCOC(=O)C1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 914532699 SCMPBHVIHXQZQZ-UHFFFAOYSA-N 432.565 2.192 10 20 IECD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832781 GRZFEXHTRBGDMA-INIZCTEOSA-N 425.489 2.293 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccccc4)CC3)cc2)C1 918118657 VEIVISSSRUKMCN-JOCHJYFZSA-N 435.572 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccncc1C(F)(F)F 1796601308 SCFGVXGVVNTEOB-CLLJXQQHSA-N 436.390 2.472 10 20 IECD O=C(/C=C/c1cc2ccccc2o1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1797136279 AVPWBHHNEKOMDB-YPIOULGTSA-N 449.463 2.156 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nn1 1798719740 ISSXGRNXUYAAQY-ITJFMEAMSA-N 444.875 2.212 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3ccno3)C2)CC1 1808329274 JKYWMWQAVJPMTA-HWKANZROSA-N 427.457 2.350 10 20 IECD O=C(c1ccc(Br)cc1O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250542 KDRMJLOXZYHWKX-UHFFFAOYSA-N 448.273 2.092 10 20 IECD C[C@@H](CC(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847056284 ZONNPEONDRHBQY-HNNXBMFYSA-N 431.583 2.244 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1 728980260 YZRUDDMPFXNJRJ-RHSMWYFYSA-N 434.514 2.349 10 20 IECD CC[C@](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)(C(=O)OC)c1ccccc1 731842297 BDRWJAXBTHSRPC-XMMPIXPASA-N 425.529 2.412 10 20 IECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1c[nH]c2ccccc2c1=O 731858288 JUNOPACIUKZKCK-QGZVFWFLSA-N 435.480 2.171 10 20 IECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1 732576140 PNGNKHNHIYQQKB-GOSISDBHSA-N 437.544 2.341 10 20 IECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n(C)n1 737107661 OGQWGNYBARUSMH-UHFFFAOYSA-N 439.438 2.093 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 741091054 WGFWXFBHSMPEDC-UHFFFAOYSA-N 434.496 2.459 10 20 IECD O=C(CNS(=O)(=O)c1cccs1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800496 SPBKRLMCDUTHGC-CYBMUJFWSA-N 445.513 2.413 10 20 IECD CN(CCCC(=O)N1CCOc2cc(N(C)C)ccc21)C1=NS(=O)(=O)c2ccccc21 742952260 ISZZCVFMVMXLIY-UHFFFAOYSA-N 442.541 2.339 10 20 IECD C[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCN1C 745738073 SMSMJLDPTWWFDR-PKOBYXMFSA-N 441.555 2.224 10 20 IECD O=C(CN1CCN(c2cc(F)ccc2F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 750070150 BVYPWFQWZLVCEE-UHFFFAOYSA-N 448.489 2.379 10 20 IECD COC(=O)C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 752955851 HQDOBSNVDSZFEK-KRWDZBQOSA-N 427.448 2.230 10 20 IECD Fc1cc(CNC(=S)NC[C@@H]2CCCCO2)ccc1N1CCN(c2ncccn2)CC1 758208616 HMBYDDCZZTWSTD-SFHVURJKSA-N 444.580 2.476 10 20 IECD COc1cc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759221828 SITASXBXPYTPTD-UHFFFAOYSA-N 446.416 2.491 10 20 IECD COC(=O)c1cc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cn1C 759513059 IWYUFGKFAHDFEO-UHFFFAOYSA-N 429.521 2.154 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(S(C)(=O)=O)CC3)cc2F)C[C@H](C)O1 760745416 VRTWCYROBYBZNT-GJZGRUSLSA-N 427.542 2.158 10 20 IECD COc1cc(CN(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1OCC(N)=O 768208153 ODQOCXWCTOTESQ-UHFFFAOYSA-N 429.517 2.037 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc(Cl)nc3)CC2)cc1 778334383 KITDUCAIUWTOCT-CMDGGOBGSA-N 428.920 2.307 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1 785296109 BQFUVRTYHZQXBB-AWEZNQCLSA-N 448.541 2.497 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3c(C)cc(C)cc3C)CC2)cc1 787308719 XXGIGWJOKFSIAQ-UHFFFAOYSA-N 438.572 2.175 10 20 IECD O=C(NCCSC(F)(F)F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 788525172 BXTKRLHMMRQKBR-UHFFFAOYSA-N 444.523 2.204 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@H](OCC(F)(F)F)C1 789854194 DLFLFOJJCWKTEB-KRWDZBQOSA-N 445.507 2.426 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(F)cc2I)c(O)c1 797390530 XLEYSKIWSINQRN-UHFFFAOYSA-N 444.200 2.399 10 20 IECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803309530 ZFWOORXHUDLVLS-WOJBJXKFSA-N 430.593 2.185 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cc1F 803663549 RZWAQAAGTDXCGS-AZUAARDMSA-N 434.462 2.348 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)C2CC2)cc1 806088246 PMOVQASILKVUHN-FGZHOGPDSA-N 428.577 2.003 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1Br 806846081 BMYZCCKTJMNDGY-UHFFFAOYSA-N 447.333 2.472 10 20 IECD O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NCc1cc(Cl)cc(Cl)c1O 807838389 PZDYPPANBOVWQY-UHFFFAOYSA-N 438.315 2.234 10 20 IECD O=C(COC(=O)c1cc(F)cc2nccnc12)NCc1ccc(N2CCOCC2)c(F)c1 917982974 DSXSZVSOSJDYGT-UHFFFAOYSA-N 442.422 2.218 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1CN1CCOCC1 918190216 UZYFGDLLUBKURN-UHFFFAOYSA-N 442.535 2.494 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1 1317889302 NIDCFTCHSKVMAC-UHFFFAOYSA-N 434.905 2.304 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)Cn2cccn2)cc1 1795870838 SBVDZPWSYXIEOQ-RUMRUAAYSA-N 447.539 2.194 10 20 IECD O=C(C[C@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601067 SMOQBVJFEQVDGW-AJYBTWMASA-N 437.496 2.449 10 20 IECD CC(C)COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccn1 1796601365 YISTWTJHGRDZEX-BCDXTJNWSA-N 440.500 2.488 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cncc(F)c1 1796932456 AJZLVNPYUBMRGW-GGPHIMKMSA-N 435.459 2.265 10 20 IECD Cn1nncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816038536 TVBSNSQZBADORE-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD CCOC(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)OCC 1817848479 LYLIABZJSKQIRX-HNNXBMFYSA-N 447.492 2.311 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824754791 BOEOMHKPOSMUPR-KRWDZBQOSA-N 447.532 2.458 10 20 IECD Cc1ccc(OCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1842750461 PXGVXNXOGWJEKH-UXBLZVDNSA-N 438.480 2.407 10 20 IECD Cc1cc(C(=O)COC(=O)CCN2C(=O)CCC2=O)c(C)n1-c1ccc2c(c1)OCCO2 12957963 TVRMYUMVIIVQQG-UHFFFAOYSA-N 440.452 2.130 10 20 IECD C[C@@H](NC(=O)NC1CCN(C2CCN(C)CC2)CC1)c1ccc(N2CCOCC2)cc1 726246780 QOFDYRODOBCZOR-LJQANCHMSA-N 429.609 2.442 10 20 IECD O=C1CCc2cc([N+](=O)[O-])c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 726968318 ITDBROJKJFIBPG-UHFFFAOYSA-N 430.486 2.326 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(F)cc3Cl)cc2)CC1 726975921 GUIBMMATNPUPBV-UHFFFAOYSA-N 432.926 2.192 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 727170937 GAYPKDJMIBYLJZ-UHFFFAOYSA-N 434.562 2.274 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)N(C)Cc3ccccc3O)CC2)cc1 732203629 ZHOURAXPHVRHJI-SFHVURJKSA-N 431.558 2.054 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(C[C@H]2CCCO2)CC1 734275411 YONQDROMEIHQFA-HSZRJFAPSA-N 430.593 2.338 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)NC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 738440527 UXNGSJPHRPINTI-INIZCTEOSA-N 440.500 2.325 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C[C@@H]2CCOC2)CC1 749852433 FSUPMOSWTUYMIO-ROUUACIJSA-N 447.535 2.443 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3C[C@@H](O)c3cccs3)CC2)cc1 753865946 ILLCGPIGNVALFF-PZJWPPBQSA-N 445.585 2.230 10 20 IECD COc1cc(N2CCN(CN3C[C@H](c4cccnc4)CC3=O)CC2)cc(OC)c1OC 758962678 AAKZBCPYCLVOEB-GOSISDBHSA-N 426.517 2.203 10 20 IECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 770021287 WIAMRARZBKYPHE-LBPRGKRZSA-N 441.531 2.093 10 20 IECD CN(CCN(C)C1CC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771573664 DCOBLKBHNUVWRR-UHFFFAOYSA-N 448.501 2.267 10 20 IECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1 772685285 AVPZSWZPTXAJJB-UHFFFAOYSA-N 437.587 2.324 10 20 IECD COc1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1OC 772906434 PCGGUZMEWRTOCG-UHFFFAOYSA-N 433.480 2.416 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@@H](O)c3ccc(F)cc3)CC2)cc1 778389287 GCRRBYCNSDFWEI-HDIXNIEBSA-N 441.503 2.277 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 781442425 FUNYPBKYIMJPNT-INIZCTEOSA-N 430.432 2.464 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1 785297413 RVFURZLXGQNEQZ-CYBMUJFWSA-N 433.892 2.274 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 785522333 FPMPZPACTZFQBI-MRXNPFEDSA-N 446.573 2.016 10 20 IECD Cc1cc(C)c(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 787302205 CBMCSHCMRVKFBE-HXUWFJFHSA-N 436.556 2.246 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@@H]2CCC[C@@H]2[C@@H]1C(N)=O 787333444 ZTCQOWWUDJMSKK-FEGUVQJSSA-N 431.492 2.375 10 20 IECD CN(Cc1nc(C(F)(F)F)cs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324292 SDCUVNCPCPRTKY-UHFFFAOYSA-N 442.463 2.273 10 20 IECD COc1ccc(O[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 788404298 WMPAFUPRGVSWDP-GOSISDBHSA-N 441.528 2.074 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cc1 788974578 HCCDWVZTCNRICR-UHFFFAOYSA-N 438.576 2.341 10 20 IECD CO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 789798904 FRAHGYBWUKXGKW-FQEVSTJZSA-N 449.910 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CC[C@@H]3CCCCN3C)cc2F)C[C@@H](C)O1 789824310 IACKAEPPIAWFTH-GGPKGHCWSA-N 448.583 2.388 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@H](c2ccsc2)C1 789841229 VHBRIYPUIBAKLD-FQEVSTJZSA-N 447.532 2.065 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)ccc(C)c3[N+](=O)[O-])CC2)cc1 790844740 ZRXLJZFGSZHNOW-UHFFFAOYSA-N 448.545 2.321 10 20 IECD COc1ccc(N2CCC(NCC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 798272024 XFKUAGRCOYOZJE-UHFFFAOYSA-N 432.565 2.333 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(F)c(F)cc(F)c3F)cc2)CC1 800936265 YYCZYQSIAOUWAW-UHFFFAOYSA-N 445.438 2.390 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCCC[C@@H]1CCO 803451302 JAELQBYMOPHCMF-QGZVFWFLSA-N 425.476 2.137 10 20 IECD COC[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451540 OKSJIFGFIILULF-HNNXBMFYSA-N 425.476 2.258 10 20 IECD CCOC1CC(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 805642746 DTJYJSYTHJZNEY-UHFFFAOYSA-N 434.514 2.283 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@H](C)[C@H]1OC 809659525 QGRSPTYGTTZFGP-IOMROCGXSA-N 431.577 2.438 10 20 IECD COc1cc(N2CCN(C[C@](C)(O)CNC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 809976525 HJUKINJDPNYXHS-JOCHJYFZSA-N 439.553 2.110 10 20 IECD O=C(CN1CCCC[C@H]1COC(=O)NC1CC1)NCc1ccc(N2CCOCC2)c(F)c1 810037825 VZDRNONXQXCVAF-IBGZPJMESA-N 448.539 2.022 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cn(Cc2ccccc2)nn1 815397136 KJCXWCGYJOKSFV-UHFFFAOYSA-N 436.541 2.135 10 20 IECD COc1cc(N2CCN(C(=O)/C=C/CN(C)CC(F)(F)F)CC2)cc(OC)c1OC 816100668 OVXBROBOQNWMRG-AATRIKPKSA-N 431.455 2.411 10 20 IECD COC(=O)Cc1csc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)n1 915313484 BDLOXIIBYDHEIM-UHFFFAOYSA-N 447.561 2.201 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918439895 WMICZLUCRKGGTM-UHFFFAOYSA-N 444.463 2.220 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 920926910 RQMCIYPXHSUTHH-GOSISDBHSA-N 438.528 2.176 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3ncccc3F)C2)C1 1779809129 DYBNBEAYKIEMDG-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243313 GWEAIXAZYUNWIH-MIUNTBIASA-N 449.866 2.192 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)ccn1 1790244997 KWAGZXZRIGDDKL-QOKNQOGYSA-N 445.903 2.362 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c(O)n1 1804288855 NKYAXCPBBKYHHA-PNEROLJOSA-N 439.468 2.178 10 20 IECD O=C(CCc1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804331372 VOFRXWARHBOJOR-BTTYYORXSA-N 437.612 2.179 10 20 IECD CN(C)CC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806463146 IXWUGZHUTRWJOR-KUHUBIRLSA-N 432.908 2.027 10 20 IECD COCCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877445 KYAWSMBTSBYXIK-JHTBKMLMSA-N 432.517 2.473 10 20 IECD [N-]=[N+]=NCCOCCOCCOCCOCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2332239867 UUGWWCFQDPJYFA-UHFFFAOYSA-N 428.402 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnnn3-c3ccccc3OC)CC2)cc1 23879886 IJUSCSJQDPIBKM-UHFFFAOYSA-N 440.529 2.120 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(c4cc(F)ccc4F)=NO3)CC2)cc1 732656047 POYHTFRCXIILGG-QFIPXVFZSA-N 444.482 2.405 10 20 IECD C[C@H](CS(C)(=O)=O)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 733246247 KCDUWQOWQILXGO-NASPGAHYSA-N 432.614 2.279 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 735883543 BGZLMBDHPZTUOA-UHFFFAOYSA-N 432.546 2.125 10 20 IECD Cc1noc([C@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)n1 747300638 JHPAPLQSUAFXTQ-MSOLQXFVSA-N 426.521 2.169 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn([C@H]3CCOC3)c2)cc1 751549659 ZPQZGQYSAIPIBN-INIZCTEOSA-N 428.536 2.187 10 20 IECD COc1ccc(CCN2C(=O)C[C@H](N3CCN(c4ccc(OC)c(F)c4)CC3)C2=O)cc1 753976870 CZHSTEJKGJZJOO-NRFANRHFSA-N 441.503 2.335 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c(OC)c1 761272822 YEKISZHJIVQERA-UHFFFAOYSA-N 445.538 2.140 10 20 IECD O=C1C[C@H](c2cccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)c2)CN1 772473059 VXIAZVBLWYKMHW-SFHVURJKSA-N 438.553 2.098 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1OC 773768909 NDXLVFSSSCXTNF-AWEZNQCLSA-N 436.530 2.498 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OCC(=O)N(C)C)c1 773858454 QMKFFHXRQUYDEC-MRXNPFEDSA-N 426.517 2.344 10 20 IECD C[C@H](O)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 774246432 VQTKVTAPSXVTQC-BQFCYCMXSA-N 437.968 2.191 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(C(=O)NCC(F)(F)F)n(C)c2)c1 775707022 UCTDKQXCYXVOOF-JTQLQIEISA-N 435.424 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4ccc(F)cc4[nH]3)CC2)cc1 778298291 PIRLCAMORNZTGL-HJWRWDBZSA-N 437.475 2.232 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(Cn2cncn2)CC1 779233213 NKDSPGOGKZQKBG-UHFFFAOYSA-N 447.542 2.398 10 20 IECD Cc1nc(Cn2nnc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2C)no1 783852938 MMDQFBJLZSLKQA-AWEZNQCLSA-N 447.446 2.326 10 20 IECD C[C@H](CN1CCOCC1)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413352 PHKAOWBRRMENLA-CYBMUJFWSA-N 426.516 2.132 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)cc1 785438215 ANXUDBOPVZZGRH-OAQYLSRUSA-N 426.586 2.103 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)OCc3ccccc3)cc2)CC1 786259501 QLRKXMVSXZYJCF-SFHVURJKSA-N 438.528 2.286 10 20 IECD Cc1nc(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 786481839 HWPFFAAKRRHPME-AWEZNQCLSA-N 438.500 2.497 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 787191207 PZCGGFXRHUKOQZ-SFHVURJKSA-N 439.560 2.258 10 20 IECD O=C(NCCCNc1ccccn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788643806 LHFVGUPQRSJJJN-MRXNPFEDSA-N 447.486 2.386 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 788930540 BXSNLUKBACWWTO-QFIPXVFZSA-N 429.561 2.480 10 20 IECD CN(Cc1cccc(N(C)C)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811795 ISCOJTYDOCSRPW-UHFFFAOYSA-N 428.508 2.003 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCN1C(=O)NC(C)(C)C1=O 791249920 LXRLGWWJRXICOF-UHFFFAOYSA-N 446.548 2.486 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn(C(C)(C)C)nn3)cc2F)C[C@H](C)O1 791636715 GJXGSPPDHKWKLS-GJZGRUSLSA-N 447.511 2.259 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)c1ccc(S(=O)(=O)NC)cc1 793936652 LLYSJMUKWIWYQN-MRXNPFEDSA-N 447.557 2.306 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)c(O)c1 797389032 MFSRJSPZRARFAX-UHFFFAOYSA-N 438.440 2.495 10 20 IECD CCOC[C@@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803450197 DXLSWRDQFQKYGJ-OAHLLOKOSA-N 425.476 2.258 10 20 IECD COCCO[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677305 LZIXCVIFPKBJBW-VXKWHMMOSA-N 447.576 2.008 10 20 IECD O=C(NCCc1ccn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804107584 SHYRHMUHZGHTPD-JOCHJYFZSA-N 448.523 2.444 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCOC4(CCSCC4)C3)CC2)cc1 804317636 KOASAWOURMCKMX-SFHVURJKSA-N 447.601 2.341 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCc3cccs3)cc2F)CC1 805007554 LXGKSTNUPGNMBH-UHFFFAOYSA-N 432.565 2.394 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3C[C@H](c4ccccc4)OC3=O)CC2)cc1 808589890 HLQJDUKYMLABQJ-NHCUHLMSSA-N 438.480 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc5n[nH]cc5c4)n3)CC2)cc1 809464693 KNCGDEQLSXIECP-UHFFFAOYSA-N 432.484 2.437 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(C4CC4)n3)CC2)cc1 815330685 GEYUVEPCNDCWDW-UHFFFAOYSA-N 437.544 2.235 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)sc1C(C)=O 815351584 IYSOWUKQOIJUPZ-UHFFFAOYSA-N 444.513 2.378 10 20 IECD CNC(=O)NC(=O)[C@@H](C)OC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 913362280 VLNMPUYVCVBFOC-QSARLWQPSA-N 441.556 2.117 10 20 IECD Cc1cc(C(=O)N2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)c(C)n1-c1ccccn1 917251878 MBMRUWWFVHVDRW-UHFFFAOYSA-N 437.544 2.065 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)cc1C 917758128 JAIYLRDNGKJPDX-UHFFFAOYSA-N 428.488 2.050 10 20 IECD CN(CCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 918117041 FPFNACIQULJPEY-SFHVURJKSA-N 447.580 2.445 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918309551 AOUBFRRKSCBANI-UHFFFAOYSA-N 440.500 2.087 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309944 HKSQKMILGXCMGM-UHFFFAOYSA-N 444.919 2.133 10 20 IECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 918439602 NTJCXYZNGBLFQM-UHFFFAOYSA-N 442.491 2.309 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4cccs4)n3)cc2F)C[C@H](C)O1 918700122 ZIJLNOKRVSFQAD-KBPBESRZSA-N 430.509 2.471 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 1341391389 UIDWZHKFWZAAPW-KRWDZBQOSA-N 447.557 2.110 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1CCCSC1 1814136328 GYMJHZYOSITWCB-RZQQEMMASA-N 442.541 2.351 10 20 IECD Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1 1815976454 JYFWBGDAICBXMV-KRWDZBQOSA-N 436.472 2.468 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728117 JEULFTXVVHVDJE-HIFRSBDPSA-N 445.545 2.048 10 20 IECD CC[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824086494 SIBCDYBJSYGWGX-XJMNNFRSSA-N 432.517 2.207 10 20 IECD O=C(c1cc2n(n1)CCC2)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428506 SCXLYEAFYGGGAK-LJQANCHMSA-N 439.516 2.183 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)C23CC(C2)C3)CC1 1832470568 QPYUUIACNSYAGU-PKAMJGAUSA-N 435.615 2.267 10 20 IECD O=C(CCC1CCC1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833397802 MGZJRNSCDMBKBZ-UHFFFAOYSA-N 430.549 2.258 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN1CCCN(c2ccc(OC)cc2)CC1 108092337 XKDOLOQVMJXOKZ-HSZRJFAPSA-N 437.540 2.334 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NCCN3CCN(c4ncccn4)CC3)ccc21 484726620 HNXRSIBHFZOLOG-UHFFFAOYSA-N 436.560 2.247 10 20 IECD CC(C)(C)OC(=O)C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 727437316 IXFGIXXEEXUHDQ-UHFFFAOYSA-N 435.540 2.332 10 20 IECD CCOC(=O)N1CCC(NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730111861 PATLEAQBKTVRLM-UHFFFAOYSA-N 435.544 2.388 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 742284698 XICUMMPDSGKMKJ-MRXNPFEDSA-N 425.551 2.125 10 20 IECD C[C@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC(=O)NCC(F)(F)F 744474843 YQBZIJBTYMFLCB-JTQLQIEISA-N 448.353 2.395 10 20 IECD CCN1CCC[C@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745648654 SUNSYFONVWNAAK-FQEVSTJZSA-N 449.615 2.344 10 20 IECD CN(C)c1ccc(CNC(=O)CN2C(=O)C(=O)N(C34CC5CC(CC(C5)C3)C4)C2=O)cc1 749343641 OLLWQJRUCNNODO-UHFFFAOYSA-N 438.528 2.128 10 20 IECD O=C(COc1ccc(N2CCCC2)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 749792007 UEXBRIGFBQLSEK-UHFFFAOYSA-N 445.541 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(CN4C(=O)CCC4=O)cc3)CC2)cc1F 753742640 UMKBKQQNIGPMPI-UHFFFAOYSA-N 425.460 2.446 10 20 IECD O=C(CN1CCC[C@@H]1C[C@@H](O)c1ccco1)NCc1ccc(N2CCOCC2)c(F)c1 758822395 HKWPYICPYXUTFS-WIYYLYMNSA-N 431.508 2.460 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 760199963 DWUBDTKMWQINRI-UHFFFAOYSA-N 434.500 2.009 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccc3nnc(O)n3c2)NC(=O)OC(C)(C)C)cc1 762986754 BIRABODNKUDMCU-KRWDZBQOSA-N 440.504 2.497 10 20 IECD Cc1ncc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(N)n1 767404530 BXEJQCDHISBURL-NSHDSACASA-N 430.420 2.327 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1 767686702 PGGKYZDXSBPHRH-UHFFFAOYSA-N 438.440 2.015 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21 773746000 SNNJOMODSUFQMX-AWEZNQCLSA-N 431.514 2.006 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 775258987 DHPNLDMMJGJAAV-QGZVFWFLSA-N 446.573 2.029 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(Cc2cc(Br)cc(C)c2O)CC1 775675815 DVAMEIQJXWXREM-HNNXBMFYSA-N 428.371 2.122 10 20 IECD C[C@@H](NCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 775838387 YAAZURYKSSJKDU-QGZVFWFLSA-N 448.564 2.075 10 20 IECD COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778417919 CQWVAVONNWBNGM-PVAWZGFLSA-N 443.544 2.138 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 779489504 PYJZXUATNTWBAN-WEVVVXLNSA-N 428.510 2.133 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 782460225 ZMJNVOCKFIERHH-UHFFFAOYSA-N 436.505 2.300 10 20 IECD COc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1S(=O)(=O)NC(C)(C)C 782597317 FSSMCFYIXCMXAA-UHFFFAOYSA-N 437.470 2.223 10 20 IECD C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439425 OZMRIQBQWRVTOY-MAUKXSAKSA-N 448.564 2.246 10 20 IECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 785601464 VFOUPGYQYJVUIK-NRFANRHFSA-N 449.580 2.495 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)CC1 786256613 HFIIGQGUQLCKAY-IBGZPJMESA-N 438.503 2.164 10 20 IECD CC[C@@H]1CN(c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313369 RPPCPPGMVUOVND-OAQYLSRUSA-N 436.556 2.267 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1 788976511 ZUXPUANVIRTORC-UHFFFAOYSA-N 431.558 2.010 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@@H](Cc2ccccc2)C1 789800771 PNMQFEYTNNAKAI-FQEVSTJZSA-N 425.504 2.370 10 20 IECD C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 793911356 AMVUAFXIKOKCNJ-BGYRXZFFSA-N 444.620 2.354 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 801550086 NHIAOLFZQFWGBM-UHFFFAOYSA-N 448.321 2.427 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCN(C2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803306056 RQSUBMPUVNUCBC-IBGZPJMESA-N 428.577 2.177 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803306518 VVHXKEOALLIBFB-QGZVFWFLSA-N 448.564 2.074 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3c(C)c(C(F)(F)F)nn3C)CC2)cc1F 806935574 TZDTUFVASFGJEF-UHFFFAOYSA-N 443.401 2.182 10 20 IECD CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290677 MCMRTKBAWIGTRG-IBGZPJMESA-N 428.533 2.147 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCN(C)Cc3ccc(F)cc3)CC2)cc1 807807632 DRLXTNXURVCBFI-UHFFFAOYSA-N 442.535 2.121 10 20 IECD CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442856 UQLRVXJSTBFYEF-UHFFFAOYSA-N 439.512 2.327 10 20 IECD CN1CCN(c2ccc(CN3CCc4ccc(S(=O)(=O)N(C)C)cc43)cc2F)CC1 1324536929 MBOOWSAMGYBECV-UHFFFAOYSA-N 432.565 2.391 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)o1 1790245655 WYLMOXRIGNFRNY-AXHNFQJDSA-N 448.903 2.489 10 20 IECD CNCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807140918 ZKJDVRLYLIARSD-MGPUTAFESA-N 446.935 2.465 10 20 IECD C[C@@H]1CCc2c(C(=O)N3CCC4(CCCN(C(=O)c5cc(O)nc(O)c5)C4)CC3)n[nH]c21 1810551283 GJBXYACFHRWGJI-CQSZACIVSA-N 439.516 2.424 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnoc1 1818185134 QXQMYYPFGKWNAH-GOSISDBHSA-N 447.455 2.497 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C2CCCC2)[nH]n1 1823496266 JODLUQXLCDTVAO-CQSZACIVSA-N 435.575 2.452 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nc2nccn12 1845502189 YLKHZYNSXVWRAR-UHFFFAOYSA-N 441.875 2.233 10 20 IECD CC(C)c1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)co1 1848308353 DWBZEYXFSCJSLF-IRJXADNDSA-N 427.457 2.444 10 20 IECD CC[C@@H](C)[C@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)OC 26865183 XWPVWHGAHHVIIX-XCLFUZPHSA-N 437.448 2.323 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1 108577960 XJUYUDFYIIYRMM-UHFFFAOYSA-N 427.501 2.181 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN([C@@H](C)C(=O)NC4CC4)CC3)cc2)CC1 303381213 MPRBGCUOUPUZQQ-IBGZPJMESA-N 427.593 2.417 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1 728980238 YQIOVVPGCQVNSY-LBPRGKRZSA-N 437.518 2.284 10 20 IECD Cc1cc(C(=O)Cn2nc(C(N)=O)ccc2=O)c(C)n1-c1ccc(Br)cc1 729152827 WXFNERJQXOORIS-UHFFFAOYSA-N 429.274 2.395 10 20 IECD O=Cc1cccc(OCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 733255231 LEJSJVSZLXCGQP-UHFFFAOYSA-N 449.486 2.450 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc4c(c3)CCO4)CC2)cc1 748965005 ACDOGIXWECYZAF-UHFFFAOYSA-N 431.558 2.121 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](c4ccccc4F)C3)CC2)cc1 754030181 LWXHEQSGJHHVDV-YKSBVNFPSA-N 429.536 2.391 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCc4n[nH]cc4C3)cc2F)C[C@@H](C)O1 757819965 QAGVNTKDKGBICB-INMHGKMJSA-N 444.507 2.127 10 20 IECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)c(F)c3)CC2)c1 768202166 YJUCHMYMMUOBSC-UHFFFAOYSA-N 437.537 2.415 10 20 IECD COC(=O)CCc1csc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n1 769012343 JYIWODAKGVAXAO-UHFFFAOYSA-N 447.561 2.201 10 20 IECD CC(C)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1nccs1 770267576 GTNURTRSLFCOJY-CYBMUJFWSA-N 426.520 2.003 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 770761981 RZJMZCVBZMRJTE-MRXNPFEDSA-N 430.455 2.406 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](c3ccco3)N(C)C)cc2F)C[C@@H](C)O1 774840954 GWFCZGBCKQSRCU-YRNRMSPPSA-N 446.523 2.068 10 20 IECD C[C@@H](NCC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1ccc(N(C)C)cc1 775836642 OTCCETIUQZZCDE-LJQANCHMSA-N 444.601 2.077 10 20 IECD CN1CCc2cc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 778581125 FDGYONXLHXBRIK-UHFFFAOYSA-N 427.476 2.128 10 20 IECD CC(=O)N[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 779378693 QGZRJAVYEOYRKI-ZUOKHONESA-N 436.464 2.493 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cnc(-c2ccccc2)nc1 780046180 DFXMOVMRQSSQSR-UHFFFAOYSA-N 449.486 2.499 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1 785294813 NRMNKMVGSNWMIG-SNVBAGLBSA-N 442.440 2.125 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(OC)c1 785472761 BLJGFNHOQOJIJL-UHFFFAOYSA-N 434.514 2.139 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 788314059 XPYKSIOVPKJCMU-FQEVSTJZSA-N 431.920 2.297 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)C1 793729579 AHMAVFRTWKPHJU-FGZHOGPDSA-N 448.567 2.096 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1 798097980 JLUBYAXRHKZNDZ-CYBMUJFWSA-N 425.482 2.221 10 20 IECD Cn1[nH]cc2c(=NC(=O)c3ccc4c(c3[N+](=O)[O-])C(=O)c3ccccc3C4=O)ccnc1-2 801703934 ZJPBJRZFPGOGEM-UHFFFAOYSA-N 427.376 2.278 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@H](N2CCCC2)C1 803448542 TXJSLMCABHDFLQ-SFHVURJKSA-N 436.503 2.070 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)cc1F 803662920 JLQSJYLEBXEDKZ-UHFFFAOYSA-N 429.492 2.373 10 20 IECD C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)S1(=O)=O 813057892 DFGCXLCHSYLSIN-OKILXGFUSA-N 431.505 2.474 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1nc(CC(F)(F)F)cs1 815356147 DTLKRNOAXNEDEM-UHFFFAOYSA-N 446.426 2.479 10 20 IECD Cn1cnc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)c1Cl 914577241 VBXBFCDNFMWNGY-UHFFFAOYSA-N 432.936 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(Br)cc3C(N)=O)CC2)cc1 1317895901 PKWAINKCULKWCZ-UHFFFAOYSA-N 447.333 2.317 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)ccc1NC(=O)N(C)C 1320397493 HQZOOYQVVWWDRQ-KRWDZBQOSA-N 429.473 2.404 10 20 IECD COCCNC(=O)[C@H](Cc1ccccc1)NCc1ccc(N2CCN(C)CC2)c(F)c1 1324927393 LPYNUTPOBDXQBH-QFIPXVFZSA-N 428.552 2.041 10 20 IECD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1794456556 BTMUPWMYKPOSPT-NUZGMZIFSA-N 445.523 2.364 10 20 IECD CC(C)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1800692384 SYVOEDHHVVLBEI-BBIADKPPSA-N 439.512 2.062 10 20 IECD CN(C)c1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1 1807430313 URJMFCILOMHFHB-UHFFFAOYSA-N 439.516 2.112 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469396 MMDGXEMCTSEALA-GCJKJVERSA-N 431.496 2.290 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(O)cc1 1811933313 XVMRLUGXPLKWSG-IERDGZPVSA-N 434.452 2.227 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2COc3ccccc3O2)C1 1841898342 AEGLUBKXJSPCPQ-GOSISDBHSA-N 444.871 2.408 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccncc2Cl)C1 1844440538 CAKOZRKKLNFHSI-UHFFFAOYSA-N 437.887 2.345 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CC23CCCN2CCC3)C1 1845117008 ZUVDUVXDTGFQDC-UHFFFAOYSA-N 449.555 2.001 10 20 IECD COc1ccc([C@@H](O)C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cc1 1845500202 BWZNBEZLEVINCT-GOSISDBHSA-N 446.887 2.310 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)COc2ccc(F)cc2)CC1 97325040 RTNDQZIRGNQOBU-UHFFFAOYSA-N 442.535 2.073 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(CCNS(C)(=O)=O)s3)CC2)cc1 726560525 ACEGPDTTXYFDSO-UHFFFAOYSA-N 437.587 2.247 10 20 IECD CS(=O)(=O)N1CCC(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726564455 KLEHTSUUAPYJDO-UHFFFAOYSA-N 431.505 2.045 10 20 IECD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565851 GPCNWINFBVOVKS-AFHBHXEDSA-N 445.466 2.180 10 20 IECD CCN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 729233750 PTCJCRQUMOEXDE-GOSISDBHSA-N 447.580 2.445 10 20 IECD CCNC(=O)COc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958113 LQOOGQPDIRIQCX-UHFFFAOYSA-N 425.485 2.041 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 749553600 JBSRDDXABJFUTA-WSTZPKSXSA-N 434.556 2.303 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)NC(=O)CC3CCCCC3)CC2)cc1 749852368 YYOSJXXYMQKOTM-IBGZPJMESA-N 430.593 2.409 10 20 IECD CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 751095473 GRXQZANTTFFJIU-UHFFFAOYSA-N 427.593 2.489 10 20 IECD COC(=O)c1nscc1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 751455736 GRDMWWSBFULAKF-LLVKDONJSA-N 447.485 2.478 10 20 IECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)N(CC)Cc1cc(Br)ccc1O 751469546 YGMLZNJWQJSSOB-AWEZNQCLSA-N 435.340 2.249 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(-c2ccc(Cl)cc2)n1 751643196 KBUNSGHYJXLXBW-UHFFFAOYSA-N 445.932 2.086 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)Nc1ccsc1 762639521 GRUOBUMNPMELJY-UHFFFAOYSA-N 440.504 2.259 10 20 IECD COc1cc(CNC(=O)NCc2cccc(Br)c2O)ccc1OCC(N)=O 765466500 SPRWSLRUXDOXTL-UHFFFAOYSA-N 438.278 2.027 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(-c4ccc(OC)cc4)[nH]n3)nc12 767572450 JWPDHJAFQGNCST-UHFFFAOYSA-N 437.412 2.367 10 20 IECD COC(=O)C1(N(C)CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCCC1 770243305 UGTGMEPKBMBKIN-UHFFFAOYSA-N 447.557 2.342 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(N(C)C)cc1 773860196 WMMGKWYCKSBMFL-OAHLLOKOSA-N 430.530 2.108 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1 775276649 OZAULHAMNYCHIL-UHFFFAOYSA-N 426.442 2.398 10 20 IECD Cc1n[nH]cc1-c1nnc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 782093352 OGOCJMVEKVQJQC-CQSZACIVSA-N 440.533 2.260 10 20 IECD COC[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCOCC1 783221078 GBAZXCKUWCTCAL-NRFANRHFSA-N 429.540 2.474 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C(N)=O)ccc1-n1cc(C)cn1 784031029 WGJQKGNIMSXXBV-UHFFFAOYSA-N 435.484 2.363 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(OC)c1 785490133 WOZSVWCQXPYJJP-UHFFFAOYSA-N 434.514 2.438 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cc2)CC1 786258332 CMBXHOPJWBCBHV-UHFFFAOYSA-N 448.483 2.379 10 20 IECD CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 788302693 RWSDIVLFPCPZCN-UHFFFAOYSA-N 442.560 2.442 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(N2CCc3ccccc32)CC1 788324303 SLLFJLGOUWQHJP-UHFFFAOYSA-N 448.567 2.193 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OC)c(Cl)c2Cl)ccc1O 790407080 SFKDHBMAHSGGMC-UHFFFAOYSA-N 441.314 2.417 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C1CCN(S(C)(=O)=O)CC1 791246232 KBROWEJSUFFXKZ-UHFFFAOYSA-N 439.578 2.047 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)[C@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)cc1 792884143 WNVCCWVHWGCHOA-JOCHJYFZSA-N 430.549 2.107 10 20 IECD CC(=O)N1CCC[C@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 794022233 FWHSXQYFYGLVGF-CQSZACIVSA-N 437.543 2.243 10 20 IECD Cc1cnn(C)c1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2 795280911 VLRSZOAIBCOGDC-CYBMUJFWSA-N 438.575 2.378 10 20 IECD COC(=O)N1CCC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 804010628 SGMCJACBCIZQKN-GOSISDBHSA-N 442.516 2.221 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3COC4(CCC(C)CC4)O3)CC2)cc1 804317785 PVMPSAONNRJEHL-SSSUMRQXSA-N 445.560 2.218 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@@]4(CCO[C@@H]4C)C3)cc2)CC1 805026021 ZCPHZHMKFNRFPU-GLDPYIMESA-N 429.561 2.334 10 20 IECD COc1ccc(C)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290538 YLLKVWLCDHZCPV-UHFFFAOYSA-N 448.567 2.340 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCCC(=O)OC(C)(C)C)CC2)cc1 807913627 FIYLRYROKJQAGA-UHFFFAOYSA-N 433.549 2.362 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C(N)=O)nc3)cc2Cl)C1 807954423 RIXWJYKHIOQJHS-CQSZACIVSA-N 443.935 2.003 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808816401 QJBFZVQSNCEPHA-GOSISDBHSA-N 431.558 2.080 10 20 IECD COCC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(C)o1 809692912 JEMDIIUVJKWGPA-HXUWFJFHSA-N 429.517 2.277 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 810368648 CTDSGGBTTHOHAT-PMACEKPBSA-N 428.533 2.397 10 20 IECD NC(=O)c1ccc(CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C2CC2)cc1 918117007 FDODSAFUCDEEGL-HXUWFJFHSA-N 449.555 2.361 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCN(C)CC3)cc2F)C[C@H](C)O1 918202916 QFTRAYAIBWWDEK-ROUUACIJSA-N 435.588 2.265 10 20 IECD CSc1ncc(Cl)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 918340914 YBBHYCQWZFKQQY-UHFFFAOYSA-N 426.951 2.017 10 20 IECD COC(=O)C[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 919723808 JVIVCMATTRJNLB-LNLFQRSKSA-N 435.540 2.473 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc21 920924737 DXNPWEWZEXNNEK-INIZCTEOSA-N 436.512 2.248 10 20 IECD O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=S=C(Cn2cc(Br)cn2)C=C1 1626257071 QOQIYYDPAOOWTF-UHFFFAOYSA-N 430.291 2.112 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(F)cc1F 1793815397 HOKURVNIRMOEGL-BPQKRJORSA-N 445.422 2.442 10 20 IECD O=C(CCN1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823568801 CQJLOPDDERLPMU-MRXNPFEDSA-N 428.493 2.008 10 20 IECD Cc1cc[nH]c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896414 HLRIRECYIVFNRE-INIZCTEOSA-N 448.614 2.417 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2F)C[C@@H](C)O1 108283882 LPPCOWITWVDZHV-LVYXFOGZSA-N 431.508 2.231 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)C1CN(C(=O)c2cccc(Cl)c2)C1 513376029 FYYWJQDCGQWYAG-UHFFFAOYSA-N 435.933 2.459 10 20 IECD O=S(=O)(Nc1ccccc1-n1ncc2c(O)ncnc21)c1cccc2nsnc12 642248190 SBTSQUMQNQIQQE-UHFFFAOYSA-N 425.455 2.327 10 20 IECD COC(=O)Nc1cccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 728656353 HTHKWIBRIFOFIR-UHFFFAOYSA-N 427.457 2.379 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(C)cc([N+](=O)[O-])c3N)CC2)cc1 729509973 GCCSZUPJSVFYAI-UHFFFAOYSA-N 427.505 2.436 10 20 IECD COC(=O)NCCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733542483 HDQPDROEHCIXJL-CYBMUJFWSA-N 438.436 2.468 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1 734471655 SIQQYGFFAFRJLW-GOSISDBHSA-N 433.578 2.118 10 20 IECD CN(Cc1ccon1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 740142627 RZCPEIWEZFCQLW-UHFFFAOYSA-N 432.414 2.361 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1NC(=O)OC(C)(C)C 740928757 SHSFGKNMUQFMFD-IUODEOHRSA-N 427.523 2.139 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 742802215 WOBHUTCYPWKWIG-MRXNPFEDSA-N 445.532 2.435 10 20 IECD NC(=O)CCN(C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(F)cc1 744402690 PYGHMVLXEOQEAO-FQEVSTJZSA-N 429.492 2.421 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 747264039 XLSIVGGLMDEOAT-UHFFFAOYSA-N 434.514 2.438 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnn([C@H]4CCOC4)c3)cc2F)C[C@@H](C)O1 751974303 MAWNOYBYZHMJNS-UXLLHSPISA-N 438.525 2.076 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)Nc1ccc2c(c1)OCCO2 756337298 RNLVEGFXLSTXKW-SFHVURJKSA-N 441.484 2.493 10 20 IECD COc1ncc(N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C(N)=O 761837101 WYEFOKDHKWMNQQ-LBPRGKRZSA-N 444.447 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(O)(c4ccccc4)CC3)CC2)cc1 768588039 CXBGZEQLHHCYFS-VAWYXSNFSA-N 449.551 2.410 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN3CCCC(C)(C)C3)CC2)cc1 769708795 YOWRQYAWBYXOSD-KTKRTIGZSA-N 428.577 2.138 10 20 IECD Cc1ccn(C)c(=O)c1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774278299 HIFPJTJLNZKNEH-AWEZNQCLSA-N 434.443 2.019 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@]4(C3)C(=O)Nc3ccccc34)CC2)cc1 777475469 IVYREKAEGIUUEF-VWLOTQADSA-N 449.555 2.123 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H](N4CCCC4)CC3)CC2)cc1 778288325 XOEZBBCRBYUYLS-ZJVMWOEPSA-N 440.588 2.377 10 20 IECD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NCc1ccc(O)c(O)c1 778926405 UUBVAXZWPQVTKJ-HSZRJFAPSA-N 445.475 2.228 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccnc(C(=O)N(C)C)c1 785191791 HHJSFEMWUNYKRO-UHFFFAOYSA-N 449.305 2.239 10 20 IECD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785303242 IAVSYYLBQVIGOE-HNNXBMFYSA-N 427.501 2.478 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1 785425476 ZXRBXRSLKNGLOQ-INIZCTEOSA-N 443.935 2.295 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc(OC)c(OC)c(OC)c1 785486420 VUXVGMFTICQLLL-UHFFFAOYSA-N 429.517 2.443 10 20 IECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785528383 HFHFLTMARXVUNL-UXHICEINSA-N 430.593 2.409 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1CN1CCCC1 785581529 WPQBMARGWAVHHM-UHFFFAOYSA-N 436.556 2.052 10 20 IECD C[C@H]1N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOC1(C)C 789951229 UOXDVOHFEUGMMP-CQSZACIVSA-N 443.466 2.184 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cscc2Br)SC1=S 794682853 YPGLRHLZRFCGCX-RUDMXATFSA-N 427.392 2.261 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CN4CCC[C@@H]4CO3)cc2Cl)C1 804059416 ZXJVVPLQISKKOT-QRQLOZEOSA-N 448.995 2.172 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 808816329 OKVNPHOYAGKCKQ-IBGZPJMESA-N 445.585 2.470 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 815397274 OKCSMDXIOOABMA-UHFFFAOYSA-N 428.514 2.213 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@]4(CCCO4)[C@@H]3C3CC3)CC2)cc1 819261433 MNUHPKDLYXNKKV-ZRJFSKGGSA-N 425.529 2.070 10 20 IECD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 913305445 RGOQVJYIESLOFM-LBPRGKRZSA-N 448.391 2.137 10 20 IECD CNC(=O)COc1cccc(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920866598 GGDVNPBQKKFOEL-QGZVFWFLSA-N 426.517 2.208 10 20 IECD C[C@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 920920588 NWVWYHXEKRZPSV-QFBILLFUSA-N 443.500 2.052 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3nc(Cc4ccccc4)no3)cc2)C1 921124101 RNLOTDCIZYHCLV-IBGZPJMESA-N 448.527 2.362 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(C(=O)OC)cc3OC)CC2)cc1 1255540791 ZZGBEKMFVQQSHP-UHFFFAOYSA-N 434.514 2.391 10 20 IECD COc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccn1 1323973298 GHLQFHZYJZARCT-HUUCEWRRSA-N 431.464 2.316 10 20 IECD CCc1nc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)co1 1779707913 YWSWQMDPDOGSRR-FQEVSTJZSA-N 435.864 2.059 10 20 IECD CN(C)c1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1802679473 HSXVJCMVSSAKAX-FNLKRUPLSA-N 438.528 2.443 10 20 IECD Cc1ccc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1803548672 SNHBYOYLLVEELA-MUJYYYPQSA-N 431.583 2.416 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cnoc2C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992140 VHTQLJQFRBFCMT-YWZLYKJASA-N 449.467 2.387 10 20 IECD COCCOCC(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809414875 PUOHDUGSLDPAOR-UHFFFAOYSA-N 440.924 2.259 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3nccn23)[nH]n1)c1cc(O)nc(O)c1 1817847294 SSTOAQPSZXFHSY-OAHLLOKOSA-N 447.455 2.483 10 20 IECD Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1822696847 QOGJHOUIBYZUCQ-OAHLLOKOSA-N 426.433 2.061 10 20 IECD Cn1ccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708663 LZBMVAQIVHJEJQ-JTQLQIEISA-N 447.904 2.481 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1832185517 AYNBYYLDMMQKIU-QFBILLFUSA-N 441.532 2.492 10 20 IECD Cc1cccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1848113921 BVTYBYYFOUINML-BDJRERGKSA-N 437.496 2.355 10 20 IECD COc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1NC(C)=O 15360929 UUYSCHJCZRZTCX-UHFFFAOYSA-N 433.530 2.311 10 20 IECD O=S(=O)(CCNCc1ccc(N2CCCCC2)cc1)N1CCN(c2ccccn2)CC1 238019630 HGPBQIOVPQLYFT-UHFFFAOYSA-N 443.617 2.314 10 20 IECD O=C(CN1CCC(N2CCCC2=O)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 729483275 SGSWOQJFNRGAOB-UHFFFAOYSA-N 431.492 2.487 10 20 IECD COc1cccc(CNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)c1O 729859809 ZXZZUNDMPIVRRT-UHFFFAOYSA-N 443.319 2.344 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)n3cccn3)c2)c1 734073056 BLPXEOJRFGEONF-AWEZNQCLSA-N 437.456 2.052 10 20 IECD COC(=O)[C@H](C)[C@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 751034245 YWEYERUHEQZKNA-JPYJTQIMSA-N 425.529 2.484 10 20 IECD O=C(CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Nc1cccnc1 751059906 ALONVYGPPWWSGG-UHFFFAOYSA-N 446.510 2.408 10 20 IECD COc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1C(=O)N(C)C 751136874 MYPTXXVGVVYRFZ-KRWDZBQOSA-N 448.541 2.473 10 20 IECD C[C@H](NCC(=O)N1CCN(C)CC1)c1cc(Br)cc(Br)c1O 756489666 IAMSMIZEBSTKLI-JTQLQIEISA-N 435.160 2.342 10 20 IECD CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758576816 MCMODGKUVFZNLL-SFHVURJKSA-N 443.569 2.284 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1 759013298 PGFHTWVZUDCQDK-UHFFFAOYSA-N 429.484 2.445 10 20 IECD COc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 761899269 WYAIGALDQRGJGE-UHFFFAOYSA-N 449.511 2.032 10 20 IECD Cc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(=O)n(C)c1 766419962 OFMXBCPSQHTVMQ-UHFFFAOYSA-N 434.443 2.019 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 768871748 KZECVIVUZYAWTQ-OAQYLSRUSA-N 429.586 2.448 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnc2n1CCC2 769715674 BPQVDRQABJPFAJ-LLVKDONJSA-N 433.515 2.283 10 20 IECD C[C@@H]1CN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CCN1c1nccn2cnnc12 771174557 WUOLJUNNZISJSI-MRXNPFEDSA-N 444.495 2.477 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(I)cn2)cc1F 773137910 BPPGJQNSASGPNS-UHFFFAOYSA-N 442.232 2.146 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSc1nnnn1C1CCCC1 777827252 YNGXGQTVNBWWSJ-UHFFFAOYSA-N 439.925 2.441 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4cncc(Cl)n4)CC3)nc12 778181279 FJMJMIYDBPWUOU-UHFFFAOYSA-N 432.868 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CCC(=O)N4)CC2)cc1 778239122 QAHIOMSFODAEDH-ZHACJKMWSA-N 434.496 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cc(F)cc(OC)c3)CC2)cc1 778421918 IWCJPBSNSCIHFL-BQYQJAHWSA-N 427.476 2.364 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCCN3CCCCC3)cc2F)C[C@@H](C)O1 785517855 QTFWILXCRJNPSB-QZTJIDSGSA-N 434.556 2.048 10 20 IECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 788007484 KEFWTVBREAHXCA-UHFFFAOYSA-N 426.561 2.222 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 788301145 WPLKDHOOWBFNNU-UHFFFAOYSA-N 440.529 2.132 10 20 IECD Cc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 788402559 RCSOWYYBEWKDKM-KRWDZBQOSA-N 429.492 2.171 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789824099 GMCGOPPLBLBVSX-ONHLAKKPSA-N 433.524 2.129 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H](C)c1ccccc1 793716416 BKGLXFKGRVCJDV-BBTUJRGHSA-N 436.556 2.313 10 20 IECD NS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1Cl 798328058 SBGKQHPULPRHGP-UHFFFAOYSA-N 437.949 2.126 10 20 IECD CCOc1c(OC)cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1OC 803723656 LQCPCGPKVJBNTE-UHFFFAOYSA-N 429.517 2.410 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCCN2CCCCC2=O)cc1 804775866 PSIVYLMSICNUIP-UHFFFAOYSA-N 440.544 2.393 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3nc(C)n(C)c3Br)CC2)cc1 804960712 VUEPLFBVGZIHKV-UHFFFAOYSA-N 443.367 2.401 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(Cc3ccccn3)C(C)C)cc2F)CC1 805009102 WPYUNHMSNKZPCT-UHFFFAOYSA-N 441.551 2.416 10 20 IECD COC[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccco1 806774996 OFBOWCIWEPRFQV-PBHICJAKSA-N 437.443 2.470 10 20 IECD Cn1ccnc1[C@@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769541 HHSQLHFNWIBSMA-CVEARBPZSA-N 447.486 2.123 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)cc1OC 917758075 GREPRZPWIRGSFE-UHFFFAOYSA-N 429.476 2.474 10 20 IECD CN(C)S(=O)(=O)c1ccc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)nc1 1116890892 OYKUAIHQJJUMTC-UHFFFAOYSA-N 440.525 2.155 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnc4c(cnn4C)c3)cc2F)C[C@H](C)O1 1320440747 PUNIKCDXFRWMHU-KBPBESRZSA-N 433.509 2.200 10 20 IECD O=C(NC1(c2ccc(NC(=O)c3cc(C(=O)O)ncn3)cc2)CCC1)c1cc(O)nc(O)c1 1787084911 SQTXTODTYZPTPG-UHFFFAOYSA-N 449.423 2.043 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(OC(F)F)cn1 1796599571 ZSECKRGVWRYHMR-CLLJXQQHSA-N 434.399 2.055 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2)n1cccc1 1802790550 YAZJVQNQFKAFRP-XEYPJELSSA-N 433.512 2.480 10 20 IECD C[C@@H](CC(N)=O)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1806138143 RHLYBNHHVHFRLC-ZDUSSCGKSA-N 437.924 2.108 10 20 IECD O=C(Cc1ccsc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722527 KTCWPCHWQPVSPI-LBPRGKRZSA-N 430.511 2.479 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1[nH]nc2ncccc12 1817913759 LTKVDXCOAZVSFP-AWEZNQCLSA-N 448.443 2.107 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)C23CC(C2)C3)n[nH]1 1823048221 RHEVQKGLUHMPRS-FPGGMFCHSA-N 433.559 2.062 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(Cl)cc2F)C1 1841146348 LCMQQTQBEICFPR-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CCOc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1847184468 IWRJYAUAVZWKMZ-IWDGFTLQSA-N 439.468 2.126 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c3ncccc23)cc1C(=O)O 728017686 WLLQRVAULCKSGR-UHFFFAOYSA-N 439.446 2.244 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1cnn(-c2ccccc2F)c1 742279458 VVOYEEXGZMEIBC-UHFFFAOYSA-N 434.468 2.466 10 20 IECD CCN(CC)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 744423399 HYWVPWFORDIWFP-LJQANCHMSA-N 432.590 2.340 10 20 IECD O=C(Cn1c(S)nc2ccccc2c1=O)NCc1ccc(N2CCC(CO)CC2)cc1 746686663 RWLPFTHTBIJORC-UHFFFAOYSA-N 438.553 2.210 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1 747216958 AAFWAXRNTDKBMY-OAHLLOKOSA-N 434.392 2.126 10 20 IECD NC(=O)CCCOC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 747793247 KCKSEQXPCXJJBK-XYOKQWHBSA-N 443.344 2.459 10 20 IECD Cc1cc(C(=O)CN2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccc(OC(F)(F)F)cc1 747837048 BRBUZTCDQNTCIE-GOSISDBHSA-N 425.407 2.362 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)C[C@@H]2c2ccccc2)c1 748790073 JZPGUUTZXBSBJJ-HSZRJFAPSA-N 437.540 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1F 753740931 ZFIGKTMGFVKKFE-UHFFFAOYSA-N 449.548 2.468 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN(Cc4ccccc4)CC3)CC2)cc1 753997244 ABFSDGCOWSBUHQ-VWLOTQADSA-N 438.616 2.386 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cnccc3SC)CC2)cc(OC)c1OC 759411216 DBFSAZPHTYRWNI-UHFFFAOYSA-N 446.529 2.117 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C)[C@H](n4ccnc4)C3)CC2)cc1 759576417 VHBVBYFKQLXDOJ-SIKLNZKXSA-N 426.565 2.306 10 20 IECD O=C(N=c1cc[nH]cc1F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 759996562 FCVQSPHLBHIURB-UHFFFAOYSA-N 425.443 2.220 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC)c2C)cc1 766360261 ADCCJINISARRRK-UHFFFAOYSA-N 432.546 2.004 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)cc1 767454792 QEWOZBDPIGFXNU-CYBMUJFWSA-N 444.506 2.413 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)c1 769539710 UJOCFCADGZPMET-KRWDZBQOSA-N 428.485 2.125 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 781623677 GZZBESRRSGEQIO-FQEVSTJZSA-N 428.420 2.380 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2sc(C)cc2Br)ccc1O 790407416 LIYHWTXRBRQCND-UHFFFAOYSA-N 441.350 2.234 10 20 IECD Cn1ncc2c1C[C@@H](C(=O)NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)CC2 798405189 CCTRRSZLCQYGME-SFHVURJKSA-N 449.534 2.097 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NOCc3ccccc3OC)CC2)cc1 799095473 AEZUJLIXMWTALF-QXMHVHEDSA-N 425.485 2.157 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1OC(C)C 799262595 DXRUREDQQLQRML-CYBMUJFWSA-N 430.457 2.358 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c(OC)c1 800597816 UEPXHGJTCBSSSS-UHFFFAOYSA-N 427.501 2.446 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@@H]3C[C@@H](O)c3ccccc3)ccc21 803685769 KDYXCJGAQQICJW-JTHBVZDNSA-N 437.540 2.036 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3COC4=O)cc2F)C[C@@H](C)O1 808919126 NHAPYILKSBXBHG-OKILXGFUSA-N 441.459 2.365 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1F 810265279 DIKDZUHAWNYCIR-UHFFFAOYSA-N 444.326 2.249 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ncccc3N(C)C)CC2)cc1 811934067 RAUWXKCGHIQORT-UHFFFAOYSA-N 426.565 2.168 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCN(c4ccccc4)C3=O)nc12 814607945 HOSAYPWAYNPSPH-INIZCTEOSA-N 438.440 2.098 10 20 IECD O=C(C[C@H]1CCCS(=O)(=O)C1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 815044259 AIRVBLJJHJGNFS-CQSZACIVSA-N 434.480 2.373 10 20 IECD Cn1ncc(C(=O)NCc2cccc(Br)c2O)c1I 816496445 KOFULKATJPTEOK-UHFFFAOYSA-N 436.047 2.423 10 20 IECD CCOC(=O)CNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 918631001 KHDBYZIZMRWLQQ-KPKJPENVSA-N 443.344 2.330 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)c(C)nc1O 1116674987 ONQPTYDGUWWYOK-ZDUSSCGKSA-N 439.262 2.174 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H]2CCCO2)cc1 1795899783 RJPRPEZAKUDXMC-IRMYBRCSSA-N 437.540 2.476 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccc(F)cc1 1798929379 MGJIPODJUFLNKT-ZSBFGKGUSA-N 434.851 2.407 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cncc(F)c1 1805844581 FXQNZJVTPCPMQD-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993513 IZZDCFRVDYUWEA-KEEKTEOCSA-N 426.448 2.100 10 20 IECD CC(C)(C)CC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814186247 NAYOARWVAVIIIG-DNVCBOLYSA-N 448.614 2.384 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2c[nH]c3ncccc23)C1 1843673130 ZHVZYRIZDPRYJG-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)N3CC[C@@H](Nc4ccccc4)C3)nnc2n1 110886027 BEDBXPRAEUFAJE-OAHLLOKOSA-N 441.565 2.188 10 20 IECD COc1cccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1O 727761054 LLLGTVWHDZSVRX-GASCZTMLSA-N 434.514 2.129 10 20 IECD CN(CC(=O)Nc1ccc(Br)cn1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 729473018 HFUNZFGALOHNRU-UHFFFAOYSA-N 448.365 2.439 10 20 IECD CCN1CCN(c2ccc(CNC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])cc2F)CC1 731636637 FGBSGHVBHPAIHN-UHFFFAOYSA-N 444.463 2.384 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(Cl)c3)cc21 734420131 VXBJFYHZFVXMSP-UHFFFAOYSA-N 443.934 2.421 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(F)c(F)c(F)c1 741427569 RZYHFEWSQRJSEQ-UHFFFAOYSA-N 425.382 2.459 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)CC1 747480935 IIRKJUAYFXJHPY-OAQYLSRUSA-N 437.606 2.322 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3COc4cc(F)cc(F)c43)CC2)cc1 753304795 WELUNBXHKAPDEI-LIXSYLKWSA-N 443.450 2.428 10 20 IECD COC(=O)CC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 769122584 QPKUHSUFEBGAIK-HUUCEWRRSA-N 438.496 2.188 10 20 IECD CC(C)(C)OC(=O)NC[C@](C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 769783584 GNLNXAFTFNFUQL-IBGZPJMESA-N 427.523 2.187 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 781448291 ABMRJLQRVQIPFK-UHFFFAOYSA-N 443.475 2.076 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781458436 RFCSBPNHQXDHAO-CQSZACIVSA-N 429.448 2.265 10 20 IECD COCCN(C(=O)CN(C)c1ccc(OCc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1 781964433 UWBQEIWPQFKXII-OAQYLSRUSA-N 446.569 2.364 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1 785423969 JDCUTJSGAPYISN-UHFFFAOYSA-N 443.935 2.295 10 20 IECD Cc1nc(CN2CCC(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)oc1C 785428467 MXLRPSNTRUVMEU-UHFFFAOYSA-N 427.549 2.002 10 20 IECD C[C@@H](OC(=O)c1ccc2nnnn2c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 786049417 CIZCICPAYFKEQH-GFCCVEGCSA-N 441.403 2.084 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1O 787303565 HURAOWITXYXDRX-OAHLLOKOSA-N 449.454 2.404 10 20 IECD O=C(NCCCc1nc2c(s1)CCCC2)C(=O)NCc1ccc(N2CCOCC2)cc1 788312243 FENYUIKHUVKFIJ-UHFFFAOYSA-N 442.585 2.224 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788912516 URWBIXBZZJZKBT-ICSRJNTNSA-N 428.577 2.446 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1 789798867 FCQBDXUWSZKACE-SFHVURJKSA-N 443.519 2.248 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Br)sc2C)ccc1O 790407599 OJUFEQYPLQWXHI-UHFFFAOYSA-N 441.350 2.234 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 790906269 WGVYMRYBPHPKAH-RDJZCZTQSA-N 447.532 2.466 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1cccc2c1OCO2 800925560 FOZNJGHJUWFZPC-UHFFFAOYSA-N 428.455 2.315 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCC[C@@H]3CCCCO3)cc2F)CC1 805007408 LCSPTQJWDAFMJA-IBGZPJMESA-N 434.556 2.049 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1 806885689 HGXNDGHYUCNTGA-GFCCVEGCSA-N 430.436 2.276 10 20 IECD O=C1/C(=C\c2ccc(N3CCOCC3)cc2)SC(=S)N1CCCN1CCOCC1 814285230 GAGOTRAMQMTHJM-KNTRCKAVSA-N 433.599 2.447 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCc3nncn3C2)NC(=O)OC(C)(C)C)cc1 815710895 YNHCPILQTGAOQI-FUHWJXTLSA-N 428.537 2.289 10 20 IECD O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)OCC(=O)c1ccc(O)c(O)c1 916611172 BYXLXMHXYGFMLV-UHFFFAOYSA-N 429.450 2.346 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 917708423 HHACFMQXSCXBCY-HNNXBMFYSA-N 425.460 2.272 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4ccccc4C3)cc2)C1 918005416 YRMZPIYCLYGGKT-QFIPXVFZSA-N 435.572 2.246 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 918372196 WGBFMFMDVMCHEC-HXUWFJFHSA-N 445.541 2.233 10 20 IECD Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 919766781 SLAPLJWXJPMVBP-UHFFFAOYSA-N 431.558 2.125 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 920188392 MPWQDNKCNCKYCE-UHFFFAOYSA-N 445.491 2.285 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC)c(OC)c3)CC2)cc1 920255464 XMRUFHBAZPGHMR-KHPPLWFESA-N 439.512 2.234 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)c(O)nc1C 1322460597 VMSDNKPLHJZQDG-ZDUSSCGKSA-N 439.262 2.174 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(Cl)c(-c4nn[nH]n4)c3)CC2)cc1 1325159338 GFMBKUJXNMXXGJ-UHFFFAOYSA-N 448.936 2.430 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@H]1F)C2)c1cc(O)c(O)c(Cl)c1 1781121894 DCVYUSVCOFNNGT-WMHAJJRKSA-N 426.872 2.237 10 20 IECD COc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424206 HJAFOXRSFOFCPP-UHFFFAOYSA-N 437.456 2.296 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CS(C)(=O)=O)cc1 1795791824 YSNCGIJPANLTOS-NUZGMZIFSA-N 443.569 2.391 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](CNC(=O)C(O)O)[C@H]2c2cccnc2)cc1 1802923182 OPKGCFWKSCPIBI-RBBKRZOGSA-N 448.523 2.119 10 20 IECD Cc1noc(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805530806 BELBYJUBTZZFND-QRWLVFNGSA-N 437.456 2.126 10 20 IECD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccccn1 1813504601 PNVZXNIDYTZGSX-YHEJKZAPSA-N 447.495 2.406 10 20 IECD CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814191238 JDJRTYSXCMWVOI-MGSHXDRLSA-N 446.598 2.160 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCCn2ccnc2)[nH]n1)c1cc(O)nc(O)c1 1817848406 HWDZUWIVDGMFSO-MRXNPFEDSA-N 439.476 2.199 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCCn2ccnc2)CC1 1832154262 OKQNESZUUNWBKY-LJQANCHMSA-N 441.532 2.403 10 20 IECD CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)NC(=O)OC(C)(C)C 1843250582 NPNYZNLYSLAKEU-HNNXBMFYSA-N 448.520 2.003 10 20 IECD CN(C)c1cccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1844909138 JRWXLUNPJDQNFZ-CSKARUKUSA-N 437.496 2.400 10 20 IECD Cc1cc(C)cc(CCC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1 1846500060 XJLMTWXLXRLKCG-UHFFFAOYSA-N 445.610 2.300 10 20 IECD Cc1c(CNC(=O)C(=O)NCC2(N3CCCCC3)CCN(C)CC2)n(C)c2ccccc12 574233035 SCFSRPXWADGVNX-UHFFFAOYSA-N 439.604 2.169 10 20 IECD CN1CCC2(CC1)NC(=O)N(CN(Cc1ccc(N(C)C)cc1)CC(F)(F)F)C2=O 728904918 YHGVEUSHHPNTGI-UHFFFAOYSA-N 427.471 2.091 10 20 IECD Cc1cc(C(=O)COC(=O)c2cn(C)c(=O)n(C)c2=O)c(C)n1-c1ccc(F)c(Cl)c1 735154574 WFXPKOCTBQVNKI-UHFFFAOYSA-N 447.850 2.324 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3OC)cs2)cn1 743046495 LOHXVRVQUCLYPY-UHFFFAOYSA-N 426.451 2.128 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1 754425602 XMOGBNAJKIGMTP-VBKZILBWSA-N 438.484 2.128 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(C)ccc3F)CC2)cc(OC)c1OC 759410084 OVMFDGVLKOFKMN-UHFFFAOYSA-N 431.464 2.447 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1 765977896 KJHDNZFGYYKNNX-GBXCKJPGSA-N 443.613 2.301 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC([C@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904956 ZPIBMWKIICINEU-FQEVSTJZSA-N 429.483 2.369 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)c2)CC1 769849674 YVABQTAORMASFL-UHFFFAOYSA-N 440.569 2.465 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccn1 774884914 JCCXZNITEMWJPS-AWEZNQCLSA-N 436.434 2.431 10 20 IECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 775259152 FPQYAQCUKWNNOS-HNNXBMFYSA-N 439.495 2.236 10 20 IECD COCCN1C(=O)c2ccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2S1(=O)=O 775402004 ANYJODOAVUKEJW-CQSZACIVSA-N 431.514 2.035 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1cnc2sccc2c1=O 777828614 MEQZHLFKBOUFJX-UHFFFAOYSA-N 435.889 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC(C)C)nc3)CC2)cc1 778235088 VCDSZHUDQBCOBT-LUAWRHEFSA-N 438.528 2.399 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779011148 DZUUMVQVNYKTMG-OLZOCXBDSA-N 427.523 2.139 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(CCO)Cc3ccc(C)cc3)CC2)cc1 783197825 LKRWTZXEQYLKCC-UHFFFAOYSA-N 426.561 2.330 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 783308891 KAOXTIWZEBKVEJ-UHFFFAOYSA-N 430.436 2.096 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)cc2)CC1 786657114 SJHXBNFOPRDYJF-UHFFFAOYSA-N 448.483 2.379 10 20 IECD COc1ccc(N2CCN(CCNc3ccc([N+](=O)[O-])cc3S(C)(=O)=O)CC2)cc1 786778315 MNBASESZZZILAW-UHFFFAOYSA-N 434.518 2.241 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3N(C)CCCC3(C)C)CC2)cc1 791146364 QEPILCHBTULBPO-RQWLHQTBSA-N 428.577 2.137 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc2[nH]1 792330057 JKYQGGZUHJLKGR-OAHLLOKOSA-N 449.511 2.180 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3CCC(NC(=O)C4CC4)CC3)cc2)C1 793133010 QRMVVXAGIFENOK-SKINQDTJSA-N 426.561 2.090 10 20 IECD CN(C)C[C@@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793728387 YHKATTCEUKDUOG-YADHBBJMSA-N 439.556 2.189 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794831729 PYRDFHCXBBMNAE-JLTOFOAXSA-N 429.521 2.050 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4ccccc4Cl)C3=O)ccc21 803686768 PITJIXLSSRSKHZ-SFHVURJKSA-N 440.931 2.260 10 20 IECD C[C@@H](OC(=O)c1ccoc1CC(N)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803938397 OYESOEAOHVRJJN-GFCCVEGCSA-N 446.415 2.267 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 806281985 DIHQLAMAGQELNK-AWEZNQCLSA-N 438.962 2.317 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccn1 806842641 RLRGADRPUGSAAZ-UHFFFAOYSA-N 438.406 2.201 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)CC2)cc1 808059172 NGNUGTIYJBQVRA-GOTSBHOMSA-N 436.556 2.296 10 20 IECD C[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)S1(=O)=O 813057893 DFGCXLCHSYLSIN-ZIAGYGMSSA-N 431.505 2.474 10 20 IECD CCCCCNC(=O)C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 917054168 WSFDJIKMASLWNB-UHFFFAOYSA-N 448.583 2.297 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cnn(CC(=O)NC4CC4)c3)cc2F)C[C@H](C)O1 918219660 MRNDBIGRMCPMJN-GJZGRUSLSA-N 444.511 2.236 10 20 IECD COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 919957830 WQZNBDJUSVACKL-UHFFFAOYSA-N 448.906 2.148 10 20 IECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1CNCc1ccc(N2CCOCC2)cc1 920180763 JMPACOZEBDVZFZ-SFHVURJKSA-N 438.981 2.331 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccn(C)n2)C3)cc1 1799620637 YITQOZPCMFGZFC-JHDGKUDLSA-N 447.539 2.345 10 20 IECD Cc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1807990664 KAKBPUWHFORTMN-KDOFPFPSSA-N 439.497 2.286 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3[nH]ncc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845350 KTTZATMFDWDZRM-OAHLLOKOSA-N 448.443 2.107 10 20 IECD CCN(CC)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847146 MFNOPHFRHQEHEV-YOEHRIQHSA-N 444.536 2.500 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCO2)[nH]n1 1823475658 FYXKTBTUZHEMTP-OJJSLQOQSA-N 442.472 2.411 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)C(F)F)CC2)CC1 1837677603 UHVCVHREZNCATH-UHFFFAOYSA-N 448.470 2.043 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3N2)C1 1845853911 CYAXZSNUBWNELI-FQEVSTJZSA-N 443.507 2.020 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(O)c1 1847038658 ZBDIQJFSYKXCIV-XBXARRHUSA-N 440.452 2.048 10 20 IECD Cc1ccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C 16135026 CTCSXIDIKLDMCB-UHFFFAOYSA-N 445.585 2.467 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCNC(=O)CC3CCCCC3)CC2)cc1 725865972 QVTIVLUKMXPHNR-UHFFFAOYSA-N 445.608 2.203 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4c(c3)C[C@@H](C)O4)CC2)cc1 732923057 KIAKSJKKAFOBLI-QGZVFWFLSA-N 431.558 2.119 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2 734687194 NGKOLTKULOHSCI-LJQANCHMSA-N 426.517 2.185 10 20 IECD NC(=O)CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1 744399924 ZEXSQRXPPOKANQ-UHFFFAOYSA-N 427.460 2.388 10 20 IECD C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(=O)N1c1cnn(C)c1 745919062 QJJOLPADKSTJCP-MNEFBYGVSA-N 427.505 2.010 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccnn1C1CCCC1 746787004 PUBLZCJVGBWIEA-UHFFFAOYSA-N 429.496 2.353 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)CC2)cc1 747038971 DWLBZFSLXKGUIL-FQEVSTJZSA-N 448.564 2.009 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1F 754040026 JHGDZRKMWKVSFO-UHFFFAOYSA-N 431.493 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4C)CC2)cc1F 754213526 SYWWBPQEZZOTFI-UHFFFAOYSA-N 440.475 2.031 10 20 IECD COC(=O)[C@@H](C)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 756896679 PTATXXLHTPUXRY-SBUREZEXSA-N 443.519 2.419 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3ccccc3CC(N)=O)cc2F)C[C@@H](C)O1 758426114 PPPLIVRAGZADSZ-HZPDHXFCSA-N 429.492 2.162 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F 763431353 BUQUKINDTSHTPW-UHFFFAOYSA-N 441.912 2.235 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H]4[C@@H](CCCN4C)C3)cc2F)C[C@@H](C)O1 766121012 FNIJAFBJBZOCEP-GXKRZCMTSA-N 432.584 2.472 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3c(O)cccc3Cl)CC2)c1 768211816 DPRDRZSNOBPXEJ-UHFFFAOYSA-N 430.935 2.400 10 20 IECD COc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc(F)cc3F)CC2)cc1OC 768440749 CVTFQXDFCTVCDY-UHFFFAOYSA-N 428.457 2.194 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 769636523 AOFAYUTYLOZDNS-UHFFFAOYSA-N 433.502 2.271 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3ccc(C)cc3)CC2)cc1 779220194 SBCNOWHPGZZMJX-QFIPXVFZSA-N 426.561 2.057 10 20 IECD Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)C2)c(O)c1O 780905542 RZYVUAFZVWXRTA-MRXNPFEDSA-N 447.532 2.338 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)[C@H]1CCCN(C(=O)C2CCCC2)C1 781524537 NEKGHYHMHOEAIG-QFIPXVFZSA-N 449.617 2.466 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(N(C)C)cc1 787736519 KPEHZZBMKCJOFP-WMZHIEFXSA-N 437.588 2.035 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Br)cc2F)ccc1O 790407422 LJUITEHWNIWZRN-UHFFFAOYSA-N 439.284 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@]4(CCCOC4)C3)cc2F)CC1 797451625 MDSDMAALNSUFAM-FDDCHVKYSA-N 434.556 2.447 10 20 IECD CCCCN(CC(=O)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801596726 LWYJENQHHUDEIO-WOJBJXKFSA-N 438.590 2.189 10 20 IECD CCn1c(-c2cnn(C)c2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802014807 UOOSIOJRSOHHBC-UHFFFAOYSA-N 427.509 2.051 10 20 IECD CO[C@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1(C)C 803448944 IUZPSGJUCDLEEP-SJORKVTESA-N 425.476 2.303 10 20 IECD COCC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 803450797 RFPCUQFOGXPOST-UHFFFAOYSA-N 425.476 2.306 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1 804898699 OKPHBFSSALAJTQ-UHFFFAOYSA-N 427.429 2.131 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCOc4cc(OC)ccc43)CC2)cc1 806791004 VPTXTCHCOLGJGQ-OAQYLSRUSA-N 439.512 2.383 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@@H](N2CCCC2)C1 807768604 MXFBJQWYYNWYNI-FUHWJXTLSA-N 436.503 2.070 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccn(C2CCCC2)n1 809078859 VZJHBCPRHRLLNY-UHFFFAOYSA-N 425.533 2.110 10 20 IECD COC[C@@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN(C(=O)OC(C)(C)C)C1 810192718 KMBAELFPJBTDBA-HSZRJFAPSA-N 433.549 2.413 10 20 IECD O=C(N[C@H]1COc2ccccc2[C@H]1O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 811573976 SDUZRPGJYWKZHP-HNAYVOBHSA-N 446.506 2.479 10 20 IECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C(F)(F)F)n1 815015860 RITGDSDVXABSJF-UHFFFAOYSA-N 436.431 2.018 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)c4ccc(F)cc4)CC3)nc12 917096965 NBXXHAYTFBMWCB-UHFFFAOYSA-N 441.463 2.099 10 20 IECD NC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 919761860 PZCFOXAHCVIHQW-UHFFFAOYSA-N 449.490 2.363 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(C(N)=O)nc2)c(C)n1-c1ccc2c(c1)OCCO2 1337934789 QYZVGYIWZJGOOX-UHFFFAOYSA-N 435.436 2.399 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=NN(c2cccc(C)c2)C(=O)CC1 1338287034 ITBFOHJXLLPWFJ-SFHVURJKSA-N 439.468 2.180 10 20 IECD Cc1cc(C)cc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)c1 1784223510 MSZVBIJXECVLOP-DEOSSOPVSA-N 439.512 2.186 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CNC(=O)C2)C3)cc1 1800515700 VWUZSUBFRBXBQH-MPJJRAAHSA-N 434.540 2.482 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1c(F)cncc1F 1804286406 TXXOMOYNJPMWQO-LJWNITHASA-N 445.422 2.442 10 20 IECD CCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1813784560 BJIACJHYCNSIJN-SNVBAGLBSA-N 425.894 2.470 10 20 IECD CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)no1 1816726292 SMAGLCUEJIMKGR-JTQLQIEISA-N 429.458 2.039 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1 1832316963 FNUZHDBJVZDYOI-IBGZPJMESA-N 440.500 2.069 10 20 IECD CCOc1ncccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440869 PKWGYCISSCKBML-UHFFFAOYSA-N 447.495 2.090 10 20 IECD O=C(c1c[nH]c2cnccc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441712 NCIXMEUKXBMNOX-UHFFFAOYSA-N 442.479 2.173 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(O)c1 1846790407 WTVUVXOEZKTJHZ-UHFFFAOYSA-N 432.480 2.311 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNC1=NS(=O)(=O)c2ccccc21 10961846 UXTOMLBYFAJKJY-UHFFFAOYSA-N 426.542 2.374 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc(Br)cs2)SC1=S 727177559 LXXWZPXBLSIEJV-UITAMQMPSA-N 427.392 2.261 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(OCCN3CCCC3)cc2)c1 732300304 JRYLVYPOVMHFHM-UHFFFAOYSA-N 433.530 2.168 10 20 IECD Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1S(N)(=O)=O 735751395 NZMNPGIXFGOALU-UHFFFAOYSA-N 436.509 2.064 10 20 IECD CC(C)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 745692325 UTJDBMQTJNFYPB-QGZVFWFLSA-N 447.580 2.491 10 20 IECD Cc1noc(C2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)n1 747301074 OYIOIAIUJJGVOG-SFHVURJKSA-N 426.521 2.169 10 20 IECD CC(C)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOCC1 748008943 NSLVWNHEBDNPCW-UHFFFAOYSA-N 439.559 2.095 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(C)c2F)cc1OC 749144703 ZTVUEQMUHYCXOJ-UHFFFAOYSA-N 446.478 2.403 10 20 IECD COc1ccc(N(C)CC(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c(OC)c1 752123528 DPBQQIXFJZVVCU-UHFFFAOYSA-N 444.507 2.062 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](N(C)Cc4ccccc4)C3)CC2)cc1 754050243 IYBNASFUZDYPNY-LOSJGSFVSA-N 438.616 2.384 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759101560 IVQZKCLIPRRIAW-UHFFFAOYSA-N 437.474 2.132 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N(C1CCCCC1)[C@@H]1CCS(=O)(=O)C1 759588101 IEMHHINJDKZWTC-NBEHIINDSA-N 437.514 2.003 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 761054314 WGYAYYPEBRKWRM-UHFFFAOYSA-N 436.512 2.001 10 20 IECD CCOC(=O)c1n[nH]c(C2CCN(c3ccc(/C=C\C(=O)OC)cc3[N+](=O)[O-])CC2)n1 767458976 MGZCDRUEMGCPQB-ALCCZGGFSA-N 429.433 2.460 10 20 IECD CC(C)N1CCN(c2cccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)c2)CC1 768369583 DTTYVWCNPGZCOP-UHFFFAOYSA-N 446.573 2.425 10 20 IECD CC(C)[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768520745 ADRSVYXSPNWPLO-HLFMIMNKSA-N 434.512 2.022 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3nc(-c4nccn4C)cs3)CC2)cc1 768717346 QBZHYVDMDPQDBN-UHFFFAOYSA-N 440.529 2.230 10 20 IECD O=C(CNc1ccccc1CN1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 772905613 YXOHSPZFAZERPY-UHFFFAOYSA-N 442.535 2.223 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C 773761538 SLEVUABCYGQIMZ-CABCVRRESA-N 435.546 2.218 10 20 IECD C[C@@H](NC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 773988439 KTQXKMHNEBDQGU-OAHLLOKOSA-N 435.521 2.404 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 774965450 QESIPHZTOQUGKA-QHCPKHFHSA-N 438.572 2.339 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCN1C(=O)COc2ccccc21 777828196 JJNYDOMUWOUINQ-UHFFFAOYSA-N 432.860 2.363 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(C(=O)OC)n(C)c1 785196641 TXDRIWZIAOWSQV-UHFFFAOYSA-N 438.278 2.267 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 786999871 NRJBKEHQOUKYFO-UHFFFAOYSA-N 446.483 2.438 10 20 IECD CCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 787282587 CQRHGYBHNKUOHQ-HZPDHXFCSA-N 444.507 2.166 10 20 IECD C[C@@H]1CCCN(CCCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 787914275 YNKNXWLVOUHJCE-WOJBJXKFSA-N 430.593 2.329 10 20 IECD CC(C)Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822396 WLJUNCRAUHXJTK-CALCHBBNSA-N 445.539 2.224 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3N(C)CCCC3(C)C)cc2F)C[C@@H](C)O1 789827120 RKASCJOYFLQRJH-LZJOCLMNSA-N 448.583 2.292 10 20 IECD Cc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 789841471 ZECYAQKWTSWBFU-OAHLLOKOSA-N 431.508 2.442 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCc2c1cnn2C 789844311 FNUXGQYJRPVNDJ-LJQANCHMSA-N 427.574 2.126 10 20 IECD Cc1cccc(C)c1CCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789846133 ZWGSOQQUPHTNLM-UHFFFAOYSA-N 427.520 2.379 10 20 IECD COc1ccc(CCS(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 790049933 QVRFSCBZPIOCMB-UHFFFAOYSA-N 431.558 2.026 10 20 IECD C[C@@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793730036 BMVNCOOHCCFGNF-RXFWQSSRSA-N 448.567 2.195 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(CS(C)(=O)=O)ccc3OC)CC2)cc1 795288710 AHXGOJLQNAHUCC-UHFFFAOYSA-N 447.557 2.009 10 20 IECD CC(=O)N1CCC[C@H](CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 797191768 XTONYKNFMVLBJC-CQSZACIVSA-N 435.436 2.359 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1C 799524210 XKZHJEWZBHMNBZ-UHFFFAOYSA-N 425.532 2.259 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(N2CCOCC2)cc1 803312059 UFDRKHNCWDNMIS-UGKGYDQZSA-N 428.577 2.177 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ncc(C)s3)cc2F)CC1 805006694 BNEQKDUOBAHJBF-OAHLLOKOSA-N 433.553 2.226 10 20 IECD O=C(NC[C@@H]1COC2(CCOCC2)O1)C(=O)N(Cc1ccccc1O)C1CCCCC1 806718614 WZEAAOFFHOEVOR-LJQANCHMSA-N 432.517 2.092 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 806901228 VOOCEASSQUZKHE-UHFFFAOYSA-N 427.480 2.375 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289146 KLXARIBPXZRCRR-FXAWDEMLSA-N 442.560 2.441 10 20 IECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)CCC3)c1C 915553931 AWFFZYOKKBTUTR-UHFFFAOYSA-N 433.526 2.370 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 917863698 VFAOFWXBTUQHCE-UHFFFAOYSA-N 431.558 2.023 10 20 IECD CC(=O)N[C@@H](C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 917954752 UGYXFUSOHHWKBG-RNODOKPDSA-N 436.464 2.493 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(CC(=O)O)ccc2OC)cc1 920482799 YXZDMSYSVVSKQE-UHFFFAOYSA-N 442.515 2.275 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N3Cc4ccccc4C[C@@H]3C(=O)OC)CC2)cc1 1320024680 WVHUNLKDNMHTFY-HSZRJFAPSA-N 437.540 2.334 10 20 IECD CC(=O)N(C)[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788654612 PDGCLAVPFIQZNT-CYBMUJFWSA-N 426.473 2.107 10 20 IECD Cc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1800435568 LDRROYUDEVNADD-BTTYYORXSA-N 435.546 2.246 10 20 IECD Cc1onc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1C 1803890102 VQERFWRWVZODFQ-FOIQADDNSA-N 437.456 2.126 10 20 IECD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccn1 1807999837 WNANBONJIHZWNC-YHEJKZAPSA-N 447.495 2.406 10 20 IECD Cc1n[nH]c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819663513 QKAHHRKQJKMJPQ-AWEZNQCLSA-N 425.449 2.176 10 20 IECD CO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822456944 ITTYDJVALVSWJX-VJFPMYOSSA-N 430.461 2.267 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1822667144 CTYCEUROQMCXED-KWCYVHTRSA-N 441.488 2.206 10 20 IECD Cn1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)n1 1825745278 QKQWQAVLXSPCAA-INIZCTEOSA-N 447.923 2.427 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3O2)C1 1843910495 GNKVZDIBJZUAHU-XSBJJCPUSA-N 436.464 2.024 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3CCNC(=O)C3)C2)cc1 1846424076 NXOYFJPBLJVEOF-HXUWFJFHSA-N 434.540 2.437 10 20 IECD COc1ccc(N2CCC(NC(=O)C3CCN(c4ccc5nncn5n4)CC3)CC2)cc1 110471517 FSRCTRWZOSXUHG-UHFFFAOYSA-N 435.532 2.135 10 20 IECD COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 726624991 BQRLMHASOYDXFR-CQSZACIVSA-N 439.921 2.434 10 20 IECD CC[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 729229822 ACHCLOCSBZQCCE-NRFANRHFSA-N 446.573 2.463 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C)c1ccc(N2CCOCC2)cc1 729788306 UEUCBYQUEDCWRF-INIZCTEOSA-N 436.512 2.248 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(Br)c3O)nc12 730366974 ZWNDCXDSYDNBOW-UHFFFAOYSA-N 436.218 2.437 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1F 731408809 WWYXEWWYSRLJMO-UHFFFAOYSA-N 435.521 2.471 10 20 IECD NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN(Cc1ccco1)Cc1ccccc1O 731844178 ANDRQCBPWCONGQ-UHFFFAOYSA-N 441.509 2.224 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2C)cc1 734557193 BQLQYKIRDKZCKT-UHFFFAOYSA-N 432.546 2.004 10 20 IECD C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C(=O)N1c1cnn(C)c1 745919061 QJJOLPADKSTJCP-LZQZEXGQSA-N 427.505 2.010 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 749107405 WTQGGDUMSKUZOO-UHFFFAOYSA-N 440.543 2.201 10 20 IECD CCOC(=O)N1CCC(NC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751935859 DFBZCBOJITZIKM-UHFFFAOYSA-N 446.529 2.210 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 752399893 IDERCUVRHUJMMZ-QGZVFWFLSA-N 426.492 2.345 10 20 IECD Cc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1C 753849583 MOIFZMGXBGAGQB-UHFFFAOYSA-N 429.498 2.428 10 20 IECD CCCCN(C(=O)CN(C)c1ccc(OC)c(F)c1)c1c(O)nc(=O)n(CCC)c1N 757851208 FCIYTASHRFNCNK-UHFFFAOYSA-N 435.500 2.358 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cc(C(=O)N(C)C)ccc3C)CC2)cc1 758223529 KZOKPQVTJVUIDK-NRFANRHFSA-N 427.545 2.267 10 20 IECD COCCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 758839527 JDFWWNBQCVNBTB-UHFFFAOYSA-N 429.542 2.482 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1 758986375 FXCDRVXEHLVUNQ-UHFFFAOYSA-N 448.545 2.235 10 20 IECD CS(=O)(=O)C1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 761654668 DAHYTXJFRIVWAD-UHFFFAOYSA-N 431.505 2.475 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 761983016 PSJRVTFBJOPQLV-AWEZNQCLSA-N 443.978 2.078 10 20 IECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 769320681 UHPBIEQLKJCMDR-TZIWHRDSSA-N 432.584 2.475 10 20 IECD Cc1ncn(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1C 771562032 OLMYZYBMAIUUTM-CAOOACKPSA-N 444.538 2.246 10 20 IECD C[C@H](NS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1ccc(N(C)C)cc1 773982949 VIEBDJVSYOCUEM-GOEBONIOSA-N 431.514 2.230 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1C 775273061 DKFJYNQYIUAUHF-UHFFFAOYSA-N 426.442 2.316 10 20 IECD CNS(=O)(=O)[C@@H]1CCN(Cc2cc(Br)cc(Br)c2O)C1 775738446 DXIJRRNLLSMBRN-SNVBAGLBSA-N 428.146 2.041 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)cc1 777609432 LHWMMFQRYAJOSD-UHFFFAOYSA-N 433.439 2.305 10 20 IECD COC(=O)[C@@H]1C[C@@H](OC)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778239580 TZINUTUSMYHCGD-YWZLYKJASA-N 436.464 2.053 10 20 IECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)C1=O 778262621 LSLYPVMOORTINY-OTWHNJEPSA-N 448.583 2.244 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1 779486240 SUHXSEHDDJCOMX-SFTDATJTSA-N 441.553 2.216 10 20 IECD CS(=O)(=O)c1ccc(Br)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 783479075 PBXBJEVYTJBUKC-UHFFFAOYSA-N 429.244 2.304 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1C(=O)N1CCOCC1 787513859 GJXQUYDQDFSKBD-UHFFFAOYSA-N 448.570 2.161 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCOC[C@H]1c1ccccc1 789837258 XRDNKIRVWBFWQM-QFIPXVFZSA-N 441.503 2.003 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(C)nn(C)c1C 789841401 WYXFIYKUOXVIHI-LJQANCHMSA-N 445.539 2.021 10 20 IECD C[C@@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789948442 AVCSLXYLUNFZHQ-AWEZNQCLSA-N 445.507 2.370 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(c4ncccn4)C3)cc2)CC1 790255024 PMGDMXDDFCMTCS-FQEVSTJZSA-N 436.560 2.114 10 20 IECD C[C@H]1CN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 797356784 FRYQSPWECJMYNC-NPMABZOXSA-N 436.420 2.390 10 20 IECD CO[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC[C@@H]1C 803448617 UUEQDOHJTNREIR-KSSFIOAISA-N 425.476 2.256 10 20 IECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687879 QHIJZOSUNOEEHT-IBGZPJMESA-N 436.556 2.337 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 803747392 QWCCAMKXKMXMOS-SLFFLAALSA-N 428.577 2.018 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@]4(CCO[C@H]4C)C3)cc2)CC1 805026020 ZCPHZHMKFNRFPU-AXHZCLLHSA-N 429.561 2.334 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(C2CCC2)C1 808021486 PEIIWTGORBZQOU-PZJWPPBQSA-N 442.604 2.251 10 20 IECD Cc1nn(C)cc1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 808069158 PNDDDACCVCZWPK-ZDUSSCGKSA-N 438.575 2.378 10 20 IECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)C1 917126487 GBWKDMHVIZVHAL-CYBMUJFWSA-N 431.543 2.103 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1ccncc1 917176764 XGEHSARXXLIALK-UHFFFAOYSA-N 442.520 2.261 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917383679 HSLJGVOKCIETCB-UHFFFAOYSA-N 447.582 2.037 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832366 VHEKDIFKIJUTIX-HKUYNNGSSA-N 430.549 2.404 10 20 IECD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1)c1ccccc1 1777851163 CSBGKWFXBBAJRR-LSRZYVKLSA-N 439.512 2.424 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccs1)C2)c1cc(O)c(O)c(Cl)c1 1799770960 XMHKSPDRWUNBBA-IVWMJMPLSA-N 436.917 2.259 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)CN3CCCC3)C2)CC1 1804927675 ROICLEWQYCKQJM-FNORWQNLSA-N 443.544 2.144 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@H]1C[C@H]1F 1807821255 WDRMEAPCMZKYDH-FAGZOMQFSA-N 449.486 2.238 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1CCCS1 1813614613 UMERJCBQRMUJQV-ZSZQSSIHSA-N 428.514 2.103 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)C1 1841396937 GHRCNEHDWMZCFB-CABCVRRESA-N 429.423 2.392 10 20 IECD CC[C@@H](NC(N)=O)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1843338285 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433.509 2.443 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1ccc(OC)cc1 746109287 OEEJVVYRISADOH-UHFFFAOYSA-N 431.558 2.196 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 749730943 HEJUIHPJTOOLJW-UHFFFAOYSA-N 429.527 2.036 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751042942 IKHRUUUBBKBXLO-CYBMUJFWSA-N 439.921 2.398 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)C1 751936084 HBQQRZXIKMGJRE-OAHLLOKOSA-N 431.514 2.275 10 20 IECD CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751937567 QSRKVROEDREDLC-KRWDZBQOSA-N 431.514 2.417 10 20 IECD C[C@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCS1(=O)=O 758625807 WMFMOVGRJSSPNE-AWEZNQCLSA-N 431.505 2.475 10 20 IECD CN(C)CCOc1cc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccn1 762681069 COWOSKUUTLGLLO-UHFFFAOYSA-N 427.549 2.200 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCC[C@@H]1N1CCOCC1 763658693 KNLWKDRVMUONJX-GOTSBHOMSA-N 430.593 2.338 10 20 IECD CCOc1ccc(CN2CCN(S(=O)(=O)c3cc(OC)ccc3OC)CC2)c(O)c1 768202505 ZZBJJJGVTMZSLC-UHFFFAOYSA-N 436.530 2.315 10 20 IECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc([N+](=O)[O-])c1F 768272785 UTHWVQZSZSALST-UHFFFAOYSA-N 443.478 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCc4cc(O)ccc4C3)CC2)cc1 768837826 VLJNFDRZURCGFK-PISNEZEASA-N 435.524 2.279 10 20 IECD CN1CCN(c2ccc([C@@H]3NC(=N)Nc4nc5cc6c(cc5n43)OCCCO6)cc2)CC1 771520303 IUUCCBQKKHPGFQ-OAQYLSRUSA-N 433.516 2.446 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)C(F)F)cc1 772773366 CEFSOXKXDLGIKB-KRXBUXKQSA-N 427.381 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(N(C)C)CCCCC3)CC2)cc1 778224974 JKNKHGWPMRGFIF-QXMHVHEDSA-N 428.577 2.281 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 785214670 PBQFUJAOBRYJTE-UHFFFAOYSA-N 437.949 2.496 10 20 IECD CC(C)CN1C[C@@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CCN2C1=O 786999968 PDFODQDWNFYUNM-SFHVURJKSA-N 447.555 2.074 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 787196942 ILNSWOMNMLNRFM-HDICACEKSA-N 439.560 2.036 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2ccccc2C1 787633982 XSQLEPOBWVKMLW-FQEVSTJZSA-N 426.536 2.461 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1 788585468 VNYHJDPBVJMISO-AEFFLSMTSA-N 436.503 2.116 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)OC(C)(C)C3)cc2F)C[C@@H](C)O1 789823353 DFZJLWWZHBHWFA-HZPDHXFCSA-N 435.540 2.472 10 20 IECD COC(=O)[C@H](C)N(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CCC1 792348613 RLNZDYNJVJNNBO-INIZCTEOSA-N 447.557 2.340 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)CC2)cc1 797529933 KLAHCUBZCDAFQD-HXUWFJFHSA-N 436.556 2.329 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2cccs2)C1)c1ccc(N2CCOCC2)cc1 803305114 JVESULYCIOXYSE-LPHOPBHVSA-N 429.542 2.362 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(N2CCOCC2)cc1 803311168 MMFRDISNOJKXMV-SFHVURJKSA-N 436.556 2.399 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1)c1ccc(N(C)C)cc1 803399513 BXQFYHRYBZBNAC-HTAPYJJXSA-N 442.535 2.259 10 20 IECD CCN1C[C@@H](C)N(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H]1C 803449067 NBMUWZUBVBQDDL-HZPDHXFCSA-N 438.519 2.314 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)C3CCC(C)(C)CC3)CC2)cc1 803746855 IPILRXGVADULIK-UHFFFAOYSA-N 430.593 2.361 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCNC(=O)C(C)(C)C)cc1 804097413 UGIYUUQSUDSBKY-UHFFFAOYSA-N 428.533 2.153 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C 807097494 OYVINCFHYRSXNB-APWZRJJASA-N 432.565 2.439 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)c1 807292421 QGORVSPHEJVAGM-UHFFFAOYSA-N 446.551 2.362 10 20 IECD O=C1CCc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)c(F)cc2N1 807385071 BCCKXNPHTPYQOE-UHFFFAOYSA-N 436.237 2.433 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cnn(CCF)c3)cc2F)C[C@@H](C)O1 808570142 OJFYVYGSMSAQTH-GASCZTMLSA-N 436.459 2.079 10 20 IECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1ccc(N2CCN(C)CC2)cc1 809719772 OJNLIIQFDFAUCR-NRFANRHFSA-N 446.592 2.423 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Cn3nc(C(F)(F)F)cc3C)CC2)cc1 810395749 UJUFDTNQFFPWIU-UHFFFAOYSA-N 425.455 2.157 10 20 IECD O=S1(=O)CC[C@@H](NS(=O)(=O)c2ccc(NCc3c(O)ccc(Cl)c3F)cc2)C1 863994119 YDGMRIMMMLMGLZ-GFCCVEGCSA-N 448.925 2.262 10 20 IECD COc1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1OCCO 918220663 IOFOHEZWOYZCDP-UHFFFAOYSA-N 447.507 2.166 10 20 IECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969736 FCNQBAHYPJIWPK-OAQYLSRUSA-N 437.606 2.106 10 20 IECD Cc1n[nH]cc1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314926 JQOOKZHKHOKQQR-UHFFFAOYSA-N 443.554 2.326 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1cc(O)nc(O)c1 1793938919 KSNUFTUJUSAYKN-BJWYYQGGSA-N 440.456 2.286 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1C 1797116583 NXMLUFCYIOKHCI-DTUWPTEXSA-N 425.485 2.416 10 20 IECD Cc1onc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1C 1804282977 JLWRLTDRZFQSIZ-SEDYWJOHSA-N 427.457 2.373 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cnoc1C1CC1 1806136936 QJOXTVRNDLTHDY-YWZLYKJASA-N 449.467 2.387 10 20 IECD Cn1ncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1Cl 1810546408 DWTRVDWWFFJQTD-UHFFFAOYSA-N 433.896 2.038 10 20 IECD O=C([C@@H]1CCc2ccoc2C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441108 MXLLNECGBYKBGV-GOSISDBHSA-N 446.507 2.381 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 9932345 DFBCTMZQMOUHOF-UHFFFAOYSA-N 446.573 2.428 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)nc12 726187540 ZWEQELOQGNVENO-HNNXBMFYSA-N 442.451 2.147 10 20 IECD CCN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 726722109 MPODWGXIBOEHGQ-MRXNPFEDSA-N 431.505 2.475 10 20 IECD COC(=O)Nc1ccccc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 729750211 RKFXGCJRGJMLFT-UHFFFAOYSA-N 427.457 2.379 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2O1 732477885 HIHDKLDZWGJHNP-HNNXBMFYSA-N 427.476 2.217 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1C 737135791 CWVUKMUVSBFSDV-UHFFFAOYSA-N 444.557 2.147 10 20 IECD O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804826 BQHPJYSPTDLXGT-XJKSGUPXSA-N 434.530 2.293 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCC[C@H](O)C1 745738087 SQLZZLWPTRTHJD-MJGOQNOKSA-N 442.539 2.293 10 20 IECD COc1cc(C[C@@H](CO)CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc(OC)c1 747582579 WZOWTLAIOLPJLW-HXUWFJFHSA-N 443.544 2.191 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 749643950 MNIFQESULOSZFH-ZDUSSCGKSA-N 435.502 2.368 10 20 IECD COc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1C(=O)N(C)C 751136876 MYPTXXVGVVYRFZ-QGZVFWFLSA-N 448.541 2.473 10 20 IECD O=C(NCCCNC(=O)C1CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 752819798 DOWCQCLUGKVTJJ-UHFFFAOYSA-N 437.543 2.291 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(Br)cn(C)c2=O)cc1 754929683 QZASRAPLIXDFKL-UHFFFAOYSA-N 435.322 2.249 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3c(C)nc4cc5c(cc43)OCCO5)CC2)cc1 758198546 TWCASYXVVRLCSD-IBGZPJMESA-N 438.528 2.308 10 20 IECD COCCc1noc(CN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 758802554 LYYVZZQWCABDMX-UHFFFAOYSA-N 434.452 2.104 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](CO)Oc4ccccc43)cc2F)C[C@@H](C)O1 759746044 AVDKFHXPEXCZNE-ZIFCJYIRSA-N 443.519 2.315 10 20 IECD COC(=O)c1sccc1NC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759886297 MIRWAHODMRNYQP-UHFFFAOYSA-N 449.529 2.321 10 20 IECD COc1ccc(C(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 760849661 NTDNZAOJPMAMHJ-UHFFFAOYSA-N 436.917 2.083 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 761729189 YQVRFRFPFSMHLT-UHFFFAOYSA-N 437.544 2.267 10 20 IECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 762000891 QNZVSWTUKKBBMW-CYBMUJFWSA-N 434.470 2.418 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccn(Cc2ccccn2)n1 765926334 LWTVAMJSBBRQBQ-UHFFFAOYSA-N 430.262 2.049 10 20 IECD CCC[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768521914 LQTCLNUWZULCMJ-ZCCHDVMBSA-N 434.512 2.166 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc4c3OCCCO4)CC2)cc1 769997289 KAQZGBWWRZQXPL-UHFFFAOYSA-N 440.544 2.478 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccs1)N1CCOCC1)c1ccc(N(C)C)cc1 774809244 OHZVPQVBGHMSDA-VQIMIIECSA-N 430.574 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3c3noc(C)n3)CC2)cc1 778287326 MSJFDQNRZGWISO-JPMGXVIASA-N 439.516 2.345 10 20 IECD CCc1ccc(CNC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 785529783 YCKGLJALZXXIJF-UHFFFAOYSA-N 444.601 2.264 10 20 IECD CC(C)OCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 787989567 FNMHYZSGKJISRF-UHFFFAOYSA-N 425.529 2.381 10 20 IECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(CC)CC)cc3)C2)ncn1 788977913 SQOKORSFIJMBHK-HXUWFJFHSA-N 438.576 2.287 10 20 IECD CC[C@@H](CO)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814151 ZHLBRHVZCAPPOG-FQEVSTJZSA-N 443.519 2.078 10 20 IECD C[C@@H]1C[C@]2(CCO1)CN(C(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)C[C@@H](C)O2 789862546 VSBQUXDNAVVHSM-PMAPCBKXSA-N 447.601 2.041 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(OC)c1 793865400 SDXCFEPVTBOQNC-FQEVSTJZSA-N 442.512 2.276 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1C 795085854 SILQWGXZHXCQNN-UHFFFAOYSA-N 437.587 2.372 10 20 IECD COC(=O)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 797298141 GBASCBRNURJLNI-GFCCVEGCSA-N 443.319 2.478 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cc1F 803664073 GIBBEQFQPIWLAU-UHFFFAOYSA-N 432.540 2.149 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3nn(C)c4ccccc34)CC2)cc1 804317360 APGLTZVGNYWXLO-UHFFFAOYSA-N 435.528 2.026 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 807095909 BSGJRCFURJAYCJ-UHFFFAOYSA-N 442.947 2.315 10 20 IECD COc1ccc(F)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807101757 VQCPBLIPAILTSI-UHFFFAOYSA-N 442.535 2.169 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 807450456 JODZACRZALQBAM-UXHICEINSA-N 437.588 2.257 10 20 IECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807513484 OWPKALZAZMXLDA-UHFFFAOYSA-N 439.299 2.494 10 20 IECD CN(C)C(=O)c1cccc(CCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 807593975 YIGJTQWCCXZKAJ-UHFFFAOYSA-N 436.556 2.304 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NCc1cc(Cl)cc(Cl)c1O 807841319 XVYRKJYSCKHEJG-SECBINFHSA-N 435.333 2.033 10 20 IECD COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 808034081 HXBXCXNYFJFCAE-SJORKVTESA-N 443.500 2.497 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C[C@@H](C)O)c3ccccc3)CC2)cc1 809460194 STUJBIJBHGTYOE-CTNGQTDRSA-N 439.556 2.405 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 914725363 LIOVKKFPRHTSND-UHFFFAOYSA-N 435.546 2.417 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916383661 MBKKEGLMCDZSAZ-UHFFFAOYSA-N 440.635 2.243 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ccccc1Cn1cncn1 918204942 VQRHFPNYNNPVJY-UHFFFAOYSA-N 438.507 2.426 10 20 IECD COC[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781119746 YJDIRORCBYNMOB-QKAVXHIFSA-N 440.924 2.161 10 20 IECD CC[C@@H](C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786405754 CXDLSTWFWHGWAC-ACJLOTCBSA-N 449.598 2.388 10 20 IECD CC1=CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1797133870 ZXJDGOFQTAEQDP-BCHOSZBJSA-N 442.512 2.153 10 20 IECD O=C(CCc1ccc(F)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336395 UKBSBTHSQGZYCG-BJWYYQGGSA-N 449.573 2.257 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995693 TUPZDXNLCYNBOE-IIBYNOLFSA-N 435.484 2.168 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnco1 1815433245 HTOUIESQMUPDSJ-QGZVFWFLSA-N 447.455 2.497 10 20 IECD CCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1816555666 YONKCCTZWJPKBW-HNNXBMFYSA-N 425.449 2.052 10 20 IECD CC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708306 QYEGUCYDWXBHMA-SKDRFNHKSA-N 425.894 2.204 10 20 IECD Cc1nscc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837345720 LQGONLMJFKIXND-UHFFFAOYSA-N 446.529 2.184 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccoc3C2)C1 1841453186 WPTFZJFTNIQXRH-QQOXCAACSA-N 438.480 2.418 10 20 IECD O=C([C@H](O)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502250 FEOVNFVJEPIFKQ-GOSISDBHSA-N 430.888 2.172 10 20 IECD COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)C1 1847561740 JMLZXICJTWYPHY-KNPMLCFXSA-N 436.892 2.156 10 20 IECD O=C(CS[C@@H]1CCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565112 AWQIOWOLNLEVAR-MRXNPFEDSA-N 434.530 2.293 10 20 IECD CN1CCN(C)[C@@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 732149398 INMKFABIQGICEY-LUYJPIOASA-N 438.644 2.092 10 20 IECD COc1ccc(OC)c(CN(CCO)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 732449750 NGJVPPUDCJITIG-UHFFFAOYSA-N 447.507 2.384 10 20 IECD COC(=O)[C@@H]1CC12CCN(CC(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CC2 733795630 FAYCZVGXCDNIHE-LNLFQRSKSA-N 447.551 2.331 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 746175749 WLTBMIZKSDVVCD-UHFFFAOYSA-N 432.565 2.190 10 20 IECD O=C(CCN1CCN(c2ccccn2)CC1)NCc1ccc(N2CCC(CO)CC2)cc1 746280234 NIGNBSBKQHDSAI-UHFFFAOYSA-N 437.588 2.119 10 20 IECD C[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 749125496 HJAKAJSLERBTAZ-YLJYHZDGSA-N 444.601 2.489 10 20 IECD COCCNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CC1 749340783 PXSMHLRDYGROPN-UHFFFAOYSA-N 426.561 2.231 10 20 IECD COc1ccc(N2CCCN(C(=O)CNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1 749848065 PPJIHHOOVUPSLA-UHFFFAOYSA-N 443.978 2.427 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2cc(OC)ccc2O)ccc1Br 751414992 HKEKYGHWBCEECP-UHFFFAOYSA-N 430.276 2.428 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CC(=O)N(Cc4ccco4)C3)CC2)cc(OC)c1OC 759223945 XBJLMZPKYQIZSY-MRXNPFEDSA-N 443.500 2.003 10 20 IECD Cc1cc(C(=O)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 763823836 OFLCXOAEYFJEDM-UHFFFAOYSA-N 430.480 2.438 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cnn(Cc2ccncc2)c1 765903350 JURFLVBADYVLOC-UHFFFAOYSA-N 430.262 2.049 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@]3(CO)CCc4ccccc43)cc2F)C[C@@H](C)O1 766249181 HOOMNSSATNQHRQ-QJMRKGMQSA-N 441.547 2.479 10 20 IECD CCN1C[C@@H](C)N(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@@H]1C 766254798 RXGNXYPWLYNNGS-DLBZAZTESA-N 432.590 2.339 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1nnnn1CC1CC1 770080292 KMDIIJGOYJDBDQ-ZROIWOOFSA-N 448.599 2.442 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 772456024 PZYCIVHPPNZMEB-IBGZPJMESA-N 446.592 2.438 10 20 IECD Cc1ccn(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(=O)c1 773712646 STULCVXSDCPHLC-UHFFFAOYSA-N 430.416 2.114 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(C(C)=O)c(C)n3)CC2)cc1 778405437 NGOYMEDANHVNHB-KHPPLWFESA-N 436.512 2.122 10 20 IECD CCN(CC)C(=O)C1(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 779222044 GKJFQPWPBDRRES-JOCHJYFZSA-N 446.636 2.339 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(CC(C)C)C(=O)[C@H]3C)CC2)cc1 779518363 AZOMSESNXYLFIJ-HXUWFJFHSA-N 445.608 2.106 10 20 IECD COc1cc2c(cc1OC)CN(C(=O)CCC(=O)OCC(=O)c1ccc(O)c(O)c1)CC2 784194420 ACTVBAJKUJPYHS-UHFFFAOYSA-N 443.452 2.206 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 784356268 YKSHKBLGKVOBMW-SFTDATJTSA-N 429.586 2.297 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H](C)C[C@H]3C)CC2)cc1 785527017 IMQIKNVXBJSVTE-WOIUINJBSA-N 430.593 2.264 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)[C@H]4CCCC[C@H]43)CC2)cc1 785530042 ZMTGSZQFSSKYLX-WWPVKYPJSA-N 442.604 2.361 10 20 IECD CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 787475253 WCIIQTPZNYBOIZ-UHFFFAOYSA-N 439.516 2.228 10 20 IECD Cc1cc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CCO2)ccc1F 788324622 WNZVBPCNWRWLEF-QFIPXVFZSA-N 441.503 2.187 10 20 IECD Cc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789837237 XGGOOJWUESNYIP-KRWDZBQOSA-N 443.519 2.295 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCCc2n[nH]cc21 790067599 FEHXEFDKEWJIDL-UHFFFAOYSA-N 443.441 2.417 10 20 IECD COC(=O)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 797290156 GCFZISGXUDEAEW-GFCCVEGCSA-N 443.319 2.478 10 20 IECD Cc1cc(C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1ccccc1Br 800551694 QIRKCPHQZGASAG-UHFFFAOYSA-N 442.335 2.052 10 20 IECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803309527 ZFWOORXHUDLVLS-PMACEKPBSA-N 430.593 2.185 10 20 IECD CCCN(CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 803687792 GZGGKXGJSZWBJB-UHFFFAOYSA-N 432.565 2.449 10 20 IECD Cc1cccn2cc(CCNC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)nc12 806537335 VGMXABHAMLVHEJ-GOSISDBHSA-N 435.528 2.015 10 20 IECD COCC1(O)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 807954512 UPFYWOJVDVNEOC-INIZCTEOSA-N 437.968 2.192 10 20 IECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 808956131 RNEFRNITXXDSDO-GOSISDBHSA-N 440.544 2.123 10 20 IECD O=C(CNC(=O)c1ccccc1OC(F)F)NCc1ccc(N2CCOCC2)c(F)c1 918141190 PDMCYWSFNYIXHG-UHFFFAOYSA-N 437.418 2.310 10 20 IECD C[C@H](OC(=O)c1ccc(=O)n(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919199059 GPILHELRXZDKQE-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 919767571 SUUHJNJQPMFLIM-UHFFFAOYSA-N 429.542 2.202 10 20 IECD CCOc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1 1319871496 UKSMJTISSHDUBZ-UHFFFAOYSA-N 443.978 2.427 10 20 IECD O=C(Nc1cccnc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798567359 NNNRRLODYOZNOU-QDMKHBRRSA-N 444.875 2.037 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc(Cl)ncn3)CC2)C1 1810546891 LMALWPMDCNNWGC-UHFFFAOYSA-N 431.880 2.095 10 20 IECD CC(C)n1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427125 GTEQTZKVKVPORT-KRWDZBQOSA-N 442.520 2.212 10 20 IECD CC[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714960 KIAQUQVFMLABGH-NHCUHLMSSA-N 440.544 2.170 10 20 IECD CCCN(Cc1ccccc1O)C(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O 116534104 BASFDPLRWPLXHD-UHFFFAOYSA-N 435.546 2.023 10 20 IECD CN1CCN(C(=O)Cc2occc2C(=O)N2CCN(C)c3ncccc32)c2cccnc21 498664127 XXCXEFPPXXHYJS-UHFFFAOYSA-N 432.484 2.192 10 20 IECD CN1CCN(Cc2ccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc2)CC1 740129068 ZOVGPUAFJDNNBJ-UHFFFAOYSA-N 435.572 2.388 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1F 742253572 RGCQGSUODUKKSQ-IBGZPJMESA-N 429.496 2.479 10 20 IECD CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 746037042 BOILSTCFNALUEC-UHFFFAOYSA-N 442.491 2.024 10 20 IECD CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 748185791 LIYYQJHFAKPGHA-QUCCMNQESA-N 428.577 2.432 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(C3CCOCC3)c2)cc1C 749756536 WDFMPZVCFOKZKW-UHFFFAOYSA-N 428.536 2.105 10 20 IECD COC(=O)c1cc(Br)cc(S(=O)(=O)NCc2cc(OC)ccc2O)c1 751414760 DUOSTWPZYKADDE-UHFFFAOYSA-N 430.276 2.428 10 20 IECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)ccc2O1 751589312 PBOLCTPBFVMFOM-INIZCTEOSA-N 434.499 2.211 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(N)cc(Br)c3)nc12 753393546 HBXQIIRPOPIRLN-UHFFFAOYSA-N 435.234 2.313 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccco3)C[C@H]3CCCO3)CC2)cc1 754019765 WOJAKEOFLHMHNB-XUZZJYLKSA-N 429.561 2.452 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1F 754039618 ALLFXPPSKZVQOO-UHFFFAOYSA-N 426.441 2.271 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754211196 FIWVCJAPXZXWHH-UHFFFAOYSA-N 430.436 2.300 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4cc(Cl)ccc4c3=O)CC2)cc1 758195193 SRJQYHYITUJUJX-SFHVURJKSA-N 428.920 2.242 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCN2C(=O)OC[C@H]2C1 764137605 XMSVNXMSXMZTPP-OJLMPMFISA-N 437.568 2.393 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3c(O)cccc3OC)CC2)cc1 768159146 BDPOFLGDPGOCFV-UHFFFAOYSA-N 434.514 2.084 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(C4CCCC4)nc3N)CC2)cc1 772673963 IZQNFWWXTRTSIP-UHFFFAOYSA-N 439.516 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-c4nnc(C)o4)cc3)CC2)cc1F 774309130 AJLRZMYOACCLGI-UHFFFAOYSA-N 439.447 2.480 10 20 IECD C[C@H](NCC(=O)NCC(=O)N[C@@H](C)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 775258168 RYZIARUHDLNQGS-ROUUACIJSA-N 442.535 2.307 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 777669053 DRNQZEWGBNOUCB-UHFFFAOYSA-N 432.502 2.367 10 20 IECD O=C(NCCCCOc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 785597787 HERPNAYGGVFMMW-UHFFFAOYSA-N 429.492 2.254 10 20 IECD CN(C)CCc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 786223143 AZYMQMUJMKFXPL-JOCHJYFZSA-N 437.588 2.492 10 20 IECD C[C@@H](Cc1ccccc1F)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787974138 LFQDYIGYXRYIOK-HNNXBMFYSA-N 431.483 2.290 10 20 IECD CN(CCCOCc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788314120 YPUINDIMLWASKB-UHFFFAOYSA-N 425.529 2.205 10 20 IECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H]1n1ccnc1 789855919 LMVSBCJAAIWBDZ-PXNSSMCTSA-N 427.574 2.162 10 20 IECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789879267 TWCNVGGYTQFBDA-INIZCTEOSA-N 449.502 2.082 10 20 IECD O=C(Nc1ccc(-n2cncn2)cn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 791292429 UXTXCBWSZGKURM-UHFFFAOYSA-N 442.482 2.483 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803305187 KZKPQARSKMPOLT-SFHVURJKSA-N 429.517 2.277 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(Cc3cccs3)C3CC3)CC2)cc1 803751750 WKCSRRUXWSEYMD-UHFFFAOYSA-N 442.585 2.186 10 20 IECD CCOC(=O)c1sc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nc1C 807289608 BDWVQTNCDLAGBO-OAHLLOKOSA-N 442.541 2.498 10 20 IECD CCN1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1=O 807955381 VNWDMZJCOKYGTI-INIZCTEOSA-N 434.968 2.273 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cn3cc(Cl)cn3)cc2F)C[C@@H](C)O1 808551618 DNKACVSBXMCSOB-OKILXGFUSA-N 438.887 2.149 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(C4CC4)n3)CC2)cc(OC)c1OC 815561669 MJUMYCYMXBZHJO-UHFFFAOYSA-N 440.500 2.272 10 20 IECD O=C1CC[C@@](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(c2ccccc2)CN1 816891137 JOKZFXKVJCIERE-DEOSSOPVSA-N 425.504 2.251 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1C 917364851 PJTCVSZZHMAHPK-IBGZPJMESA-N 432.542 2.495 10 20 IECD COc1cc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1 920088930 CCAMEUDMFMUUPY-UHFFFAOYSA-N 431.508 2.428 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3ccncc3)cc2)C1 1116025959 WQSQJUVGWNHELW-FYYLOGMGSA-N 435.572 2.454 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2ccccc2F)cc1O 1338289461 YFFJDPIXUQDXKC-AWEZNQCLSA-N 429.404 2.032 10 20 IECD Cc1cccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003907 OOHLJRYQQGVCDC-OAQYLSRUSA-N 431.876 2.212 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2cc[nH]n2)cc1)c1cc(O)nc(O)c1 1800612119 CELZUDZDUSIKEO-BCDXTJNWSA-N 433.468 2.449 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccnc1S 1804282915 HDIZQVAGSYBDAG-RRJKNOHSSA-N 441.509 2.452 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1 1809511437 NXTOBCJNPTZZFS-ZLHSVIROSA-N 445.903 2.237 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)c1nc[nH]n1 1817761688 YBFJNMAQSOLMHB-LBPRGKRZSA-N 431.840 2.212 10 20 IECD CC(C)[C@@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708418 YPQPSGHELYEGEI-ZUZCIYMTSA-N 439.921 2.450 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824690378 RCRMINKBUKBFKK-GOSISDBHSA-N 441.532 2.390 10 20 IECD CN(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826713253 KBVZKBQHFQJVIV-XSBJJCPUSA-N 445.560 2.388 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829829983 ASAKGZDKUCVDJG-INIZCTEOSA-N 443.460 2.276 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(Cl)s2)C1 1842409803 DQYYETKRRDTYCK-UHFFFAOYSA-N 429.976 2.079 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnn(C)c1I 379120879 OCDPFIAETPAIOH-UHFFFAOYSA-N 440.285 2.134 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C(=O)c2ccc(F)cc2F)CC1 727032569 JZGKLMMSWDLVTM-UHFFFAOYSA-N 444.482 2.469 10 20 IECD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NCCCSc1nccs1 733975158 XQDKPEBQUFJTHO-UHFFFAOYSA-N 430.533 2.018 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](CS(N)(=O)=O)C3)c2C)cc1 733997730 UZCCZDRJGRZGSQ-QGZVFWFLSA-N 447.557 2.064 10 20 IECD C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 739078503 CQJWPFHDRLOYEB-GOSISDBHSA-N 438.528 2.003 10 20 IECD Cn1c(S)nc2cc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc2c1=O 739768188 NDOINESLDKNHTL-UHFFFAOYSA-N 437.525 2.176 10 20 IECD CCOc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 739926433 GVEZUAOWLUCIMH-UHFFFAOYSA-N 433.530 2.181 10 20 IECD COc1cc(N(C)CC(=O)NCC2(N3CCOCC3)CCCCC2)cc(OC)c1OC 741796046 ZXXAQFIFLDAGJN-UHFFFAOYSA-N 435.565 2.300 10 20 IECD CCN(C)C[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 744423304 CRCCTSLJSCAIJL-GOSISDBHSA-N 432.590 2.198 10 20 IECD O=C1CCc2cc(OC[C@@H](O)CNC(=O)NCCCSc3nccs3)ccc2N1 759589705 FWJCKPNZWSIJMW-AWEZNQCLSA-N 436.559 2.249 10 20 IECD C[C@@H](CN1CCN(c2ccccn2)CC1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761315576 RTNQRLNXLYZJDR-INIZCTEOSA-N 443.935 2.416 10 20 IECD CCn1c(=O)n(CN2CCCc3cc(OC)ccc32)c2cc(S(=O)(=O)N(C)C)ccc21 766341831 RVMKLULDBBSNHH-UHFFFAOYSA-N 444.557 2.492 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1 766342592 IWXHZNGVQOMNIK-UHFFFAOYSA-N 437.500 2.328 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)CCC(=O)OCc3ccccc3)CC2)cc1F 767293406 XWDQAAXVKSJXQS-UHFFFAOYSA-N 436.505 2.420 10 20 IECD CCCC[C@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768523134 XUCREGHDABGUHV-RVKKMQEKSA-N 434.512 2.166 10 20 IECD COC(=O)Cc1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778223608 LZAIDLCKHZLZRT-VAWYXSNFSA-N 437.496 2.254 10 20 IECD NS(=O)(=O)c1cc(Br)cnc1NCc1ccc(N2CCOCC2)c(F)c1 779892117 CYIMINNEZBEKEO-UHFFFAOYSA-N 445.314 2.079 10 20 IECD CC(=O)NC1CCC(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 784541562 LHSRVXDRGALHRM-AGXSTUJCSA-N 448.583 2.435 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccsc3C(=O)OC)cc2F)CC1 784704030 ZOKHMNPSLJLWKA-UHFFFAOYSA-N 448.520 2.071 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@@H](C)CC(C)(C)C3)CC2)cc1 785526540 FJWJZMXDZKSQJG-IBGZPJMESA-N 430.593 2.218 10 20 IECD CCN(CC)Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 785559580 CZGYFCXZRYOABN-UHFFFAOYSA-N 438.572 2.298 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 785839383 JONXTLFNIIMHDW-HNNXBMFYSA-N 434.443 2.093 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 785868528 FJFUNKCONCHGOS-OALUTQOASA-N 432.609 2.494 10 20 IECD Cc1cnc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 787878283 FWLQLDPLIJCXPB-OAHLLOKOSA-N 429.908 2.000 10 20 IECD CC(C)(C)c1cc(CS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)no1 790161955 IZRGXBXAZWVHPD-INIZCTEOSA-N 434.562 2.293 10 20 IECD C[C@@H](c1ccccc1F)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734597 UWMCNLAMFMTEFQ-WMZOPIPTSA-N 440.519 2.363 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(OC(F)F)nc1 802550979 KNJVVDBFDQQALN-UHFFFAOYSA-N 434.443 2.147 10 20 IECD CCCCOc1ncccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 803148977 ZAXNGGCJWQVTSE-UHFFFAOYSA-N 440.544 2.372 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@H]3C[C@@H](O)c3ccccc3)ccc21 803685766 KDYXCJGAQQICJW-FYYLOGMGSA-N 437.540 2.036 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1F 804853027 RSPXVWGGXZKQEW-UHFFFAOYSA-N 442.539 2.237 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 916624837 URZWCJNZDLGDBY-UHFFFAOYSA-N 442.541 2.464 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(S(C)(=O)=O)nc1 918308554 LSMWMQASECZCIZ-UHFFFAOYSA-N 430.530 2.073 10 20 IECD C[C@@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCCCC1 918848500 FLPCXRPMNKPONL-OAHLLOKOSA-N 448.475 2.136 10 20 IECD C[C@@H]1Oc2ccccc2O[C@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919043544 XBYBCOKSECDCOX-OYHNWAKOSA-N 444.459 2.050 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(CC(=O)O)ccc3OC)CC2)cc1 919957886 AFOSUUAUYLBZFH-UHFFFAOYSA-N 434.514 2.232 10 20 IECD CCCN(C(=O)[C@@H](C)N1CCN(c2ccc(OCC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 1319847911 QMALKMDYXQTMDP-UYAOXDASSA-N 437.606 2.022 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnc4c(cnn4C)c3)n2)o1 1320730397 ULTIBXMHCSHBJJ-UHFFFAOYSA-N 432.487 2.122 10 20 IECD CCc1nc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)co1 1779707915 YWSWQMDPDOGSRR-HXUWFJFHSA-N 435.864 2.059 10 20 IECD CC(F)(F)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1793702677 NMWSILPDKCFUGW-ZSBIGDGJSA-N 433.546 2.166 10 20 IECD Cc1nscc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794854251 JWMRJFYCZRJIMF-ACHSLPGTSA-N 437.525 2.496 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cnoc1C1CC1 1795005041 NZMOQKQZUJBZSP-FVCICTRLSA-N 447.875 2.134 10 20 IECD CN1CCCC[C@@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1814887041 NSUVLGGOFZCMRH-HZPDHXFCSA-N 428.493 2.006 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)nn1C 1817846330 SCUAFKHZSATSLP-INIZCTEOSA-N 439.476 2.132 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(O)cc1 1822233717 NVNAJQWIWKYEMV-GFCCVEGCSA-N 426.454 2.195 10 20 IECD O=C(Cn1ccnc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708644 LGOSFZRJZOBMOM-NSHDSACASA-N 447.904 2.330 10 20 IECD O=C(Cc1cnc[nH]1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823710452 DTPJGOZPKRUAKU-SNVBAGLBSA-N 447.904 2.399 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825651137 OAXFEBVJEPDTHA-MRXNPFEDSA-N 445.495 2.465 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)c(F)c3)CC2)cc1 12069524 MZSOMCOGEYNWPU-UHFFFAOYSA-N 432.471 2.240 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 725899810 JOZZELXRENUKRO-ZDUSSCGKSA-N 427.523 2.141 10 20 IECD CCCC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 726235102 UOYZDEHFFQEBIH-WOJBJXKFSA-N 443.592 2.226 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)cc1 728295350 UOJWCGASKJAWPQ-UHFFFAOYSA-N 449.485 2.322 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 733834145 FWQATKCEPDCAIT-XFQXTVEOSA-N 432.498 2.035 10 20 IECD CCCCNC(=O)[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 747860680 LYYCNVNSDCPFKQ-FQEVSTJZSA-N 445.608 2.155 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(C)c([N+](=O)[O-])c1 753822071 FYWHXWCXTFGITJ-UHFFFAOYSA-N 440.456 2.327 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756711112 IGELPENGVWLANO-AEFFLSMTSA-N 441.532 2.125 10 20 IECD CCOC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 766113009 NGXVHPRWQXECEA-JENIJYKNSA-N 435.540 2.331 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1O 768085878 MIQOGWJWWMWWFR-UHFFFAOYSA-N 426.517 2.186 10 20 IECD COCCCS(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 770334294 JFNLQBUHPCZBHA-UHFFFAOYSA-N 437.537 2.357 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1 770465799 VVUZASJBTXRILS-UHFFFAOYSA-N 427.482 2.437 10 20 IECD COc1ccc(N(C)CC(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)cc1OC 771796739 YFZBFEAMPMBIMU-UHFFFAOYSA-N 444.507 2.062 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775260004 MIWCJVHHTGEGKS-MBSDFSHPSA-N 437.540 2.300 10 20 IECD CN1CCN(c2cc(NC3CCN(c4ccc(OC(F)F)cc4)CC3)ncn2)CC1=O 775465936 QSRUGURLCUZEEB-UHFFFAOYSA-N 432.475 2.437 10 20 IECD O=C(NCCO)C1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775652230 JAJFAPKXVQTFLC-UHFFFAOYSA-N 436.144 2.238 10 20 IECD CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1cnn(C)c1 776338214 GTCWLYGTKXAXKP-FQEVSTJZSA-N 443.548 2.481 10 20 IECD CC(C)Cc1ccc(-c2csc(NS(=O)(=O)c3cn(C)c(=O)n(C)c3=O)n2)cc1 776785618 XRXOHOJOKMXJMK-UHFFFAOYSA-N 434.543 2.207 10 20 IECD CNC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778235509 POLJOKYNXUDYNN-QXMHVHEDSA-N 436.512 2.207 10 20 IECD COC[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H](C)O1 784660140 ZTZUQHZFLGNVTR-OCCSQVGLSA-N 426.516 2.130 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 785298016 UACIBLDDMABFEH-BBRMVZONSA-N 432.448 2.481 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(OC)c1 785489807 OXMIHMUACZEWMP-UHFFFAOYSA-N 448.906 2.308 10 20 IECD CCOC(=O)c1ccnc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1[N+](=O)[O-] 786072040 GDQXZPAJMMZAOR-UHFFFAOYSA-N 427.461 2.447 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN4C(=O)N(CC(C)C)C[C@@H]4C3)CC2)cc1 787160007 QFIBZFCHIYFIAZ-FQEVSTJZSA-N 429.565 2.451 10 20 IECD O=C(NCCCN1CCc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787688872 PJVXXNIPCWFSDK-OAQYLSRUSA-N 437.540 2.469 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)cc1F 787753315 GGCATWOPCQBHLP-UHFFFAOYSA-N 428.508 2.063 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(c2ccccc2)C1 788324907 ZMYODRLDMHJRDV-HSZRJFAPSA-N 436.556 2.267 10 20 IECD CCSc1cc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccn1 789840448 IJVFWEAVZCDIDR-UHFFFAOYSA-N 446.548 2.226 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CC2)cc1 792972238 MCMVGLNLUVANOZ-UHFFFAOYSA-N 434.496 2.271 10 20 IECD CCC(=O)c1ccc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(S(N)(=O)=O)c1 804365225 AKUGAVCBTUGACE-KRWDZBQOSA-N 444.557 2.241 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807099924 HKWVNVBNAVILMJ-UHFFFAOYSA-N 428.508 2.174 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O 808189490 SLNHCAJBWMIZMM-NRFANRHFSA-N 437.544 2.196 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC(=O)N1CCCC1=O 913359885 FXPIXWWUJOJFDX-JLHYYAGUSA-N 438.552 2.422 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCC(C(=O)N4CCC[C@@H](C)C4)CC3)CC2)cc1 916984923 SDHPCYCZHCKODW-HXUWFJFHSA-N 442.604 2.314 10 20 IECD CNC(=O)c1ccc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918117194 IKSVTECQIKJCAT-FQEVSTJZSA-N 437.544 2.090 10 20 IECD Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918438396 NVQRNEBZSLHCGJ-UHFFFAOYSA-N 428.508 2.416 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1C[C@@H](C)O[C@H](C)C1 921203349 FZLPKWXWGLQKIL-VFSLUADLSA-N 430.593 2.138 10 20 IECD COc1cc(NCc2ccc(N3CCN(C)CC3)c(F)c2)ccc1S(=O)(=O)N(C)C 1262186824 OOJAICZGMVCXGR-UHFFFAOYSA-N 436.553 2.449 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)O)[C@H]3C2)cc1 1791051819 IYAGHCHWCDYNSB-HQMSXXKGSA-N 425.529 2.068 10 20 IECD Cc1nc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1798313585 IKVXBRUCOUHXLV-IVWMJMPLSA-N 449.866 2.111 10 20 IECD Cc1cncc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)c1 1808485664 JOYRWIRVDLPFOY-UHFFFAOYSA-N 446.598 2.095 10 20 IECD CCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814190212 UBNYEQDKWAGEPB-MAUKXSAKSA-N 448.614 2.384 10 20 IECD C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832221907 OOTUQCJNLIFJHM-VQIMIIECSA-N 441.532 2.259 10 20 IECD O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C1CC1 1832875895 RYNNRYUCFBDHCZ-KOEDOTQGSA-N 442.512 2.415 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccc1O 1845355116 ALBFANNCKHKHES-UHFFFAOYSA-N 432.480 2.311 10 20 IECD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC2(CCCN2C(=O)C2CC2)C1 1846763015 AKFTYGCQACVTLZ-LJQANCHMSA-N 442.560 2.318 10 20 IECD CN(C[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)C(=O)OC(C)(C)C 116080994 YILOSGPYKXPKRA-AWEZNQCLSA-N 441.550 2.483 10 20 IECD CSc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)OCCO2 726292221 UICQIPKSBMMKFS-UHFFFAOYSA-N 443.525 2.271 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 741055369 JEFGAYKLYDIRPJ-UHFFFAOYSA-N 442.541 2.405 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2C=CS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742750401 MXTRIWUKCTWDDJ-QAPCUYQASA-N 437.562 2.383 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 753644987 QRRKEYXIOPVXON-NSHDSACASA-N 432.420 2.142 10 20 IECD CCc1noc2ncc(S(=O)(=O)Nc3ccc(NS(=O)(=O)CC)c(OC)c3)cc12 762440572 SIYUMCORBSKNGY-UHFFFAOYSA-N 440.503 2.356 10 20 IECD CS[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H]1N(C)C 765266622 BEZIURVGLKCLMS-ZBFHGGJFSA-N 441.600 2.372 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4cccc([N+](=O)[O-])c4)n3)CC2)cc1 771067916 POTFDOKEQGDWQW-UHFFFAOYSA-N 437.456 2.469 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 773741026 RYRXOOGNZHKDAQ-CQSZACIVSA-N 443.525 2.006 10 20 IECD CC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 778372799 HPGQGSRFOYBGCB-YAINUAMHSA-N 431.533 2.137 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@]4(C3)C(=O)Nc3ccccc34)cc2)C1 779537355 RHJMHNUHTJWQRT-CJAUYULYSA-N 447.539 2.194 10 20 IECD COc1ccc(OC)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 786649281 MPXFFIDMLDECQY-LJQANCHMSA-N 428.485 2.233 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](CC(C)C)N3CCCCC3=O)cc2)CC1 786656172 LJMJJCRLUUQHBY-JOCHJYFZSA-N 428.577 2.399 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(S(C)(=O)=O)ccc3Cl)cc2)CC1 786660449 XSGUGJHGHWWGAI-UHFFFAOYSA-N 449.960 2.342 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(CCc2cccs2)CC1 788936338 KGYVQRLAHSKSRA-UHFFFAOYSA-N 426.586 2.351 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2ccccc2CC1 789848025 XTIZFFDGWCOFDU-UHFFFAOYSA-N 425.504 2.030 10 20 IECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)n2C 789854524 BIVAJANHYURPHM-UHFFFAOYSA-N 437.569 2.368 10 20 IECD C[C@@H]1CCCC[C@H]1CCNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793724946 PQLSBZKOASKVHH-HOJAQTOUSA-N 428.577 2.337 10 20 IECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)c(O)c1 794377295 GELCJVXWRWSAOI-UHFFFAOYSA-N 440.468 2.396 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(C)c2)cc1OC 795302810 AGPJLSJAABOCCS-UHFFFAOYSA-N 428.488 2.264 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CO)c3ccccc3OC(F)(F)F)nc12 796523779 HHWDICRLQLPWRL-AWEZNQCLSA-N 440.378 2.333 10 20 IECD CC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803677038 DKDWWHGFBBSLHB-FQEVSTJZSA-N 428.577 2.446 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)ccc21 803687780 GYHQAIZRMCHMKE-GOSISDBHSA-N 430.549 2.153 10 20 IECD COC[C@]1(CNC(=O)NCc2ccc(N3CCOCC3)cc2)OCCc2ccccc21 811866506 LZQAPDPWFWFKGO-DEOSSOPVSA-N 425.529 2.437 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 915305906 WPTXPDZKHMJMQK-UHFFFAOYSA-N 432.546 2.437 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919968927 QTVMBEOYWCABCO-UHFFFAOYSA-N 447.557 2.007 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920868462 FUBICAJQWKNZAN-KRWDZBQOSA-N 446.573 2.133 10 20 IECD CN1CCN(c2ccc([C@@H]3NC(=O)c4cc(N5CCOCC5)ccc4N3)cc2F)CC1 1115863400 BGDGRZIZLAOEGD-QFIPXVFZSA-N 425.508 2.268 10 20 IECD Cc1c(F)cccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777846440 HXSKHPDVYKHIFQ-WZONZLPQSA-N 443.475 2.382 10 20 IECD CO/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781122059 JRVZEZOTDWVRNL-QQCGKZLYSA-N 438.908 2.429 10 20 IECD O=C(CCc1ccco1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004934 QGIPBJPWJQWZPE-OAQYLSRUSA-N 434.876 2.421 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1C1CC1 1791908224 VCZLMFGUVIRHGY-YSSFQJQWSA-N 437.496 2.277 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)N1CCCC1)c1cc(O)c(O)c(Cl)c1 1794059503 WAYYTYZWYGRLBW-MUJYYYPQSA-N 449.935 2.406 10 20 IECD N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1cccc(Cl)c1 1796073527 OQSZBZGAICQFJK-YYAJDYIMSA-N 430.892 2.098 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(=O)C2CC2)C3)cc1 1799619804 DIADQNBORDEPBK-VTYHHJSWSA-N 435.524 2.276 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)COCCO)C3)cc1 1800514063 ILZOVKGCFYWAIS-QQFNCUIESA-N 425.529 2.355 10 20 IECD Cc1nn(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1F 1827426807 IAMSQKZAFOUWMP-INIZCTEOSA-N 445.495 2.221 10 20 IECD O=C(c1ccc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901905 VSEJUQGASHWLDT-INIZCTEOSA-N 434.587 2.108 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3cnccc3[nH]2)C1 1844113293 BKCZBINDWITMRL-HWKANZROSA-N 434.452 2.210 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccccc4F)n3N)CC2)cc1 23473983 HMEFDYNRNVSRDD-UHFFFAOYSA-N 442.520 2.248 10 20 IECD COc1ccc(N2CCN(CC(O)CN3CCN(c4ccc(OC)cc4)CC3)CC2)cc1 31539098 VHPOJFNPMOMKPV-UHFFFAOYSA-N 440.588 2.009 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CSCN3C(=O)C(C)(C)C)CC2)cc1 728151425 CAOXQYZOTXKZNG-HXUWFJFHSA-N 448.633 2.271 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 728751910 WZACKEYPTYSVPQ-UXHICEINSA-N 438.519 2.497 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3cccc(C(F)(F)F)c3=O)cc2F)CC1 730194977 UPRJLOKSDGZLJU-UHFFFAOYSA-N 440.441 2.465 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4c(c3)C[C@H](C)O4)CC2)cc1 732923056 KIAKSJKKAFOBLI-KRWDZBQOSA-N 431.558 2.119 10 20 IECD CN1CCC[C@H](N2CCN(CC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CC2)C1 734487276 PEOJHGVVMNTDDC-IBGZPJMESA-N 446.551 2.112 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c1O 737286407 ZIJIXSSVIHZYRG-UHFFFAOYSA-N 425.485 2.211 10 20 IECD CS(=O)(=O)N1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805187 IDNHRYKYJSCYFD-RHSMWYFYSA-N 431.505 2.187 10 20 IECD CCn1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1=O 743974855 JACGMKQHZVQIMB-AWEZNQCLSA-N 434.443 2.193 10 20 IECD CCN(CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(OC)cc1 746108926 FWSCHOXVEUPTIR-UHFFFAOYSA-N 433.530 2.181 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)NC(=O)CC3CCCCC3)CC2)cc1 749852370 YYOSJXXYMQKOTM-LJQANCHMSA-N 430.593 2.409 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O 753291989 ZJODOEXBUFGHAJ-QFIPXVFZSA-N 437.544 2.251 10 20 IECD CNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)CC1 754389265 NOBLBLVMUUZNQF-UHFFFAOYSA-N 433.350 2.360 10 20 IECD C[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS1(=O)=O 758890327 ZKPWOHNVZWQOCV-CABCVRRESA-N 431.505 2.475 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1 760091700 BAZWTPJJVMQWHI-HXUWFJFHSA-N 439.512 2.288 10 20 IECD CCOC(=O)C1=C(COC(=O)/C=C\c2ccc(O)c(O)c2)NC(=O)N[C@@H]1c1ccco1 772775198 MRGBKTICXJODAO-MONCILHSSA-N 428.397 2.119 10 20 IECD CS(=O)(=O)C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 774172135 MERLPCZAIVVZNI-HXUWFJFHSA-N 449.548 2.372 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)C3CCN(C(C)C)CC3)CC2)cc1 778222963 FEDCJMSHKCNKNV-KTKRTIGZSA-N 428.577 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](CN(C)CC4CC4)C3)CC2)cc1 778299647 LOZQIBMVKAEJJR-YUQDSPFASA-N 440.588 2.090 10 20 IECD CC[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1nccs1 785531302 UNGPSRPGHKRDFU-IBGZPJMESA-N 445.589 2.048 10 20 IECD COc1cc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 785587661 LFIXURNZJMTFNK-AWEZNQCLSA-N 444.488 2.214 10 20 IECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1F 785602021 FAYUQNJXRPRTKV-NRFANRHFSA-N 433.487 2.457 10 20 IECD CCCN(C)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824251 HMAHDLHACAAJCR-WSTZPKSXSA-N 448.583 2.246 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccco1 789824829 KBXYJOJMEWMNOR-RKVPGOIHSA-N 433.480 2.152 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)cc2F)CC1 789936671 VYAMHIQWOFBOLC-KRWDZBQOSA-N 432.462 2.287 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cn1 795604406 BWTSWNSJWLANMX-UHFFFAOYSA-N 439.496 2.138 10 20 IECD C[C@H]1C[C@H](N2CCOCC2)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 796377390 LGTHNIOPINPKCF-IRXDYDNUSA-N 433.508 2.196 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1 804315518 IRDVJJZPIVYYFS-UHFFFAOYSA-N 436.556 2.125 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccc(S(C)(=O)=O)s2)C2CC2)cc1 807694314 GPFGARYVEFTFLL-UHFFFAOYSA-N 435.571 2.025 10 20 IECD COCCN1C(=O)/C(=C/Nc2ccnn2Cc2ccc(C(C)(C)C)cc2)C(=O)NC1=S 814316619 DSFSDOHICWUMKC-GHRIWEEISA-N 441.557 2.414 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)sc1C(C)=O 815518834 CDRACCYJWXUEOO-UHFFFAOYSA-N 442.497 2.154 10 20 IECD CCCC1(CCC)NC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 917706885 ZTGOASHLJDPJMG-UHFFFAOYSA-N 434.512 2.169 10 20 IECD COc1ccc(N2CCCN(C(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 917821356 APBCGPMEKONGEH-UHFFFAOYSA-N 426.473 2.462 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCNS(=O)(=O)c3ccc(C)cc3)CC2)cc1 918006341 UWHVDVRYKFBTEV-UHFFFAOYSA-N 446.573 2.204 10 20 IECD CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 920345298 GAFFTUJOUBBFIO-MOPGFXCFSA-N 428.577 2.289 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)NCc4ccccc4)CC3)cc2F)CC1 1319688449 JIYFRMASZMQWRV-UHFFFAOYSA-N 439.579 2.012 10 20 IECD CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1342840744 KSVSMJBHVLWTGP-MRXNPFEDSA-N 440.905 2.321 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1793761588 JHFSBAJGQUZPCM-FJXIAYRNSA-N 440.500 2.119 10 20 IECD O=C(c1cc(F)ccc1Cl)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054854 VMESURYWXIRUDM-UHFFFAOYSA-N 441.937 2.156 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CCCC[C@@H]1O 728750185 BZSKFHPNNBAPEI-ICSRJNTNSA-N 428.512 2.045 10 20 IECD Cc1cc(C(=O)N2CCCN(CC(N)=O)CC2)c(C)n1-c1ccccc1Br 728867835 SYRYMXFUVDTYKF-UHFFFAOYSA-N 433.350 2.490 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)nc12 740301552 XTPNVWLVWZDCBC-ZFWWWQNUSA-N 448.476 2.348 10 20 IECD CN(c1ccc(CNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1)C1CCCCC1 742591116 YFOZXQQVIZOHBK-WKDRNLAYSA-N 425.529 2.234 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)Cn4c(cc5ccccc54)C3=O)CC2)cc1 743869466 SFPUBRUPJLPUIK-UHFFFAOYSA-N 446.507 2.371 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN([C@H](C)C(F)(F)F)CC2)c1 749965366 ZDQAHBMGZJULOA-MRXNPFEDSA-N 429.483 2.495 10 20 IECD COC(=O)C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 753011506 WUBREHYEZWYTAK-WMLDXEAASA-N 427.448 2.230 10 20 IECD COC(=O)c1ccc(CNC(=O)[C@@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753861524 RIPWYRBUVXEXLU-MRXNPFEDSA-N 429.492 2.448 10 20 IECD CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1 757654888 HUFBXSGVQXCQTA-UHFFFAOYSA-N 428.488 2.433 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccc(N(C)C)nc3)CC2)cc(OC)c1OC 759216262 NJVLZCWDBVJLAS-UHFFFAOYSA-N 429.521 2.205 10 20 IECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(Br)o1 761260465 VEGATNNISCZECD-UHFFFAOYSA-N 445.291 2.055 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1F 762465426 PCVAZSWBIQMFCZ-UHFFFAOYSA-N 433.411 2.047 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCOC[C@@H]1C1CC1 770145125 OZZQVPQLWCCRFS-GOSISDBHSA-N 447.469 2.352 10 20 IECD CSc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 770746648 SIZDHDUXMUUULI-UHFFFAOYSA-N 447.582 2.207 10 20 IECD C[C@@H](NS(=O)(=O)CCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccc(N(C)C)cc1 773084290 NYFWDFGHRLHOIC-OAHLLOKOSA-N 443.566 2.193 10 20 IECD CSCC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 773742693 ZGVJHEIBSVXSLP-MWQQHZPXSA-N 434.558 2.442 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(N(C)C)cc1 773858319 PPQYVXPFXZHPPY-INIZCTEOSA-N 444.557 2.353 10 20 IECD COc1ccc([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N(C)C)cc1OC 774857534 GAAUBGUZGVTMPX-HXUWFJFHSA-N 442.560 2.147 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c1O 774915091 QVIQCAGVZKUREU-UHFFFAOYSA-N 436.490 2.003 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@@H]3CCCc4c3cnn4C)CC2)cc1 778393139 YWKDRZNGWXDRBH-RJRNSMGGSA-N 437.544 2.170 10 20 IECD Cc1cc(C(=O)N2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)c(C)n1-c1ccc(F)cc1 779582938 GFWDDWKRTSVZNA-FQEVSTJZSA-N 449.548 2.500 10 20 IECD Nc1ccc(N(C(=O)C(=O)Nc2cnn(CCN3CCOCC3)c2)C2CCCCC2)cc1 784060325 CYTRIAHWLDZKDI-UHFFFAOYSA-N 440.548 2.102 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1 785297467 PIPRTDGCUJTRHU-CQSZACIVSA-N 434.452 2.431 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313085 PPNCMJGUAZBFAS-RTBURBONSA-N 430.593 2.012 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cn3ccc4ccccc4c3=O)CC2)cc1 790482248 JKJRIQGPLDDRBH-UHFFFAOYSA-N 434.540 2.339 10 20 IECD CCS[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793727928 WMYPGSSGSACZMM-YSIASYRMSA-N 446.617 2.185 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc4cnn(C)c4c3)CC2)cc1 794351669 CHHKGTDPZYOLIB-MDZDMXLPSA-N 433.512 2.103 10 20 IECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c(O)c1 794387532 KQAXXCMGUUPXHT-UHFFFAOYSA-N 440.468 2.396 10 20 IECD COc1cncc(S(=O)(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c1 795588513 UXXURQQIGIATPO-UHFFFAOYSA-N 426.498 2.383 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4cc(OC)ccc4C3)CC2)cc1 801967782 MLYNJTDNODGHRL-OAQYLSRUSA-N 427.545 2.081 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)CSc3cccc(F)c3)nc12 803797574 NBZDKFHYAVGIKU-HXUWFJFHSA-N 449.460 2.337 10 20 IECD O=C(COCc1cccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 805168104 BWVFSOZHFALRFR-UHFFFAOYSA-N 436.491 2.170 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807286912 FEEOPEFQERXGIY-QGZVFWFLSA-N 428.533 2.147 10 20 IECD COc1cc2c(cc1NC(=O)C(=O)NCc1cc(Br)ccc1O)NC(=O)CC2 807386845 MDKPYUACOCTBJP-UHFFFAOYSA-N 448.273 2.303 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1C 917758158 KNFMDBWHHXZGGQ-UHFFFAOYSA-N 428.488 2.264 10 20 IECD COCC(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918032006 DFWDCHBZYYGZKX-QGZVFWFLSA-N 439.516 2.295 10 20 IECD C/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127338 JLFIGAPVEZRIHG-RFRWANLJSA-N 438.528 2.259 10 20 IECD CCOc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1804685871 ANQRGLRFCRLYFJ-UHFFFAOYSA-N 440.500 2.445 10 20 IECD Cc1c(CNC(=O)N2C[C@H](COCC(=O)N(C)C)OC(C)(C)C2)n(C)c2ccccc12 554147900 KMBPHVXEQYPDDI-QGZVFWFLSA-N 430.549 2.281 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCCN(Cc3cscn3)CC2)n(C)c2ccccc12 561370298 PJAAKVYSHPJUNT-UHFFFAOYSA-N 425.558 2.294 10 20 IECD CC(C)CCC(=O)NCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727485234 KSDFZHMAXZHXKW-UHFFFAOYSA-N 442.539 2.111 10 20 IECD COC(=O)CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)Cc1cc(Cl)ccc1O 731844545 FQTSEPOELDFUIE-UHFFFAOYSA-N 447.919 2.496 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)cc1[C@@]1(C)NC(=O)NC1=O 732526442 RQNGXQONQSYAQJ-OAQYLSRUSA-N 444.513 2.151 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4ccc(Cl)cc4)C(=O)C3)nc12 738340611 MXMKOEDLOMHJPK-UHFFFAOYSA-N 443.891 2.109 10 20 IECD C[C@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 743638603 RXTCWYODOKZLNO-UONOGXRCSA-N 448.501 2.314 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3c(O)ccc4c3CCCC4)cn2)C[C@H](C)O1 747573412 XVNXCGOMTZJIOE-HOTGVXAUSA-N 441.532 2.425 10 20 IECD O=C(O)COc1ccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cc1Cl 748690898 GOLSNQOZCLKHGN-UHFFFAOYSA-N 426.878 2.441 10 20 IECD COC(=O)c1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)OCO2 753812339 OBPNJTREPZSABA-UHFFFAOYSA-N 425.441 2.057 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 754080958 HCLRPWPWNPFJCN-TZIWHRDSSA-N 440.592 2.053 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2nccn2C)CC1 760876807 UMMRDEJAAPUBBI-MRXNPFEDSA-N 443.507 2.345 10 20 IECD Cc1cn2ccnc(C(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)c2n1 761597406 BBEHBTPIMBNDHW-UHFFFAOYSA-N 446.490 2.223 10 20 IECD CCOc1cccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1O 768185096 KXNFGAVFMXVLNN-UHFFFAOYSA-N 434.543 2.302 10 20 IECD CCCN(CC(=O)N(C)C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769710967 LXMQFYATIVKZMM-UHFFFAOYSA-N 425.532 2.195 10 20 IECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H](c2ccccc2)C1 776004348 WTTWNWWKKLUQPR-HSZRJFAPSA-N 426.536 2.267 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(OC4COC4)cc3)CC2)cc1 781740841 BWVFJHHRCXWWKR-KHPPLWFESA-N 437.496 2.316 10 20 IECD COC(=O)CCC(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 781987051 JOCDGJNPNPVONX-UHFFFAOYSA-N 425.349 2.049 10 20 IECD COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 782071420 RQARMKAURKKAHV-UHFFFAOYSA-N 434.474 2.160 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)s1 782305871 MWEHMYRJKPJORF-ZDUSSCGKSA-N 425.484 2.047 10 20 IECD Cc1cc(Br)c(=O)n(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 783132010 JBJIXUGLPFJBJQ-UHFFFAOYSA-N 438.297 2.211 10 20 IECD COC[C@H](C)n1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 784768515 YWJZJOQVFCUQQR-WMLDXEAASA-N 449.939 2.169 10 20 IECD C[C@@H](NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 788027137 STPQTWDLOUVEIC-GOSISDBHSA-N 441.551 2.007 10 20 IECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789816316 CVLSROCPOMWWNG-IRXDYDNUSA-N 435.540 2.379 10 20 IECD CN(C)CCCC1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789860169 IQXDZSXTEFSNSS-UHFFFAOYSA-N 432.634 2.436 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@]3(CO)CC(C)C)CC2)cc1 789873724 NFAXFXQCNUYJMH-GTCGAKFVSA-N 429.561 2.300 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1c(S)nc2ccccc2c1=O 799718236 STYRDYOLELBGFC-UHFFFAOYSA-N 447.900 2.246 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCN3CCOCC3)cc2Cl)C1 800721266 YZKDDJUGUHIXGP-SFHVURJKSA-N 439.000 2.412 10 20 IECD O=C(COC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1)c1ccc(O)c(O)c1 801881655 SOAWYEUQNKIOHS-IAGOWNOFSA-N 436.420 2.416 10 20 IECD CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 808072607 MXBXNYLHLDIJQQ-UHFFFAOYSA-N 432.545 2.043 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809243007 FZZGCBNMVZSGDV-LPHOPBHVSA-N 432.565 2.473 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ncc(C(F)(F)F)s1 812956729 AINLDPBQGMZOPZ-UHFFFAOYSA-N 432.399 2.393 10 20 IECD Cc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nnn1-c1ccn(C)n1 815834983 HIKFBVQKFBJYDA-INIZCTEOSA-N 429.912 2.063 10 20 IECD C[C@H](c1ccc(F)cc1)N1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 818641775 WJPNAIZUFYYMNB-FZKQIMNGSA-N 449.504 2.385 10 20 IECD COc1ccc(OCC[S@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 912938866 SQAPCDCUSVFPMO-PMERELPUSA-N 432.542 2.180 10 20 IECD O=C(CN1CCN(CCc2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917006012 GXKVAJGZESKBLD-UHFFFAOYSA-N 440.563 2.139 10 20 IECD CS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c(S(C)(=O)=O)c1 917252265 WPNMAAJZEPNDKV-UHFFFAOYSA-N 442.534 2.081 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)cc1C 917758123 IQAKTZOQFDXOOQ-UHFFFAOYSA-N 429.476 2.474 10 20 IECD COc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1S(=O)(=O)NC1CC1 918372034 RUOPAWDIWLJEIA-UHFFFAOYSA-N 431.514 2.225 10 20 IECD NS(=O)(=O)c1ccc(CCNC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1 919803275 ZNVUVDBSRCVTTJ-UHFFFAOYSA-N 439.484 2.047 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 920195490 TZZGSXMIHKRUTH-QFIPXVFZSA-N 439.512 2.336 10 20 IECD CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc21 920636804 MCCNMVOJTREBBJ-GFCCVEGCSA-N 446.481 2.101 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920887027 XHBKYFPBNNECIJ-HNNXBMFYSA-N 435.521 2.452 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806234680 FOTYVCQHAOTJJT-DYESRHJHSA-N 446.463 2.090 10 20 IECD CCc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816722054 BYQHEFYNXUJTHI-CYBMUJFWSA-N 439.497 2.446 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnco2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145653 BRGWWBYJHHTLMC-QGZVFWFLSA-N 447.455 2.497 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccc3[nH]ncc23)C1 1843262269 WMPBNLYVHAVPJQ-SOFGYWHQSA-N 434.452 2.210 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)no1 1843441281 KZULBQMXSKTULZ-UHFFFAOYSA-N 435.484 2.408 10 20 IECD CS(=O)(=O)c1ccc(OCCCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 109344171 XMXDBVFCNPUMPR-UHFFFAOYSA-N 432.542 2.402 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)CC2)cc1 726561413 UQENFDJHZVRGQY-UHFFFAOYSA-N 433.530 2.472 10 20 IECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 733224916 CXRHRQZIABHMJT-VXGBXAGGSA-N 444.465 2.264 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCn2c(Cc3ccccc3)nnc2C1 743560637 VVNMMGSOQLQFRB-UHFFFAOYSA-N 432.528 2.431 10 20 IECD CC(C)OCCN1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 746496258 VYOGFCJMTRNFPP-UHFFFAOYSA-N 435.524 2.443 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1 749031594 ZGYNPTCNVFEWEG-UHFFFAOYSA-N 427.526 2.107 10 20 IECD COc1ccc(N2CCN(CCN[C@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 749130754 ZJCFTBQGSUKTCC-LJQANCHMSA-N 446.617 2.418 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1NC(C)=O 751235661 ARUXHYCCCDHPQF-UHFFFAOYSA-N 447.557 2.341 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(c2nc[nH]n2)CC1 751427750 GSQNUUXFCOYMJR-UHFFFAOYSA-N 433.515 2.392 10 20 IECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 752878816 GEZKEVCAGIDJGE-NJYVYQBISA-N 443.592 2.319 10 20 IECD CCn1c(O)nc2cc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)ccc2c1=O 753740149 OPKVNVOMRYFDQA-UHFFFAOYSA-N 426.448 2.232 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN(C)c3ccc4c(c3)OCO4)CC2)cc1C 756657792 DSBAFEPDYCJCFL-UHFFFAOYSA-N 445.541 2.001 10 20 IECD COc1cc(N2CCN(C[C@H](O)COc3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759873648 XWDGMFIQOSWJDX-SFHVURJKSA-N 447.488 2.183 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)c1 761966817 AMSWPZRGJRHIJP-CYBMUJFWSA-N 440.543 2.038 10 20 IECD CCNC(=O)c1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2ccccc12 763237287 QMABOASCJWPYTA-UHFFFAOYSA-N 428.470 2.314 10 20 IECD CC(C)(C)C(=O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770141495 LEMSAEQLIDMTJG-UHFFFAOYSA-N 435.458 2.446 10 20 IECD CC(C)OC[C@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 770707267 SHTSIDPMRKUFME-WSTZPKSXSA-N 437.556 2.181 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)OC[C@@H]4CCCO4)n3)CC2)cc1 771067888 PKWMNPMQCBJRQS-APWZRJJASA-N 430.505 2.226 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@H](c4ccco4)C3)CC2)cc1 778319411 WTMMMXCMAUAMNH-GEPASTNRSA-N 425.485 2.093 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4cccc(C)c4)CC3)CC2)cc1 779213939 OUYOQCOUZKLSEZ-VWLOTQADSA-N 438.616 2.304 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@H](C)O)cc1 779501500 AJBSCADHHYMXGF-PGRDOPGGSA-N 445.585 2.329 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)N3CCOCC3)CC2)cc1 784356753 SIIHSBRYLQEINK-FCHUYYIVSA-N 427.545 2.175 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1N1C[C@H](C)O[C@H](C)C1 785294867 OVRQRUFIXJXPLK-HRCADAONSA-N 427.501 2.397 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC4(CCCC4)C3)CC2)cc1 785528558 IWTKOUQUOZNMOV-UHFFFAOYSA-N 428.577 2.116 10 20 IECD C[C@@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 787948789 BDRIVEAPTNGZGL-AWEZNQCLSA-N 439.434 2.499 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12 788321939 DLVYWBRCJRWVIW-RUZDIDTESA-N 435.524 2.188 10 20 IECD C[C@@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788935790 FPWPVTRQBUPVAL-KRWDZBQOSA-N 427.574 2.265 10 20 IECD COC(=O)Cc1cccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 792406057 FYJLGBZCIPTMIK-UHFFFAOYSA-N 444.488 2.177 10 20 IECD Cc1ccc(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 793732610 JMCJMOYCKNOVMR-YJBOKZPZSA-N 442.585 2.122 10 20 IECD CCN1CCC(CNC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)CC1 793812232 CGFXPRPWOGLJOX-UHFFFAOYSA-N 426.355 2.351 10 20 IECD CNC(=O)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 796588499 VOONKLJWSNAQGS-GGPKGHCWSA-N 448.583 2.436 10 20 IECD C[C@H](O)C[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 803311321 UFNLVYNBGFEUIV-CNNODRBYSA-N 439.556 2.371 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C(C)(C)N3CCCC3)cc2F)C[C@H](C)O1 805608913 JXLNPNKGIADYTA-IRXDYDNUSA-N 435.540 2.473 10 20 IECD C[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1(S(C)(=O)=O)CC1 808931188 JSRRCNCAYIXIHU-LLVKDONJSA-N 442.449 2.066 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C(=O)OC)c3ccc(OC)c(Cl)c3)nc12 809564063 VOVWQSWWIZMPEE-KRWDZBQOSA-N 448.863 2.278 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)sc1C(C)=O 815446698 BLUJMSJHHUMGKN-UHFFFAOYSA-N 444.513 2.160 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 916232396 JQOPDZXTPOPWDD-OAHLLOKOSA-N 439.559 2.253 10 20 IECD COc1ccc(N2CCCN(CC(=O)N(C)CC(=O)Nc3cccc(OC)c3)CC2)cc1 917210259 KLGOWIJOZXTXSF-UHFFFAOYSA-N 440.544 2.313 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)cc2F)C[C@@H](C)O1 917712207 VWEPWNDVHOUPBX-HZPDHXFCSA-N 446.523 2.310 10 20 IECD O=C(COCc1nc2ccccc2s1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918336083 VEQYGLSHUFBTKZ-UHFFFAOYSA-N 445.566 2.364 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cccnc34)cc2)C1 918464413 VHUNABAGRALNBD-SFHVURJKSA-N 431.496 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1254279388 JFQBWZCYEWAWHY-QXPKXGMISA-N 431.533 2.137 10 20 IECD CN1CCN(c2ccc(CN3CCCN(S(=O)(=O)c4ccccc4)CC3)cc2F)CC1 1319699708 CDJIUGUETAPANV-UHFFFAOYSA-N 446.592 2.474 10 20 IECD CCOC(=O)c1ccc(N2CC(NCc3ccc(N4CCN(C)CC4)c(F)c3)C2)nc1 1320911792 JAPQHUQAUUXMNM-UHFFFAOYSA-N 427.524 2.128 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccn1 1798800744 RLGMYSBGCJICKQ-GGPHIMKMSA-N 447.495 2.135 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(F)nc1F 1804283515 KZBCJCXWJWSNBO-ITJFMEAMSA-N 445.422 2.442 10 20 IECD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1824312912 NOLMDXVTGCHRAE-QAPCUYQASA-N 427.505 2.184 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@H](CCS(C)(=O)=O)C3=O)c2C)cc1C 16544305 KUJZEOTYEVFLED-LJQANCHMSA-N 445.541 2.249 10 20 IECD CS(=O)(=O)N1CCCC[C@@H]1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565462 OQICRPLXHWRRHI-QGZVFWFLSA-N 431.505 2.187 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4nccnc4c3)cc2F)CC1 730391715 SUXXGZMZLDZQFW-UHFFFAOYSA-N 436.491 2.166 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 730756728 XDSYMKZBCDFJSP-UHFFFAOYSA-N 449.573 2.487 10 20 IECD CCN(CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 732395637 BGDAPIGARLIGFF-UHFFFAOYSA-N 429.492 2.348 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 734703087 JIIRUQQSIUXVIS-UHFFFAOYSA-N 444.557 2.100 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(S(C)(=O)=O)cc1 753205561 UJNQGKGMVBKRMG-LPHOPBHVSA-N 443.569 2.212 10 20 IECD CC1(CO)CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 763011153 IXCHDHPDZPLYAP-UHFFFAOYSA-N 442.539 2.246 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)CC2)cc1 767942685 WGZBXYZWQLRUEQ-UHFFFAOYSA-N 433.530 2.050 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(S(=O)(=O)CC)CC3)cc2F)CC1 770532026 DLGAQELJCPKJHN-UHFFFAOYSA-N 440.585 2.076 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc(C(F)(F)F)ccn1 772929229 PNXSDKCYKAXLHO-UHFFFAOYSA-N 426.370 2.331 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3COC4(CCCC4)O3)CC2)cc1 773737868 LIGPPXDNDHVIRY-NRFANRHFSA-N 432.565 2.192 10 20 IECD CC(C)(C(N)=O)N1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775724660 GLWDANCRVLCFGP-UHFFFAOYSA-N 435.160 2.299 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)N(CC)Cc1ccc(N(C)C)cc1 777862358 VIGKPPVSFCGFTA-UHFFFAOYSA-N 425.576 2.262 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)cc2)CC1 786256294 CZTGQDAZDLTFMH-JOCHJYFZSA-N 434.540 2.020 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1F 786656944 PDZPBRFNFAWWLS-UHFFFAOYSA-N 446.498 2.282 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 788144210 XDWCFMHBRKIGMA-ZJOUEHCJSA-N 432.590 2.207 10 20 IECD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 789168608 KMGYMJPNSVGHKV-HKUYNNGSSA-N 442.560 2.262 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CC2(C(=O)OC)CCCCC2)cc1OC 793368061 PZSVJSBTSVTJFM-UHFFFAOYSA-N 448.563 2.322 10 20 IECD C[C@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCCCC1 793721311 ISSQOFCMOAEKFO-MRXNPFEDSA-N 438.519 2.364 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC([C@](C)(O)C(F)(F)F)CC3)ccc21 803686627 FECWVNOCCGLOTM-FQEVSTJZSA-N 427.467 2.237 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C)c3ncc(C)s3)cc2F)CC1 805007966 WJDBNWVFHWWIBZ-HNNXBMFYSA-N 447.580 2.269 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](N4CCCC4)[C@H]3C)CC2)cc1 806334886 XCMYPDNVXOBIQG-OFNKIYASSA-N 429.609 2.476 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)C1 806493868 GTFGBMXZBGBQKK-RCDGMEKDSA-N 426.561 2.271 10 20 IECD CCSCC[C@H](C)NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 807046734 GTCOMUGDNIQZLP-HNNXBMFYSA-N 439.578 2.009 10 20 IECD O=C(NC1CCN(c2cccnn2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807745818 HUYWXJUTIVBVIY-UHFFFAOYSA-N 435.484 2.089 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)CC2)cc1 808059171 NGNUGTIYJBQVRA-DHIUTWEWSA-N 436.556 2.296 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCOC2(CCCCC2)C1 808117326 NKTWFCLPAFZENY-FQEVSTJZSA-N 429.561 2.480 10 20 IECD COC(=O)c1cn(-c2cccc(NC(=O)NCc3ccc(N4CCOCC4)cc3)c2)nn1 812978403 OPEMRJWVSQDIPQ-UHFFFAOYSA-N 436.472 2.212 10 20 IECD Nc1c(C(=O)OCC(=O)Nc2nnc(C3CC3)o2)ccc2c1C(=O)c1ccccc1C2=O 914886547 VEKRZKUYANNIHU-UHFFFAOYSA-N 432.392 2.100 10 20 IECD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 917708118 GNEHPAGFKHWDCF-UHFFFAOYSA-N 439.509 2.262 10 20 IECD Cc1csc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)n1 918117137 HOHKXDASFJCPFJ-SFHVURJKSA-N 442.589 2.185 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2)C1 918117687 HPMJTRGZQMMDTQ-VXKWHMMOSA-N 435.572 2.462 10 20 IECD COc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918221423 JATKJVYQULPSBK-UHFFFAOYSA-N 440.544 2.133 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1N(C)C 918438450 PIHBSGQGVSZBBF-UHFFFAOYSA-N 428.508 2.416 10 20 IECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc(N2CCN(C)CC2)cc1 1139408443 MHUQJZWCAUDDQW-OAQYLSRUSA-N 446.592 2.423 10 20 IECD Cc1cc(F)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777851679 OKYYCXHATPOETE-WZONZLPQSA-N 443.475 2.382 10 20 IECD Cc1ncsc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005168 XGZBMAACOZDQFG-LJQANCHMSA-N 437.905 2.273 10 20 IECD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)n1cccc1 1782009293 VLWIODOKAOGLGR-SPLOXXLWSA-N 433.892 2.257 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)C1CCCC1 1806188612 FKYRPSDKCGXAHR-VQIMIIECSA-N 446.598 2.138 10 20 IECD Cc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1808907691 ZKDKYMHVIAUNLC-AUUYWEPGSA-N 439.497 2.286 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825335630 YTJZERVKBSGHNM-APWZRJJASA-N 441.532 2.259 10 20 IECD O=C(CCN1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827430067 AQCLCYYFXGDSMA-LJQANCHMSA-N 430.549 2.212 10 20 IECD CCO/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1832053281 IBQQLDAPESFWIN-OQRGYWNNSA-N 439.603 2.017 10 20 IECD Cc1ccccc1OCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842746337 VYHWJSPVMKBNCX-UHFFFAOYSA-N 446.507 2.370 10 20 IECD O=C(c1ccc2nonc2c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501419 NLEUOHZETSLHSW-UHFFFAOYSA-N 428.832 2.418 10 20 IECD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502063 KGPLLGMDLLLZGO-UHFFFAOYSA-N 447.831 2.496 10 20 IECD O=C(CCCc1cccnc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037412 OKLDUJZSKPMDDR-CSKARUKUSA-N 437.496 2.438 10 20 IECD O=C(c1c[nH]c2ncccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037572 OLJYLOYWPRCTJP-FNORWQNLSA-N 434.452 2.210 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3ccccc3Cl)CC2)cc1 12069553 WJKTVUUUHQQHFI-UHFFFAOYSA-N 444.963 2.293 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3Cc4ccccc4N3C(C)=O)CC2)cc1 15773245 RYNLTMVGXPNYQZ-DEOSSOPVSA-N 436.556 2.301 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 117630416 GGNNMDVIMCRMHP-GASCZTMLSA-N 435.521 2.277 10 20 IECD O=S(=O)(N1CCC(CNCc2ccc(N3CCOCC3)c(F)c2)CC1)C(F)(F)F 237695780 GQERUISMDQSWCS-UHFFFAOYSA-N 439.475 2.314 10 20 IECD NS(=O)(=O)c1ccc(CNC(=S)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 726445613 YWMCBTGYFURBJJ-QGZVFWFLSA-N 435.571 2.095 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(CCNC(C)=O)cc3)CC2)cc1 726602361 XHHFPWWOLKEUPP-UHFFFAOYSA-N 431.558 2.321 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccccc3Cn3cncn3)CC2)cc1 726728146 NUGRVTGADNSJCY-UHFFFAOYSA-N 434.500 2.059 10 20 IECD COc1ccc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1N 727005641 DWODTQXYXSLURC-UHFFFAOYSA-N 431.464 2.035 10 20 IECD Cn1ncc2c(N3CCN(Cc4c(O)ccc(C(=O)c5ccccc5)c4O)CC3)ncnc21 728195444 SEGROKRSRUETSS-UHFFFAOYSA-N 444.495 2.328 10 20 IECD C[C@@H]1CN(C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 729597909 UEWLXJZFNVILRU-QWFCFKBJSA-N 434.556 2.446 10 20 IECD CN1C(=O)CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 729785012 CTKNVXCNFIQKAM-IBGZPJMESA-N 437.496 2.448 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H](C)N1C(=O)OC(C)(C)C 733363749 FZTOBLBWFMDYII-BETUJISGSA-N 427.523 2.234 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 735392705 IDVNOPWBKFZJQA-INIZCTEOSA-N 440.500 2.195 10 20 IECD Cc1nc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)n[nH]1 737106850 CAINTJCGXMRVOA-UHFFFAOYSA-N 438.463 2.011 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCC[C@H]3NC(=O)OC(C)(C)C)nc12 740301551 XTPNVWLVWZDCBC-UKRRQHHQSA-N 448.476 2.348 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H](C(F)(F)F)O1 745690539 CTANMLRPRICVLV-KMFMINBZSA-N 428.455 2.250 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 754043279 KJBIIFAOIFPEMB-IFMALSPDSA-N 446.636 2.052 10 20 IECD O=C(COC(=O)c1nc(Cl)ccc1F)NCc1ccc(N2CCOCC2)c(F)c1 758879201 HIVLVNHKIKXRHF-UHFFFAOYSA-N 425.819 2.323 10 20 IECD COc1cc(N2CCN(C[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc(OC)c1OC 759878285 LNJQERXKFQCTDC-FQEVSTJZSA-N 444.528 2.477 10 20 IECD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 763280054 PYXKABAXDUPLIF-RHSMWYFYSA-N 438.571 2.245 10 20 IECD CN1CCN(c2ccc(CNC(=O)NCc3cccc(Br)c3O)cn2)CC1 764763440 VXSOUICHUPMVNA-UHFFFAOYSA-N 434.338 2.301 10 20 IECD CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 767662857 JGNXGSUJCUVAIS-MRXNPFEDSA-N 425.501 2.208 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1 773855850 HHKLDBXXOGKFGG-OAHLLOKOSA-N 444.557 2.318 10 20 IECD CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)CC1 774356061 GSGYGSUMGVTRDW-UHFFFAOYSA-N 425.485 2.267 10 20 IECD COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@H](C)c1cc(OC)ccc1O 775368817 GOEKTAHHBOWARO-JLTOFOAXSA-N 425.485 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 778246828 LPRCGWWLTLQGRR-DOHOIIEJSA-N 442.604 2.383 10 20 IECD COC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 778302420 QJPXAOWDFGVELT-JPMGXVIASA-N 427.501 2.305 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@](OC)(C(F)(F)F)C3)CC2)cc1 781978790 SMCOXTRHRXQGKO-AZUAARDMSA-N 431.499 2.221 10 20 IECD Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)OCC(=O)c1ccc(O)c(O)c1 782852138 JBDVLEFXNIVJJN-UHFFFAOYSA-N 429.454 2.280 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C3CCOCC3)C[C@@H]2C)c1 782896643 AJPYTRCZFBLIGR-SFHVURJKSA-N 431.577 2.112 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C 785297745 RZHCPHJANZUOTB-CYBMUJFWSA-N 449.529 2.244 10 20 IECD Cn1ccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1F 785602022 FAYUQNJXRPRTKV-OAQYLSRUSA-N 433.487 2.457 10 20 IECD CCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 787282586 CQRHGYBHNKUOHQ-HOTGVXAUSA-N 444.507 2.166 10 20 IECD CN1CCC(n2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)n2)CC1 787456919 SVPFYKAFRQQANH-LJQANCHMSA-N 441.532 2.002 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1C 794864532 OJTYUIHNFPFXER-UHFFFAOYSA-N 429.476 2.474 10 20 IECD Cc1nc(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1C 795248583 GTGFWQZNJIIYCJ-QGZVFWFLSA-N 437.566 2.339 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(=O)c4ccc(F)cc4o3)nc12 803928268 KOHUFWNXAHRBKL-UHFFFAOYSA-N 427.344 2.214 10 20 IECD CN(C)C(=O)COC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 913359963 ANRLSZUDZDYYGI-GHXNOFRVSA-N 443.344 2.282 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)cc2F)C[C@@H](C)O1 917712210 VWEPWNDVHOUPBX-IYBDPMFKSA-N 446.523 2.310 10 20 IECD COC(=O)COc1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918035659 YADDRRGHKMBOBG-QGZVFWFLSA-N 440.500 2.262 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncccn4)CC3)cc2F)C[C@H](C)O1 918221698 RGBSXDVEBBPCBV-IRXDYDNUSA-N 428.512 2.261 10 20 IECD Cc1cc(C)n(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 919022712 INGWKAQGXOMFTI-CALCHBBNSA-N 432.496 2.112 10 20 IECD C[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CC=CCC1 1782720438 DNABIAIRHYEAHS-MQNAVGNWSA-N 429.517 2.367 10 20 IECD O=C(CC(F)(F)C(=O)O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800714795 FRZAPOPFJCXTGG-JGPRNRPPSA-N 432.807 2.113 10 20 IECD Cc1cc(F)cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804336411 VZLZPZCQAQZRBW-BJWYYQGGSA-N 449.573 2.175 10 20 IECD Cc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1807990667 KAKBPUWHFORTMN-RDTXWAMCSA-N 439.497 2.286 10 20 IECD CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cn1 1810547088 OGXCPGHOWULGDR-UHFFFAOYSA-N 439.516 2.112 10 20 IECD CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n(C)n1 1819831021 OQZPHZQGUORQAI-OAHLLOKOSA-N 439.476 2.132 10 20 IECD C[C@@H]1C[C@]1(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1820772526 IYQAVRDXXKFXCY-MVBJNABHSA-N 435.575 2.308 10 20 IECD Cn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)n1 1823709016 VELJVHNVVCNLPZ-JTQLQIEISA-N 447.904 2.481 10 20 IECD CC[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824086486 SIBCDYBJSYGWGX-AZGCOUAMSA-N 432.517 2.207 10 20 IECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1827427159 QFAVPMSSMRJMBD-KRWDZBQOSA-N 427.505 2.082 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3ccoc3cn2)C1 1845580660 GJAMFCPQJPIRNU-HWKANZROSA-N 435.436 2.475 10 20 IECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccc1F 1847033899 NSOZXSBHIKXBRV-XBXARRHUSA-N 427.432 2.176 10 20 IECD O=C(c1cc(Cl)ccn1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038277 INPZVLPUDKWBKH-HWKANZROSA-N 429.860 2.382 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3cccc(CS(C)(=O)=O)c3)C=C2)cc1 466319704 GTSHGRSMXVEXHG-UHFFFAOYSA-N 444.534 2.214 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)[C@@H](C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 733341547 AGASSLMAVRODKI-QKPAOTATSA-N 429.558 2.402 10 20 IECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 734065446 BRXWYPIQBIGIPG-MWTRTKDXSA-N 446.498 2.373 10 20 IECD O=C1C[C@H](Cc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)C(=O)N1 743313988 LFAOYKUOIOMUSM-NRFANRHFSA-N 435.524 2.031 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(-n4cncn4)c(C)c3)CC2)cc1 745411553 QOERSDWNFXPXHZ-UHFFFAOYSA-N 435.484 2.090 10 20 IECD CC1CCN(c2ccc(CNS(=O)(=O)c3cnc4nc(O)nc(O)c4c3)cc2)CC1 752246063 BFZVREXLMSYVKP-UHFFFAOYSA-N 429.502 2.151 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC([C@@H]4CCOC4)CC3)CC2)cc1 752998206 ALNGDSNLMVTYBC-PXDRNWIDSA-N 427.545 2.175 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-] 759253047 MZVPAWJXLRGVRJ-UHFFFAOYSA-N 425.438 2.058 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 768917417 YYHWWFSMDZQYOJ-QGZVFWFLSA-N 437.949 2.348 10 20 IECD CCN1CCOC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 769080144 YURXGKKPTJLSSJ-AUUYWEPGSA-N 436.464 2.053 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc4c3NC(=O)CO4)cc2F)C[C@@H](C)O1 774679601 LLTXFCJVWYWSIF-GASCZTMLSA-N 443.475 2.465 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(O)(C(F)(F)F)CC3)CC2)cc1 775411744 WXIPRJKGXOXUKU-UHFFFAOYSA-N 444.498 2.306 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC(OC(F)F)C1 781196509 AFPKYYQSWZKKIL-UHFFFAOYSA-N 443.384 2.165 10 20 IECD Cc1cc(C(=O)CN2CCc3ncsc3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782636006 UHOHUCLMRXSPFS-UHFFFAOYSA-N 430.555 2.439 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1c[nH]nc1-c1ccccc1 782776609 BRBRRBCEPBKWCE-UHFFFAOYSA-N 437.475 2.432 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1 785298029 UHPGNSOBFUEWKO-MRXNPFEDSA-N 443.569 2.375 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)cc2)C1 785609127 PEAVCQYVZRPIGH-DOIPELPJSA-N 440.588 2.480 10 20 IECD CN(Cc1ccccc1N1CCCC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324016 PTACBUIVSBQFBF-UHFFFAOYSA-N 436.556 2.398 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1 788978267 WQJMFAMXGSYSNM-SFHVURJKSA-N 445.585 2.436 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)CN1CCN(C)CC1 790182414 BWROQUYGQQOLRJ-HXUWFJFHSA-N 443.636 2.071 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(F)ccc1-n1cccn1 793127819 YGTUYEWUVKXUFF-UHFFFAOYSA-N 428.489 2.176 10 20 IECD CCCC1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793716644 DGYVVESHYLNAPW-SYYJFZTOSA-N 428.577 2.480 10 20 IECD CCOC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)c1 795298133 COOQYMZNONXFEF-UHFFFAOYSA-N 442.515 2.434 10 20 IECD Cn1cc2c(n1)CCC[C@H]2C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 798405639 TWRRARLYBLQDIM-GOSISDBHSA-N 449.534 2.412 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688083 UWHQUMIIZBHOAH-QFBILLFUSA-N 444.576 2.447 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)NC(=O)OC(C)(C)C 806340111 NXJXXDDUIDFQHU-LJQANCHMSA-N 430.549 2.345 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccn(CCc2ccncc2)n1 807386781 IYWIDACNNQNCEY-UHFFFAOYSA-N 444.289 2.244 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3nc4cc(Cl)ccn4n3)cc2)C1 810246224 CAPFPQYJLZYSIY-AWEZNQCLSA-N 427.896 2.406 10 20 IECD NC(=O)Cc1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 813256893 XBJZLRANRYATPY-UHFFFAOYSA-N 443.415 2.328 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)C3CCN(S(N)(=O)=O)CC3)c2C)cc1 913214519 AJAOLIAIGYJTQO-UHFFFAOYSA-N 433.530 2.044 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(C)c1 918267613 WGEJBMUSHWBEQX-UHFFFAOYSA-N 425.485 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 920253991 DLKAAVYZZBIPBU-JHUUHBRDSA-N 448.567 2.415 10 20 IECD COc1cc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1OCCO 920871543 LHBMVQAWMSEANH-KRWDZBQOSA-N 429.517 2.463 10 20 IECD COc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1S(=O)(=O)N(C)C 920970070 HDMOUFOHAWPJKI-GOSISDBHSA-N 448.541 2.473 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC(=O)N(C)c4ccccc43)CC2)cc1 1328226786 SNSRXRUJPQRYLT-FQEVSTJZSA-N 437.496 2.037 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCSC3)C2)C1 1785478412 XYBDYNQLIRZTJU-ZUOKHONESA-N 440.949 2.338 10 20 IECD CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1795760587 VRQDFCIMOFWRPU-XMTFNYHQSA-N 447.532 2.192 10 20 IECD Cc1cc(F)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1800367531 BTHPMXMZTLUAKG-MUJYYYPQSA-N 435.546 2.246 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808470218 UJBJGJBFJXTKHC-UTKZUKDTSA-N 449.486 2.382 10 20 IECD O=C(CSc1nnnn1C[C@@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 16409601 HGUWWLLYZMWWQG-ZDUSSCGKSA-N 449.492 2.358 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCc3cccc(C(=O)NC)c3)cc2F)CC1 303909506 UGKGJNSFVMDQMF-UHFFFAOYSA-N 441.551 2.369 10 20 IECD COc1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 732816352 VRIHWRMVUMRZSQ-UHFFFAOYSA-N 444.962 2.062 10 20 IECD COc1ccc(O)c(CNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c1 734065953 GUOHQAOZMOOCJD-LJQANCHMSA-N 443.500 2.074 10 20 IECD Cc1ccc2c(c1)c(=O)n(C)c1nnc(CN(C)Cc3ccc(N4CCOCC4)cc3)n21 738300237 VFRUNGZLTBOHKQ-UHFFFAOYSA-N 432.528 2.358 10 20 IECD COc1ccccc1-n1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cn1 742283936 XOGAOCXLNNBAOQ-UHFFFAOYSA-N 428.514 2.196 10 20 IECD COc1cccc(CNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1O 745830764 CWYACPGXAQZYKZ-UHFFFAOYSA-N 433.530 2.194 10 20 IECD O=C(NCCN1C(=O)CSC1=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 749702521 MZXJMPFEKOZLCX-UHFFFAOYSA-N 446.451 2.037 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNS(=O)(=O)c2cccs2)cc1 751407005 SSTMCLUYUPDGBJ-GOSISDBHSA-N 437.587 2.300 10 20 IECD COC(=O)[C@H]1COCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 752346956 MKRHLCGYJCDHQQ-JFBXQDQPSA-N 440.568 2.130 10 20 IECD O=C(COC(=O)C(F)(F)C1(O)CCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 753420338 ZSPPUOFQRXEKCA-UHFFFAOYSA-N 429.375 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(CCN(C)C)cc3)CC2)cc1F 754210877 BHKQZZRNKVWFED-UHFFFAOYSA-N 428.508 2.226 10 20 IECD COc1ccccc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759410972 AGVLUDJKXLKNQL-UHFFFAOYSA-N 429.473 2.008 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 768892497 QTNMSWSZQFATAM-UHFFFAOYSA-N 443.503 2.193 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4c5c(nn4C)CCCC5)n3)CC2)cc1 771083174 OOVSMEJXEOKMTR-UHFFFAOYSA-N 436.516 2.249 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc(N(C)C)cc1 773849612 WRDUPKGPQITUEN-OAHLLOKOSA-N 439.516 2.038 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCN(Cc2ccccc2)CC1 774957286 XGBINXQIBSRHAD-UHFFFAOYSA-N 438.572 2.065 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CCO)C3CCCCC3)CC2)cc1 778376614 DAKLJFINTQBEKS-LEQVUBRHSA-N 429.561 2.348 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(-c2cc[nH]n2)cc1 780046903 IRBWCJINJNLIMG-UHFFFAOYSA-N 437.475 2.432 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1 785295078 QQBYWYUDOQKVLC-LLVKDONJSA-N 449.389 2.383 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCC(C)(C)C3)CC2)cc1 785530314 NSBNMRRCGUFWAZ-IBGZPJMESA-N 430.593 2.409 10 20 IECD CCOC(=O)[C@H](CC)N(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787678191 CPBQXUREZSSGKK-IWGBCORSSA-N 443.544 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)C(=O)NC4)cc2F)C[C@@H](C)O1 788792071 VEZUGZYZQOPYII-GASCZTMLSA-N 427.476 2.378 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 788930200 OXAQFYZZSJZFMR-UHFFFAOYSA-N 440.519 2.195 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3nc(C(C)(C)C)cs3)CC2)cc1 789405560 QMPZFLRJTCHVIG-UHFFFAOYSA-N 445.589 2.326 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 789813750 VEKXSFHGZIHIQX-LJQANCHMSA-N 445.466 2.098 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]1c1cccnc1 789844431 SCFGMNPXFHUJFV-HXUWFJFHSA-N 426.492 2.162 10 20 IECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854817 DWSDARQHCOXEBL-PMERELPUSA-N 445.610 2.252 10 20 IECD CCC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789950843 RCZPNCRPQVSDJX-QGZVFWFLSA-N 443.466 2.186 10 20 IECD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800048582 FPBILLWWVIKKRE-FOIQADDNSA-N 434.968 2.320 10 20 IECD COc1ccc(COCCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 804038671 AJIMLLWHSJYXQT-UHFFFAOYSA-N 441.528 2.076 10 20 IECD COCCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 804901050 PAAASWOMODVXKS-FUHWJXTLSA-N 436.984 2.029 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3C[C@@H](OC(C)C)C3(C)C)cc2F)CC1 805010026 RTAPOTSHWYROTC-NHCUHLMSSA-N 448.583 2.292 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(c2nnc3ccccn23)CC1 807288584 XYIVNTHZEULDRN-UHFFFAOYSA-N 430.512 2.128 10 20 IECD C[C@H](O)C[C@@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769738 VKWWDUGGEYHHSN-UXLLHSPISA-N 425.476 2.135 10 20 IECD O=C(CN1CCO[C@@H](c2ccc(F)cc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 917048474 CPVBANONLQEUGN-JOCHJYFZSA-N 431.483 2.491 10 20 IECD C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919380484 UWSUAJZOTOTDRN-GFCCVEGCSA-N 448.391 2.137 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1n[nH]c2c1CCCC2 919761427 AJCOBJWRROGBKS-UHFFFAOYSA-N 435.507 2.474 10 20 IECD O=C(Nc1cccnc1N1CCOCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 919797143 VYDIRHQLNAGYIY-UHFFFAOYSA-N 436.468 2.384 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1N(C)C(=O)C1CC1 1324121861 WMLUVQIOAGOVJS-KRWDZBQOSA-N 426.469 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCc3nc(C)cs3)CC2)cc1 1337366266 WRVFBEJVNVOSDA-KTKRTIGZSA-N 428.558 2.414 10 20 IECD CO/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1779237740 QECHPQYHYBQVGJ-QQCGKZLYSA-N 438.908 2.429 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CNC(=O)O2)cc1 1793650582 AETQWWYIZQCDON-NRDMVMEKSA-N 436.512 2.454 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc(C)c1C(=O)O 1796604101 GTTLDBYXSQBJNQ-BJWYYQGGSA-N 439.468 2.373 10 20 IECD CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1O 1796604230 SOWQMHNTMIKISV-QDMKHBRRSA-N 427.457 2.163 10 20 IECD O=C(c1ncc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715140 NBHYLWNAMAVAJL-FQEVSTJZSA-N 448.527 2.436 10 20 IECD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc(Cl)cc1[N+](=O)[O-] 1845499227 UGHGEYDSCGSSSZ-UHFFFAOYSA-N 446.847 2.494 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)[C@@H]4CCCN4C)CC3)ccc21 483930829 XFONYWSZDDLTDG-QFIPXVFZSA-N 426.561 2.283 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1=O 729628702 XTVYLYXXBLDHAD-SYYKKAFVSA-N 428.577 2.033 10 20 IECD COC(=O)c1ccc2c(c1)CN(C(=O)NCCN1CCN(c3ccc(OC)cc3)CC1)C2 730123802 WCHRAZOWOFEDOQ-UHFFFAOYSA-N 438.528 2.329 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)N4CCCC4)CC3)cc2F)CC1 730133453 SSBMIPVEFFHYHU-UHFFFAOYSA-N 446.571 2.011 10 20 IECD CN(CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)C1=NS(=O)(=O)c2ccccc21 751306725 YCHUCLKDGUAZTB-UHFFFAOYSA-N 446.492 2.416 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 752014709 MBJFETZNDZBGRD-UHFFFAOYSA-N 449.515 2.397 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC[C@@]2(CCOC2)C1 757423531 DYNYHTPTPSZUPA-HXUWFJFHSA-N 447.469 2.354 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)c1 759592827 AKZOCXFMZKIPGC-BIPYJSMBSA-N 443.408 2.255 10 20 IECD CS(=O)(=O)CCn1cccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)c1=O 760794899 MWKYEVNFCQWBFL-UHFFFAOYSA-N 445.497 2.426 10 20 IECD CN(C)c1noc(CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 776626364 ASLJYMWEHVWFQA-UHFFFAOYSA-N 427.427 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@H](CCO)c3ccccc3)CC2)cc1 778389924 KKXSVYQZMZSEIF-WHIOSMTNSA-N 437.540 2.482 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3c(C)nn(C)c3OC)ccc21 778835675 KDDCUDLMGWFRQX-UHFFFAOYSA-N 434.518 2.074 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ncn(C)c2=O)c(C)n1-c1cccc(Br)c1 781266538 RDDBJACFHANJBL-UHFFFAOYSA-N 447.289 2.178 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(-n2nccn2)nc1 785194794 KWJFZZYTMBSLAW-UHFFFAOYSA-N 445.277 2.118 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C[C@H](C)O1 785864091 AFIMVUITDBCKLR-ROUUACIJSA-N 430.593 2.248 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCN2CCc3ccccc3C2)cc1F 787622106 JXMAAZTXQPEOQA-UHFFFAOYSA-N 426.536 2.463 10 20 IECD CCc1ccc(CNC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 788713149 ULQPJZGNZMMLTK-UHFFFAOYSA-N 447.557 2.301 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccnc(OC2CCOCC2)c1 788929864 LLEXFEHKZDZSRG-UHFFFAOYSA-N 438.528 2.172 10 20 IECD CC(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 789382324 LTKKULRVIJODQW-OAHLLOKOSA-N 429.546 2.223 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789819201 MLYFSMNSZLJSMP-JENIJYKNSA-N 434.556 2.046 10 20 IECD CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 789971198 VIAYAQSIIOANSC-WMZOPIPTSA-N 433.549 2.446 10 20 IECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2c(O)ccc(Cl)c2F)CC1 792156349 AZHCSTDJMAPYFT-UHFFFAOYSA-N 440.884 2.273 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(Oc4ccc(F)nc4)CC3)CC2)cc1 792386328 VPFJKHWHEHZSOX-UHFFFAOYSA-N 428.508 2.421 10 20 IECD CC(=O)N1CCC[C@@H](CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 797191764 XTONYKNFMVLBJC-AWEZNQCLSA-N 435.436 2.359 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 802188490 LFANBUQUUDRDHW-UHFFFAOYSA-N 449.577 2.291 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cc1F 803663991 DBLIHZVUXZUWGE-FQEVSTJZSA-N 426.492 2.162 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1 803686872 JFPKNRZFXCQJFG-UHFFFAOYSA-N 441.528 2.070 10 20 IECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687142 VRPUIZUXTPQIGS-GOSISDBHSA-N 435.572 2.422 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)cc1F 804852490 AZYUEIXWICZATJ-HKARXFIJSA-N 435.540 2.473 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)cc2)CC1 805024669 LDQSUBGDSSTCRJ-UXHICEINSA-N 428.577 2.302 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 805202148 GHQHOYLRJGFPFH-IBGZPJMESA-N 438.915 2.254 10 20 IECD O=C(NCCn1cc(Br)cn1)NCc1ccc(N2CCC(CO)CC2)cc1 805837960 IACCCQKSCCYDGK-UHFFFAOYSA-N 436.354 2.354 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]1C 807097119 LSBDLNHDMZAUAC-IAGOWNOFSA-N 432.565 2.439 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386906 PMZQKPUIQYZEFH-UHFFFAOYSA-N 441.303 2.122 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807675068 UHNWINAUIMIGCS-GCJKJVERSA-N 436.556 2.280 10 20 IECD CN(C[C@H]1CCCOC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769005 CUQFPJDNSVKISO-CVEARBPZSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@]4(O)CCc5ccccc5C4)n3)CC2)cc1 809465601 YEIJYLCOBOYXOK-VWLOTQADSA-N 448.523 2.346 10 20 IECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1ccccc1 918119196 YBIRBHWOGAMJIB-JTHBVZDNSA-N 437.588 2.360 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C(N)=O)cs3)cc2F)C[C@H](C)O1 920603047 VKAKHTWDOCTWLZ-STQMWFEESA-N 449.504 2.073 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C(=O)N3CCC[C@H](C(N)=O)C3)C(C)C)sc2n1 924232448 FKCVHJURYNNFTI-XJKSGUPXSA-N 432.546 2.401 10 20 IECD Cc1cnc(Cn2c(=CC(=O)C3CC3)sc(=Cc3ccc(N4CCCC4)cc3)c2=O)nc1 1323542293 ZXNZREKIAHHJQD-UHFFFAOYSA-N 446.576 2.245 10 20 IECD Cc1ncsc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805750357 DEOWUXQMTWJMBC-KSSFIOAISA-N 439.497 2.286 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC(O)C2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811796273 HAZULPNLNMMHBQ-QOOYBSBZSA-N 445.903 2.237 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1cc(O)nc(O)c1 1817844008 MUYHPFSPDIQAEJ-OAHLLOKOSA-N 426.408 2.370 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cnccn2)CC1 1832260484 VVRZJIMRPBGJLU-IBGZPJMESA-N 439.516 2.149 10 20 IECD O=C(/C=C/C1CC1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896884 SMALWKFUEWCNAD-LXXRFIIISA-N 435.615 2.433 10 20 IECD CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)c1cn(C)nc1-c1cccnc1)CCC2 606392879 JTKDQQOATYGXST-UHFFFAOYSA-N 425.514 2.325 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc([N+](=O)[O-])cc2c1OCCO2 727483331 FGDDNBZUHVXEAV-UHFFFAOYSA-N 431.420 2.396 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCc4c[nH]nc4C3)cc2F)C[C@@H](C)O1 745621879 IMDGNOYTUQJKOY-INMHGKMJSA-N 444.507 2.127 10 20 IECD CN1CCCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)CC1 747012231 NMTNEKYPZIFYJI-UHFFFAOYSA-N 427.524 2.289 10 20 IECD NS(=O)(=O)c1ccc(C(=O)NCCCSc2nccs2)cc1Br 749429080 GTGDLTCYBOHAAX-UHFFFAOYSA-N 436.378 2.465 10 20 IECD Cn1cnc2cc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 753460368 GVQKDMVBNIBEGP-UHFFFAOYSA-N 426.448 2.022 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCO[C@H]([C@H]2CCCO2)C1 757425496 MHJYULLDGIPZMF-SJORKVTESA-N 438.527 2.275 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCCC4(C3)OCCO4)CC2)cc1 768174544 GHSJXINYKCNTDT-IBGZPJMESA-N 432.565 2.192 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2F)CC1 769156813 UFEKBIQCARFRLO-PKTZIBPZSA-N 447.599 2.145 10 20 IECD CC(C)[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCCS1(=O)=O 772693624 FSYLFXAXHMIYKO-GOSISDBHSA-N 445.532 2.433 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(C(=O)OC)s1 773089729 UYOXUHICLPWUHH-LLVKDONJSA-N 426.516 2.427 10 20 IECD CN(C)C(=O)N1CCC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 774806866 TYGIOIBPPFNZAH-UHFFFAOYSA-N 441.555 2.178 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C12CCC2 778290567 XIMPUCVIFMWQNK-XMHHWPDXSA-N 427.545 2.364 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)nc(C(F)(F)F)n3)CC2)cc1 778387419 AIVJBPGHIIZYSB-UHFFFAOYSA-N 438.406 2.318 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F 784026090 BKUXJUNEGZNECU-UHFFFAOYSA-N 437.493 2.159 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1CN1CCSCC1 785296674 HNCLQYYUWNAJDL-OAHLLOKOSA-N 429.542 2.333 10 20 IECD CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1cccs1 786259489 QILUONRNMZNBLY-HXUWFJFHSA-N 428.558 2.300 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)[C@H]3C)nc12 786372088 SQEFYKCTCXNPSU-JSGCOSHPSA-N 448.476 2.300 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(-n2cccn2)c1 788319607 MIQQGMYDHSKSQN-GOSISDBHSA-N 433.512 2.203 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCNc3ccccn3)cc2F)C[C@@H](C)O1 788640564 BAXOCCQNYNFEIW-CALCHBBNSA-N 443.523 2.069 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822936 BRHJPUNGUFSREK-IAGOWNOFSA-N 445.539 2.157 10 20 IECD CC(C)[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793829987 PJEVESWFIQKGDN-KRWDZBQOSA-N 442.539 2.061 10 20 IECD C[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306351 SQBUNVSIBVWVEP-OALUTQOASA-N 425.529 2.110 10 20 IECD CNC(=O)CC1CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803679437 SQGGIMZSSCNFMY-UHFFFAOYSA-N 428.577 2.446 10 20 IECD C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686893 JMHYQMWSJFMQBM-SJLPKXTDSA-N 444.576 2.447 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC[C@H]3N3CCOCC3)cc2)CC1 805025412 PACGTKXVRROPED-DHIUTWEWSA-N 442.604 2.299 10 20 IECD O=C(CN1CC[C@@H](C(=O)N2CCCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805811308 OZJYYDHBYKOZGA-MRXNPFEDSA-N 431.492 2.345 10 20 IECD COCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 806957654 VKPRSMJYUIYLKG-UHFFFAOYSA-N 443.573 2.076 10 20 IECD COc1cc(OC)cc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)c1 807671969 VRSWMLXAGGLNFX-AEFFLSMTSA-N 440.544 2.342 10 20 IECD COC(=O)Cc1cccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 811678650 GGZJYZYMECRFCQ-UHFFFAOYSA-N 432.907 2.228 10 20 IECD C[C@H](COC1CCCC1)CS(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 814996329 XCLGYPGIQHTOKG-IEBWSBKVSA-N 437.606 2.403 10 20 IECD CCOC(=O)c1cnc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[nH]1 816535935 GLSFDSALALHKNV-UHFFFAOYSA-N 436.471 2.407 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCS(=O)(=O)Cc1ccccc1 916635062 BBRMDYBNDXLGFA-UHFFFAOYSA-N 431.558 2.280 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1nc(CN2CCOCC2)cs1 916670675 DJEQPRPLAUKZQT-UHFFFAOYSA-N 449.552 2.397 10 20 IECD CNC(=O)c1ccc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 917228093 XOYQUJFKMDWVHZ-HZPDHXFCSA-N 429.492 2.494 10 20 IECD CCC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917311223 TVUZHODKQCRIGO-UHFFFAOYSA-N 443.475 2.484 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(-n3nccn3)nc2)c(C)n1-c1ccccc1 918250638 SENIZEAALHUVCX-UHFFFAOYSA-N 429.484 2.367 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cc(OCC(F)F)ccn3)cc2)C1 1116507414 LIZOXTUOQYJNIC-INIZCTEOSA-N 447.486 2.427 10 20 IECD O=C(/C=C/c1ccoc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1793925043 PCCGZJMSUOVGSG-SGLKITHBSA-N 432.860 2.261 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cn[nH]c2)cc1 1796573224 HCGKUAKNDPFHID-VTYHHJSWSA-N 433.512 2.334 10 20 IECD CC(C)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C(C)C 1804285171 HHCMKGOZHWQIND-RDMZFHBCSA-N 445.560 2.477 10 20 IECD CC[C@@H](C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806081364 CHWJZGVBINYBJN-XUYSBGGMSA-N 446.544 2.455 10 20 IECD O=C1CC(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1811813588 SLBIYHNYOPSFCV-ORAYPTAESA-N 443.887 2.445 10 20 IECD CC(C)(C)c1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)[nH]n1 1844477380 RXVILAPGRPWMMO-SOFGYWHQSA-N 440.500 2.354 10 20 IECD Cn1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(C(F)F)n1 1847038511 BZKZEAZRUDFLSC-GQCTYLIASA-N 448.426 2.005 10 20 IECD COc1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(F)F 727177497 KUMNBVVQBMAKAK-FLIBITNWSA-N 438.499 2.047 10 20 IECD CCCOc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1 728015576 SKYZLPBNFSPSJI-UHFFFAOYSA-N 428.488 2.346 10 20 IECD CN(CCCO)C1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 734487896 YUOSPVKSLNCBTR-UHFFFAOYSA-N 435.524 2.179 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc(N4CCOC4=O)cc3)c2)CC1 741136139 GBYLCABQHDHPLW-UHFFFAOYSA-N 444.513 2.146 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H](O)COCC1CC1 749009604 GOMYIADGWXRHMW-QGZVFWFLSA-N 431.455 2.129 10 20 IECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 751227696 JWDKZWDIJWGWEA-UHFFFAOYSA-N 436.505 2.360 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(c4nc[nH]n4)CC3)cc2F)C[C@H](C)O1 751500321 ZGGIFKIOLKMARK-HOTGVXAUSA-N 430.528 2.053 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@@]3(C)CCC(=O)N3)cc2F)C[C@@H](C)O1 751523345 XOBQLKFBDUWMAF-VBURHUQHSA-N 449.523 2.048 10 20 IECD C[C@@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCCO1 755860934 YSPKTUWSENJHIY-IBGZPJMESA-N 435.458 2.400 10 20 IECD COCc1cccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759410282 QYJBSPBUSMPERU-UHFFFAOYSA-N 443.500 2.146 10 20 IECD COC(=O)c1sc(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c(C(=O)OC)c1C 759588095 ICMZRQOUNSZWCX-ALCCZGGFSA-N 449.437 2.236 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)cc1 760793268 BRLHHRCITKMBOR-UHFFFAOYSA-N 434.562 2.403 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4c(C)noc4C)n3)CC2)cc1 771054413 AJGQPENWXBILGC-UHFFFAOYSA-N 425.489 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc5c(cc4O)OCO5)n3)CC2)cc1 771083168 OKIOKHBJKWLAMI-UHFFFAOYSA-N 438.440 2.071 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3ccccc3Cl)CC2)cc(OC)c1OC 774552116 VVOIMDDWSKVIPP-UHFFFAOYSA-N 447.919 2.331 10 20 IECD COC(=O)Cc1cccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 777442363 DFJZZCYCNZPPCX-UHFFFAOYSA-N 425.529 2.353 10 20 IECD O=S(=O)(NC1CCCC1)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 781919556 DETMKTNUUQWSNL-LJQANCHMSA-N 425.570 2.489 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 785560777 PHNWHVYLZFRRBV-DEOSSOPVSA-N 448.567 2.177 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cn2cc(Cl)ccc2n1 786506933 QFBIQLAUMPXSPU-UHFFFAOYSA-N 443.960 2.474 10 20 IECD C[C@]1(c2ccc(F)cc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313408 SXTRCDRKGQZVDZ-DEOSSOPVSA-N 425.504 2.469 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1 788937915 OSQFTROKCWGZBN-PMACEKPBSA-N 443.569 2.316 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cc2F)C[C@@H](C)O1 789824575 JIIJRYVEXCVNJJ-MYJBXWICSA-N 433.524 2.129 10 20 IECD CN(CCOC(C)(C)C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949839 KXZFDKMOPVABSU-UHFFFAOYSA-N 445.482 2.432 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cn1cccn1 790218463 YMZLUGCWQIAXHP-CVEARBPZSA-N 435.475 2.022 10 20 IECD C[C@@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1C 793731887 GEEZJHCWCFKZRF-LFGUQSLTSA-N 428.577 2.193 10 20 IECD C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 793908583 KADQLFSDSLLHIY-RTBURBONSA-N 430.593 2.327 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c(F)cc1C 795290022 MBOBXSLGOWJZEH-UHFFFAOYSA-N 430.479 2.483 10 20 IECD CC(=O)N[C@@](C)(C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 797707009 IDJWPNBSPZIPOP-HSZRJFAPSA-N 443.569 2.358 10 20 IECD COCCn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802397296 QCZCHJIYHZKNNF-UHFFFAOYSA-N 439.564 2.259 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1 802610224 WEIOINKGVYLQFW-QGZVFWFLSA-N 448.545 2.024 10 20 IECD CN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1)C(=O)OC(C)(C)C 803659530 RGAPRHGJUNZUSG-INIZCTEOSA-N 436.528 2.223 10 20 IECD CCCN(C[C@@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805006998 CDNAYHYCYNCSKC-FQEVSTJZSA-N 448.583 2.392 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(OC)c(O)c3)CC2)cc1 916196481 IKRRUPOKDIKYJT-UHFFFAOYSA-N 428.533 2.421 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 919815975 WDWUQDKCEORMLY-MRXNPFEDSA-N 433.486 2.360 10 20 IECD O=C(COC(=O)[C@@H]1COc2ccc(F)cc2C1)NCc1ccc(N2CCOCC2)c(F)c1 1116405251 PTMGNHIGDLZQIE-KRWDZBQOSA-N 446.450 2.212 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccnn3C[C@@H]3CCOC3)CC2)cc1 1116654285 CSMLZMPOYJBEBD-IBGZPJMESA-N 442.564 2.262 10 20 IECD O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1317963643 ISRXRJYRVZXCDY-UHFFFAOYSA-N 427.398 2.284 10 20 IECD CCc1oncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004403 CMNQARCLODFZTB-HXUWFJFHSA-N 435.864 2.059 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c[nH]3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246066 IQSFGXMEFRPRLD-SVKFGRERSA-N 437.855 2.126 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(F)(F)CC1 1793347760 VASBXTZEEHNXAQ-BTTYYORXSA-N 445.557 2.310 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cn[nH]c2cn1 1798262557 KIMUJJGRTAOJHX-KOTZLPFRSA-N 449.467 2.040 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3c(F)cncc3F)CC2)C1 1810546637 KLOJKIOQXMXTMD-UHFFFAOYSA-N 432.427 2.325 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccc4nccn34)CC2)C1 1810554692 VBYALJMVACGZEO-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CC[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714957 KIAQUQVFMLABGH-LEWJYISDSA-N 440.544 2.170 10 20 IECD CN(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877311 FAOZBRNTNPXAHX-XSBJJCPUSA-N 445.560 2.388 10 20 IECD C[C@@H](CN)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877629 VSSMJMSGQOOALV-WHFNLZNOSA-N 431.533 2.031 10 20 IECD Cc1ccncc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1848208816 ZIGUVPPUIYCQRN-VXKWHMMOSA-N 445.523 2.317 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4cc(C)no4)CC3)cc2F)CC1 730132315 BNFWWLBHHQYVRI-UHFFFAOYSA-N 444.555 2.291 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3ccccc3OC)cc2F)CC1 730292202 WTKMTBAJCGEURT-UHFFFAOYSA-N 428.508 2.022 10 20 IECD COc1ccc(N2CCN(CCNc3nc(N)c4cc(OC)c(OC)cc4n3)CC2)cc1 731998551 YYGPBVNHAPCNEL-UHFFFAOYSA-N 438.532 2.472 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C3)nc12 733201906 PHGKHHOQTOOYDR-KBPBESRZSA-N 433.509 2.441 10 20 IECD COCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 737757498 ZMZJMOJSXCRYKV-UHFFFAOYSA-N 442.515 2.037 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCNc3ccc([N+](=O)[O-])cc3)CC2)cc1 742948590 ZWFONIUGDBGBOM-UHFFFAOYSA-N 442.520 2.137 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(CS(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 749404318 JJIXDYLGRPZZSB-HUUCEWRRSA-N 435.521 2.158 10 20 IECD Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 749626135 PBNXHMPDJKEICG-UHFFFAOYSA-N 437.475 2.318 10 20 IECD CCN(CC)c1ccc(CNC(=O)NC[C@@H](O)CS(=O)(=O)c2cccs2)cc1F 752170514 IUDDLEOKRNGNEI-OAHLLOKOSA-N 443.566 2.367 10 20 IECD CC[C@H](C)c1nc([C@H](C)NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)n[nH]1 754709536 KTJYDCZSEJSRKG-YOIRJEGESA-N 440.548 2.409 10 20 IECD Cc1nn(C)c(C)c1OCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 758985943 FTKNFQJSSPAHNJ-UHFFFAOYSA-N 447.447 2.373 10 20 IECD COc1ccc(CN2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2=O)cc1 767932418 UMEXAXUKVBIRCO-UHFFFAOYSA-N 438.572 2.454 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 768207305 BMJZSIYRMVAWCV-UHFFFAOYSA-N 430.870 2.065 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccccc3-n3ccnc3)CC2)cc1 778418522 GBFDIOCSIRMHSN-KHPPLWFESA-N 445.523 2.402 10 20 IECD Cc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cccc1C(=O)N1CCCC1 785297390 NWEGKRLQXNPZDE-CQSZACIVSA-N 425.485 2.328 10 20 IECD CCC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)N1CCc2sccc2C1 785421080 AMNXJXUEENKQJR-IBGZPJMESA-N 442.585 2.300 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 786751806 JNTYPVRFJBABPK-UHFFFAOYSA-N 442.493 2.234 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)c1 787614435 VADUNLZWMLMMTD-CVDCTZTESA-N 438.572 2.428 10 20 IECD CCN(CCCN1CCCC1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819447 MYZBPBXABBUFKY-KDURUIRLSA-N 448.583 2.390 10 20 IECD CCc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789825584 MYHCCJWDQXSCIQ-HZPDHXFCSA-N 428.508 2.329 10 20 IECD CC(C)(C)OC(=O)N[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 793628419 CPRVAQUICQKILK-LJQANCHMSA-N 428.533 2.099 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)CC2)cc1 793723341 WOCJUWGKPWNOCX-QHCPKHFHSA-N 438.572 2.461 10 20 IECD Cc1noc([C@@H]2CCCN2CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1 796692262 ARQHPYGFPPDPBY-IBGZPJMESA-N 443.529 2.453 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3c(F)c(F)cc(F)c3F)cc2)C1 800901182 PKJRVXJVSCYIRW-GFCCVEGCSA-N 445.438 2.423 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc(F)c(OC)c4)CC3)nc12 801964673 FNJCJVXGMCQDIU-UHFFFAOYSA-N 429.452 2.082 10 20 IECD COc1cccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803687910 RCIZYKDHELUUET-FQEVSTJZSA-N 436.556 2.479 10 20 IECD CC[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 805636267 MHSOQTAMKAHXAY-SFHVURJKSA-N 448.583 2.295 10 20 IECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)[C@@H]1CN(Cc2ccccc2)CCO1 806282261 JGPLRDBMAQEMTO-WMZOPIPTSA-N 448.614 2.147 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769827 ISACZDUXYFHMGD-KRWDZBQOSA-N 449.502 2.427 10 20 IECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(N2CCCNC2=O)cc1 812762899 DFILADBYXCGMGC-ZDUSSCGKSA-N 432.502 2.174 10 20 IECD Cc1cc(C(=O)O[C@@H](C(=O)N2CCC[C@@H](C(N)=O)C2)C(C)C)c(C)n1-c1ccccn1 914903373 LTARHHUQPPJHJY-YLJYHZDGSA-N 426.517 2.394 10 20 IECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1ccccc1 918119194 YBIRBHWOGAMJIB-GMAHTHKFSA-N 437.588 2.360 10 20 IECD COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1353860820 IRRGJMSDWIOOSP-SFHVURJKSA-N 438.933 2.089 10 20 IECD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)nn1 1788426948 IPCBBOMGWXLFLQ-UHFFFAOYSA-N 435.440 2.353 10 20 IECD CC(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831400735 CEOCYGQMVVFFMS-QGZVFWFLSA-N 437.924 2.121 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C23CC(C2)C3)CC1 1832899912 NUBQZHDYQFSTHE-JERHATOGSA-N 435.615 2.267 10 20 IECD O=C([C@@H]1CC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902060 IRTKZEBBQJAOJA-KBPBESRZSA-N 445.557 2.122 10 20 IECD COc1ncc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1C 1847039110 MPOFWULFMAEPCZ-FNORWQNLSA-N 439.468 2.046 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc(SC)ncc3Cl)CC2)cc1 21582568 NHGVPALDRPSTDM-UHFFFAOYSA-N 436.921 2.366 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(CC(=O)Nc3ccccc3Cl)CC2)cc1 23301663 SJEJYHPBXGALJX-UHFFFAOYSA-N 443.979 2.279 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)c(F)cc3F)cc2)C1 729784338 IONKOTQBWHZXQQ-ZDUSSCGKSA-N 434.418 2.061 10 20 IECD CC(=O)NCc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 733662208 UDLUFVSYDGFDHG-HXUWFJFHSA-N 425.485 2.175 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1C 745937199 FSCAIXUTIUMAEL-OKILXGFUSA-N 439.509 2.043 10 20 IECD O=C(Cn1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1)NC1CCCCC1 746588762 DOKANNJSPUKPHG-UHFFFAOYSA-N 443.523 2.238 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C(C)(C)CO)CC1 747840958 WAWUYULBPYMIGM-MRXNPFEDSA-N 435.524 2.178 10 20 IECD CCN1CCO[C@H](C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 748457180 GXARVKSBFPRKNV-LIRRHRJNSA-N 436.464 2.053 10 20 IECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749556142 XECIKFAQXJIOHM-FZYZMVIOSA-N 442.585 2.467 10 20 IECD CCC(CC)[C@@H](C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1)N1CCOCC1 750511314 FFDKZBAEHGLKJC-QHCPKHFHSA-N 447.576 2.024 10 20 IECD NC(=O)c1cccc(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 751060704 OESNPYYOQMUPSX-UHFFFAOYSA-N 445.522 2.326 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](OCC(F)(F)F)C3)CC2)cc1 754043142 PVXGDTAVVYGRNV-QUCCMNQESA-N 431.499 2.221 10 20 IECD COc1cc(N2CCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC2)cc(OC)c1OC 759261946 QWSHMXQSYDJRPY-GDLZYMKVSA-N 427.567 2.091 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCS(=O)(=O)C1 764215774 LABILZSPLFLYCK-AWEZNQCLSA-N 449.495 2.118 10 20 IECD COc1cc(N2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c([N+](=O)[O-])cc1OC 767310098 VMYWOHLYCFAFMH-UHFFFAOYSA-N 436.490 2.310 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(NC(C)=O)c(F)c3)CC2)cc1 769005986 FJTLLDFEMOPDIF-UHFFFAOYSA-N 429.448 2.298 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)Cc3cccnc3)cc2F)C[C@H](C)O1 771663829 BIKIBQPOWJDRGY-HOTGVXAUSA-N 429.496 2.192 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1OC 773994836 PAMMMBWQLAYXNR-HNNXBMFYSA-N 435.546 2.316 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN3CCc4ccccc4C3)CC2)cc1 778236076 MOEYNQDDFOLNDZ-ZHACJKMWSA-N 448.567 2.075 10 20 IECD Cc1noc(C2(C)CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)n1 781367658 FMRNVGCOPLIIBT-GOSISDBHSA-N 440.548 2.343 10 20 IECD COc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(OC)c1 786666863 QDYCSSUTFMAYRA-IBGZPJMESA-N 428.485 2.233 10 20 IECD O=C(NC1CCN(C2CCCC2)CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787194246 XIUIRXRPAKJNOD-NRFANRHFSA-N 429.561 2.423 10 20 IECD Cc1nccn1CCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787654831 PSMMGCFAPSXYGK-MRXNPFEDSA-N 435.475 2.084 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCc3c(C)nc(C)nc3O)CC2)cc1 787901080 GHPBAJXLKBFVCH-UHFFFAOYSA-N 427.549 2.069 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCN3[C@H](C)CCC[C@H]3C)cc2F)C[C@@H](C)O1 789823007 XTTNBAONVXDRSO-NCXUSEDFSA-N 448.583 2.435 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(N2CCOCC2)cc1 803301584 UIMPPULMYVDELQ-ZXNZYJFHSA-N 427.545 2.164 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)c1ccc(N2CCOCC2)cc1 803308821 KTENLMYTSWJMCI-HTAPYJJXSA-N 441.503 2.440 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Oc3ccc(C=O)cc3)CC2)cc1 803961546 DPOQZDKXXRNDJU-KRWDZBQOSA-N 426.469 2.167 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C(F)(F)F)[C@@H](CO)C3)CC2)cc1 806620320 SFVSTHIKFKGZLR-APWZRJJASA-N 444.498 2.020 10 20 IECD CCN(CC)[C@@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771227 TXMONZRJSICIIK-SJLPKXTDSA-N 438.519 2.316 10 20 IECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 810318418 ZHJMZBAIUHRHTJ-UHFFFAOYSA-N 437.949 2.412 10 20 IECD Cc1cc(C(=O)COC(=O)CCNS(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 914649781 VYWKQUJZFFQUDL-UHFFFAOYSA-N 444.456 2.361 10 20 IECD CN1CC(=O)N(c2cccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)C1=O 916688628 CMRIDULNGOPDJX-UHFFFAOYSA-N 441.463 2.382 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)cc2)C1 919754310 PIBMSMZFJJWTHS-LAUBAEHRSA-N 438.503 2.197 10 20 IECD Cc1ccc(C)n1-c1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnn1C 919849687 BCAZDPLWCFUUPO-IBGZPJMESA-N 434.544 2.459 10 20 IECD O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968342 FHMDZOAIVMGEMF-SFTDATJTSA-N 427.545 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4cccn4)nc3)CC2)cc1 920255223 QDCOITRXVYSZGM-KTKRTIGZSA-N 432.484 2.119 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1ccccc1)N1CCCCC1=O 1323860037 OFLUGAHGESYTLJ-AVRDEDQJSA-N 440.496 2.442 10 20 IECD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)ccn1 1782007262 NVNIIJPPYXEVLI-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(CC1CCOCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285807 URLNYHVGBHPILK-YBXVHQAYSA-N 430.501 2.272 10 20 IECD CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n[nH]1 1817703018 PLTVIFJXVMEWLG-OAHLLOKOSA-N 425.449 2.121 10 20 IECD Cc1nn(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825628623 CYPFNLADEQIQMG-INIZCTEOSA-N 445.495 2.221 10 20 IECD CC(C)N[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)C(C)C 1842998286 ZFLRTYADZDDAMM-NRFANRHFSA-N 439.560 2.005 10 20 IECD Cc1cccnc1CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034044 XGKVYNCBEUTFHT-RMKNXTFCSA-N 437.496 2.356 10 20 IECD CCOC(=O)N(C)C1CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 726980836 ZYYTYQZXUSLURI-UHFFFAOYSA-N 447.580 2.080 10 20 IECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(S(=O)(=O)N(C)C)cc3)cs2)cn1 727248116 DZICPMJHZUYAGB-UHFFFAOYSA-N 441.560 2.078 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CN(C)C(=O)OC(C)(C)C)C3)nc12 729474784 NGKKGWWAZTXOHF-AWEZNQCLSA-N 433.509 2.300 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C3)nc12 733201907 PHGKHHOQTOOYDR-OKILXGFUSA-N 433.509 2.441 10 20 IECD Cc1nn(C(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 734491875 ROASVTKICXZWAQ-SFHVURJKSA-N 433.578 2.261 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 735191734 QPWKEUVVUKISFV-SSEXGKCCSA-N 431.558 2.245 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Oc3cccc(C(N)=O)c3)nc2)c1 743331271 OEBYGMYVJOWEFZ-UHFFFAOYSA-N 442.453 2.302 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(Cl)cc3F)CC2)cc1 743442810 ZTWWEUIVLPNCIK-UHFFFAOYSA-N 434.899 2.365 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c(OC)c1 743914390 SUGCKYBMKCKIAL-UHFFFAOYSA-N 429.473 2.120 10 20 IECD CC(C)[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCC[C@@H](C(N)=O)C1 751931875 UUBPZVPJILEGIE-BEFAXECRSA-N 444.557 2.221 10 20 IECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1cccc(OC)c1O 752396903 SSOCSXNEMLIKIA-UHFFFAOYSA-N 426.878 2.103 10 20 IECD COc1ccc(N2C(=O)C[C@H](N3CCN(c4ccc(OC)c(F)c4)CC3)C2=O)c(OC)c1 753978955 ZDJUOROGEQCSDS-IBGZPJMESA-N 443.475 2.306 10 20 IECD C[C@@H]1COCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 754581606 SSNPAOLZKMEHKO-KRWDZBQOSA-N 428.512 2.120 10 20 IECD COc1cc(N2CCN(C(=O)NCCc3cn4c(n3)SCC4)CC2)cc(OC)c1OC 767949540 ROYUZSPCDCQYDQ-UHFFFAOYSA-N 447.561 2.089 10 20 IECD CCS(=O)(=O)C1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 770033681 AYPYGJBSZQPCTF-UHFFFAOYSA-N 440.521 2.300 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 776492834 WJCIUYBSOCOALT-AWEZNQCLSA-N 431.514 2.496 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 777826572 OFCYZMSLMCPUPC-OAHLLOKOSA-N 444.871 2.066 10 20 IECD COC[C@H](C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 778528689 GSQLGFLJXINGDX-ARFHVFGLSA-N 447.511 2.098 10 20 IECD Cc1cc(C(=O)[C@H](C)OC(=O)Cn2ncn(C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 779128292 KYUQVRGXJXZEGA-AWEZNQCLSA-N 448.426 2.405 10 20 IECD Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 785492627 DLJIMVCFHVQLMM-UHFFFAOYSA-N 447.539 2.258 10 20 IECD Cc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(-n2cc(Cl)cn2)n1 787442146 TYKXRVXCEJZQAD-UHFFFAOYSA-N 435.893 2.236 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 787685264 DEYMXFAOLRHYML-LJQANCHMSA-N 436.556 2.269 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 788932882 QUNIXGVUOXKSRF-KRWDZBQOSA-N 427.936 2.347 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)CN3CCCCC3)cc2F)C[C@@H](C)O1 789828277 WUQWRKBCOOBHKS-QRVBRYPASA-N 448.583 2.294 10 20 IECD CN(C)CCN(Cc1ccccc1F)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687019 TWALUSRZVVTMMJ-UHFFFAOYSA-N 426.536 2.415 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1)[C@@H](C)CS(=O)(=O)CC 805025810 UYMVUZCKFFEEKZ-SFHVURJKSA-N 437.606 2.211 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1Cl 807386869 NOYOFDQYUFEICG-UHFFFAOYSA-N 440.681 2.423 10 20 IECD Cn1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc(Br)c1=O 807513048 QXOUOCJLHSXIAG-UHFFFAOYSA-N 449.088 2.415 10 20 IECD CCC1(O)CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 809319876 BOEBXVOVAJKEGJ-FTIOSWPQSA-N 435.540 2.255 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)CCCOCc3ccccc3)cc2)CC1 809836903 ZSTYRTUDADFLOA-UHFFFAOYSA-N 445.585 2.381 10 20 IECD O=C(N[C@@H]1COc2ccccc2[C@@H]1O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 811573972 SDUZRPGJYWKZHP-BEFAXECRSA-N 446.506 2.479 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ncccn3)cc2F)C[C@H](C)O1 812603521 XZSKZWQJWVGJLJ-HOTGVXAUSA-N 430.480 2.022 10 20 IECD CCN1C[C@@H](C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914912240 VDRCMASIYFPGLY-KGLIPLIRSA-N 434.448 2.201 10 20 IECD CCOC(=O)N[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 916196563 MEONVWYWHRGYCD-IBGZPJMESA-N 447.580 2.127 10 20 IECD CCOC(=O)c1c(NC(=O)COC(=O)CS(C)(=O)=O)sc(C)c1-c1ccccc1 920596227 QWOKDPOQPNXPBU-UHFFFAOYSA-N 439.511 2.427 10 20 IECD Cc1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1780584046 RHYUAQYUVYHJRX-RXVLNYDTSA-N 438.480 2.269 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)cn1 1785942342 GSVMZOCDOFJFLE-QOKNQOGYSA-N 445.903 2.362 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)s1 1787290668 ZETXLZTYCYEEHS-WBAXXEDZSA-N 445.541 2.089 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@H]3C3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243086 QLYIUWKNFPQCPZ-RWBKLUSOSA-N 434.920 2.391 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2)c1cc(O)nc(O)c1 1793709294 NOHAHQZUUDGMMU-QNFZCTPRSA-N 425.407 2.477 10 20 IECD COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1819765163 BBZXCWMHXDNDFE-INIZCTEOSA-N 438.444 2.239 10 20 IECD Cn1nncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290591 BJOKCWZBOIBKEM-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD CCOCCN1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 729995192 RIHNDLXEVVYNDK-QGZVFWFLSA-N 435.524 2.443 10 20 IECD O=C(c1ccc(S(=O)(=O)NCCCSc2nccs2)cc1)N1CCOCC1 735315109 BKSPWHOIPGREQO-UHFFFAOYSA-N 427.573 2.076 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(S(=O)(=O)NC)cc3)cc2F)CC1 743162053 VXBIKPPWYIREBT-UHFFFAOYSA-N 449.552 2.197 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(F)c3F)CC2)cc1 743369261 UJIQMBGTDFJELX-UHFFFAOYSA-N 432.471 2.240 10 20 IECD Cc1cc(C(=O)COC(=O)CCc2ccccn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 744885251 RSWUJPKSEGGWJD-UHFFFAOYSA-N 441.509 2.495 10 20 IECD CN1CCC(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 747990773 ZOGSFCYHNLCWRD-UHFFFAOYSA-N 433.572 2.020 10 20 IECD CN(C)CCCOC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 748963283 ZQKVUYOWVYEWMX-UHFFFAOYSA-N 436.572 2.429 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3ccc(F)c(Cl)c3)cc2)CC1 755945426 SFBXEPXMUJQKKI-UHFFFAOYSA-N 446.953 2.334 10 20 IECD CC(C)(C)OC(=O)N1CCOC[C@H]1c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 758297375 WLPVKNKWXOGJBV-ZDUSSCGKSA-N 440.478 2.122 10 20 IECD COc1cc(N2CCN(C(=O)C[C@@H]3C(=O)Nc4ccccc43)CC2)cc(OC)c1OC 759220894 JXNFBSNJQAXTKQ-KRWDZBQOSA-N 425.485 2.487 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)COC4)CC2)cc(OC)c1OC 759411011 APUTUAGAXGHBQI-UHFFFAOYSA-N 441.484 2.030 10 20 IECD CCO[C@@H]1COCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760044844 DEYVTMFHUYFQBA-GDBMZVCRSA-N 426.516 2.178 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 760519562 LLNKULRNMNCMEF-UHFFFAOYSA-N 437.587 2.406 10 20 IECD COc1cc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)cc(OC)c1OC 760858073 OTYFHEJXBNOYLB-UHFFFAOYSA-N 443.909 2.088 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)cn1C 766742212 ABRPBFRGRXVIAM-UHFFFAOYSA-N 441.557 2.283 10 20 IECD COC(=O)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(C)c1 767884730 OHONLTKJWOVSSG-JOCHJYFZSA-N 447.482 2.230 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCc3cn4c(n3)SCC4)cc2F)CC1 767951193 XZXQXVNXXPHHLV-UHFFFAOYSA-N 432.569 2.312 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H](C)CO1 769674866 SDQUCXDNRDJDGP-OLZOCXBDSA-N 435.458 2.351 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCCNC(=O)C(C)(C)C)n3)CC2)cc1 771059148 XWFIVQKAZCQIMJ-UHFFFAOYSA-N 443.548 2.064 10 20 IECD CN(C)C1(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCCCC1 775221571 GKNCPUCFGWKBNE-UHFFFAOYSA-N 448.583 2.174 10 20 IECD CC(C)Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(O)n1 777139886 KVOCRMXXUOPJDB-UHFFFAOYSA-N 445.491 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3n[nH]c4ccc(OC)cc34)CC2)cc1 778406560 GAXNMBWNUHLTFS-MDZDMXLPSA-N 435.484 2.424 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OC(F)F)c1 785297376 NSPADBYOOUKPOL-JTQLQIEISA-N 438.383 2.172 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CC(c2c(F)cccc2F)=NO1 785897619 OYLAKTYGDKLDCD-IBGZPJMESA-N 449.479 2.009 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cn2cc(Cl)ccc2n1)c1ccc(N2CCOCC2)cc1 786502192 JVKGVZNOGQXPRS-HNNXBMFYSA-N 441.919 2.318 10 20 IECD CCc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 789827457 SVVXRWTVKLUGOZ-GASCZTMLSA-N 448.564 2.433 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Cc1cccs1 789833243 FSYWEKJGGLGOBQ-OAHLLOKOSA-N 433.549 2.460 10 20 IECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854717 CXCVGCANYOELCQ-HXUWFJFHSA-N 427.574 2.262 10 20 IECD COc1cncc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 791698005 ZUEKZLVIXSKPFT-GFCCVEGCSA-N 431.404 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(C(N)=O)ccc3N3CCCC3)CC2)cc1 797674688 PPCKPGRWJSGTST-UHFFFAOYSA-N 437.544 2.155 10 20 IECD Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 799254397 YMEXDLFAWSKMJB-UHFFFAOYSA-N 433.512 2.487 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CC(=O)N(CC(F)(F)F)C2)cc1)C1CCCCC1 803677903 VATPFNDUOAGPLB-UHFFFAOYSA-N 440.466 2.262 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C(C)C)C3)cc2F)CC1 805006899 JQCNZYWDCUYOMY-FQEVSTJZSA-N 436.597 2.184 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(CCN(C)C)C[C@H]3CCCO3)cc2)CC1 805025653 SLVYERPUSSZJAC-JOCHJYFZSA-N 430.593 2.108 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 806877895 DWMXOTWLFYDNRP-UHFFFAOYSA-N 443.523 2.427 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C 807195576 HTIJDJLBJLDDRY-FVQBIDKESA-N 425.323 2.433 10 20 IECD C[C@@]1(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCCS1 807775897 QQZPVFOXGKZGJV-QHCPKHFHSA-N 430.618 2.237 10 20 IECD CC(C)[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 808085459 MAWCDSZYHYRXMU-GMAHTHKFSA-N 442.604 2.155 10 20 IECD Cc1cc(C(=O)COC(=O)CCn2ncn(C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 815269308 SEGYDGKTSYPONV-UHFFFAOYSA-N 448.426 2.407 10 20 IECD Cc1ccc(-n2nnnc2SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917175288 SSRBUWAKSYZSHT-UHFFFAOYSA-N 442.520 2.355 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)CCN4C(C)=O)CC2)cc1 918462127 RRGBVFIUEUTERM-UHFFFAOYSA-N 436.512 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc(N(C)C)cc3)CC2)cc1 1116502897 GZHVHOQYYMFTNG-SEYXRHQNSA-N 436.556 2.325 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2 1782004849 OSBPOPBVFGKKPI-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)s1 1782005148 VTNMQDKRAMLNTO-LJQANCHMSA-N 437.905 2.273 10 20 IECD Cn1nncc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc(O)c(O)c3O)CCC2)cc1 1786986173 UPYKCQINLXJSGG-ONNFQVAWSA-N 449.467 2.393 10 20 IECD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C=CCN3)CCC2)cc1)C1=NN(c2ccccc2)C(=O)C1 1788672550 RFTZVJWDBYLYIR-FQEVSTJZSA-N 443.507 2.441 10 20 IECD CSCC[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791616275 LABBIQCPWJRTET-MRXNPFEDSA-N 431.514 2.355 10 20 IECD Cc1onc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1C 1793815553 MYPUDLQEXJLHLN-VBUUOAMHSA-N 435.484 2.336 10 20 IECD CCn1nc(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1796594468 DCZUKFJGZJRXON-GGPHIMKMSA-N 448.527 2.256 10 20 IECD COc1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)ccc1O 1843442693 USIFTQCRHILDFL-UHFFFAOYSA-N 448.479 2.011 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2(C(F)(F)F)CC2)C1 1843945234 LHDZQMJIRPDPJI-UHFFFAOYSA-N 434.418 2.325 10 20 IECD O=C(NC1CCN(C(=O)C2CC2)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060087 PVORYMVDYTTZIV-UHFFFAOYSA-N 449.554 2.385 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 751227114 FGOZIOGQLKZVFD-UHFFFAOYSA-N 426.466 2.035 10 20 IECD COC(=O)C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 752865519 LRLIKQORSZWDLP-INIZCTEOSA-N 445.438 2.016 10 20 IECD COc1ccc(N2CCN(C(=O)c3cccc(N4CCCS4(=O)=O)c3)CC2)cc1F 753740547 REZKOOBDECLBJI-UHFFFAOYSA-N 433.505 2.337 10 20 IECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1F 753976808 AXEPAUFRVIPZBR-GOSISDBHSA-N 428.420 2.197 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cc1F 756170243 PAHNUXMYBPTVPS-UHFFFAOYSA-N 440.450 2.496 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)c1 761981878 JHYQFPIEHITJKZ-MRXNPFEDSA-N 449.573 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3CN(C)C)CC2)cc1 778219392 CUFXVKINLASCRK-OUKQBFOZSA-N 436.556 2.278 10 20 IECD CCNC(=O)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778230418 CWUFNCKXTJTRSR-OUKQBFOZSA-N 436.512 2.288 10 20 IECD COC(=O)[C@H]1C[C@H](OC)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778239572 TZINUTUSMYHCGD-FOIQADDNSA-N 436.464 2.053 10 20 IECD CCCCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 789799517 IJYNAIOOSVYZOB-PMACEKPBSA-N 435.540 2.379 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)C1 793718811 KMQFUNSZVUWELE-CJFMBICVSA-N 438.572 2.353 10 20 IECD COc1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(O)c1 794377360 HQHJNUHNXFPCGK-UHFFFAOYSA-N 448.419 2.284 10 20 IECD CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC)cc2O)cc1 795362168 JATJKZOTPXBZMV-UHFFFAOYSA-N 428.532 2.421 10 20 IECD COc1ccc(N2CCN(C(=O)CN(CC(=O)N3CCCCCC3)C(C)C)CC2)cc1 796601796 MNCCICNEQDHLEA-UHFFFAOYSA-N 430.593 2.457 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1 801548118 NPPBBYGICBSZCE-QGZVFWFLSA-N 445.541 2.221 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 803135418 QKEZDPNRHLSMGD-INIZCTEOSA-N 448.570 2.175 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(Cc3ccccc3)C[C@H](C)O)CC2)cc1 804317321 ZRTANDPJXJCSFQ-SFHVURJKSA-N 425.529 2.190 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3c(C)noc3C)cc2F)CC1 805009321 HJOXYEUKBNIDRY-CQSZACIVSA-N 431.512 2.066 10 20 IECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)CC2 807292882 BCNZAIJKJPGJJB-WOJBJXKFSA-N 440.544 2.351 10 20 IECD CCNC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)C 817851654 GVYONQDNRCQJSG-INIZCTEOSA-N 425.532 2.145 10 20 IECD C[C@]1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCS(=O)(=O)C1 914406296 YSSZDSODBGGGTF-QFSNBGPKSA-N 444.625 2.423 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)c1cccc(S(N)(=O)=O)c1 916196673 CVAJFLCCVOAHRE-HNNXBMFYSA-N 434.587 2.448 10 20 IECD COCCn1c(=O)nc(O)c2c1nc(-c1cc(O)c(O)c(OC)c1)n2Cc1ccccc1 916856827 QDAFCEDNKWUXIU-UHFFFAOYSA-N 438.440 2.080 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccccc4)CC3)cc2)C1 918118660 VEIVISSSRUKMCN-QFIPXVFZSA-N 435.572 2.416 10 20 IECD O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NCc1ccc(N2CCOCC2)cc1 919766940 BONVDICLWCTMOM-UHFFFAOYSA-N 437.949 2.161 10 20 IECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCc1ccccc1F 920635706 KVSFRFSQDQLENO-SFHVURJKSA-N 438.477 2.401 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)NC(=O)c1ccc(Cl)cc1 1324120727 IVLVHHWUICHEAU-LRDDRELGSA-N 434.876 2.160 10 20 IECD CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126367 UAPDBYKPROVIHY-AUSIDOKSSA-N 426.517 2.093 10 20 IECD CN(C)c1cncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810543104 VRFOTJPWSRLKDP-UHFFFAOYSA-N 439.516 2.112 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(Cl)nc2)[nH]n1)c1cc(O)nc(O)c1 1817842759 NFZYHMWXAOCHDG-CYBMUJFWSA-N 443.851 2.279 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1C 727357814 RYKOUBMMLFSGAK-UHFFFAOYSA-N 432.549 2.281 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 728025161 YTEFSXSNNKQNDM-OJADOOIQSA-N 446.617 2.191 10 20 IECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)Cc1cnn(C)c1 728925627 JVDVTASQIRJPBF-UHFFFAOYSA-N 429.546 2.180 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(OC)ccc3OC)cc2F)CC1 730390953 JZGFRSSOXSOMAX-UHFFFAOYSA-N 444.507 2.240 10 20 IECD O=C(NC[C@@H]1CCCO1)c1c(NS(=O)(=O)C[C@@H]2CCCO2)sc2c1CCCC2 735646296 OTVJGIJHQUTFFM-KBPBESRZSA-N 428.576 2.456 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br 750029014 AOWZTVDHRGEWPS-LLVKDONJSA-N 445.270 2.433 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 754140347 MXHMCZWRDWQYEX-XMSQKQJNSA-N 438.572 2.048 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 754643431 XAJBPLMZWGTPNI-LJQANCHMSA-N 445.585 2.210 10 20 IECD 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Nc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc2cccnc12 731250686 ZLZVKIXKRQKVJB-UHFFFAOYSA-N 438.459 2.266 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)NC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 738440529 UXNGSJPHRPINTI-MRXNPFEDSA-N 440.500 2.325 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC(C)(C)C 740491195 IOMWJINMSAFVEH-UHFFFAOYSA-N 446.573 2.393 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(S(=O)(=O)Cc3ccon3)CC2)cc1 742805654 NBNHUOQGDGFFFU-UHFFFAOYSA-N 428.514 2.370 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(CCc4ccncc4)n3)CC2)cc1 743190931 WGJPNZUQOQEQDW-UHFFFAOYSA-N 449.559 2.473 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N(C1CCCCC1)[C@@H]1CCS(=O)(=O)C1 746497551 PEQKHULAGPLQAZ-LJQANCHMSA-N 435.590 2.300 10 20 IECD O=C(COC(=O)c1ccc2nncn2c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749407502 BBOKRYFKJMFAQY-UHFFFAOYSA-N 426.388 2.300 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N1CCCC[C@H]1C(N)=O 749700611 CXTLNRXPYQMJDW-HNNXBMFYSA-N 430.530 2.300 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753860521 FTORDBOQRMEBEU-UHFFFAOYSA-N 444.507 2.062 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754211655 JMCLHRNSSGXRSO-UHFFFAOYSA-N 431.464 2.147 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nc(C(F)(F)F)ccc3=O)cc2F)C[C@@H](C)O1 754722047 AWGJUPYFMBNECO-CHWSQXEVSA-N 442.413 2.331 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](c3ccco3)N3CCCC3)CC2)cc1 758186820 SBNXYZYUSJFQGJ-FYYLOGMGSA-N 428.577 2.198 10 20 IECD C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759563707 VDFUJQYMQIRSTE-BXKMTCNYSA-N 444.503 2.376 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3csc([N+](=O)[O-])c3)cc2F)CC1 768838408 TXRIKAUZQXGRPH-UHFFFAOYSA-N 428.511 2.416 10 20 IECD C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 768950595 BVKHBIVXPHLMQX-NVXWUHKLSA-N 433.553 2.101 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 772446314 MMGGKABMKZOWIJ-OALUTQOASA-N 441.576 2.121 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](C4CCN(C)CC4)C3)CC2)cc1 778393966 CBXZLOCORJFIOR-CQQBXOTJSA-N 440.588 2.090 10 20 IECD COc1ccc(CN(CC(=O)NCc2ccc(N(C)C)cc2)[C@H]2CCS(=O)(=O)C2)cc1 781350821 QOHYNDWJPYJNCP-NRFANRHFSA-N 445.585 2.067 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1[N+](=O)[O-] 782778916 VAJUIEVRCJJBCM-UHFFFAOYSA-N 430.486 2.412 10 20 IECD O=C(Nc1ccnn1CC1CC1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765785 BYLFRCACFRMRKQ-KRWDZBQOSA-N 431.924 2.371 10 20 IECD CC1CCN([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C(C)C)CC1 787613651 BHWMBDQTDFPTIN-QHCPKHFHSA-N 444.620 2.354 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cnn(Cc2ccccc2)c1 788827770 NKFPFRKFYJMNLN-UHFFFAOYSA-N 449.580 2.417 10 20 IECD CCn1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C(F)(F)F 799254259 VUQQBUQKAQNLKX-UHFFFAOYSA-N 425.411 2.013 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C 807095920 CEZPSKGEAGXOTR-HNAYVOBHSA-N 432.565 2.439 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCc4cnn(C(C)C)c4C3)CC2)cc1 807293367 UUIGAEFRSFCEHD-LJQANCHMSA-N 439.560 2.185 10 20 IECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385685 OYRQYJFFSQPEBU-UHFFFAOYSA-N 441.303 2.122 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(N(C)C)cc1 807673844 AGOWAABXBJDURJ-AUSIDOKSSA-N 438.572 2.337 10 20 IECD C[C@H](NC(=O)CNS(=O)(=O)c1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 810207432 ISADQERUANBJDM-HNNXBMFYSA-N 437.949 2.332 10 20 IECD O=C(N[C@@H](CO)C1CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812376576 XFGGOJJMDMMELP-SFHVURJKSA-N 449.485 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)c3cnn(C)c3I)CC2)cc1F 815773770 ZURJDCQGXHWKNS-UHFFFAOYSA-N 444.248 2.135 10 20 IECD Cc1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n([C@H]2CCS(=O)(=O)C2)n1 915328422 GTTJFUSXOACNLS-IBGZPJMESA-N 447.561 2.052 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 916587018 RIEZMIKGRSERCU-UHFFFAOYSA-N 447.561 2.108 10 20 IECD CN1CCN(c2ncccc2CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 921247885 MVFAQRDBMKXLEK-OAQYLSRUSA-N 439.560 2.430 10 20 IECD C[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)NCC(F)(F)F 1251133547 DZXRVGHUGYODIC-VIFPVBQESA-N 449.341 2.167 10 20 IECD CCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cn1 1799767410 NGNWQFMCZPRBNN-CCWDJLKJSA-N 445.903 2.226 10 20 IECD CCn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cc1C 1817846146 IZZDTXXNUHVADH-INIZCTEOSA-N 439.476 2.360 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccccc2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 10530309 RKEAISQCCZOCBF-UHFFFAOYSA-N 428.466 2.487 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)N3CCN(c4ncccn4)CC3)sc2n1 28776331 HHCZIHKYDVDHDR-AWEZNQCLSA-N 440.529 2.179 10 20 IECD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)c1 730771964 DBGSFPIQMMYCKJ-NRFANRHFSA-N 436.512 2.353 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)cc1 740812840 DXKKXRTVLTXVST-UHFFFAOYSA-N 425.532 2.437 10 20 IECD CN1CCN(Cc2cccc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2)CC1 746146465 GYNYBQRXCLTSQO-QHCPKHFHSA-N 449.599 2.066 10 20 IECD O=S(=O)(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn([C@@H]2CCOC2)c1 752000422 ZLTNDZNLKFQGGR-GOEBONIOSA-N 442.488 2.393 10 20 IECD Cc1nn(C)c(C)c1C(=O)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753618520 DVYYRDAVJNNJTN-UHFFFAOYSA-N 445.431 2.177 10 20 IECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 759024367 ABQCZCUOUHFCNX-UHFFFAOYSA-N 433.455 2.437 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 759592480 KXBJTGJMVBXQOO-WMZJFQQLSA-N 431.466 2.322 10 20 IECD COC(=O)c1ccccc1NC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759873629 XERYSHQRQBDOBC-UHFFFAOYSA-N 443.500 2.260 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(CC(F)(F)F)[C@H](C)C2)c1 762508735 QFDYXTGDAMRRIL-OAHLLOKOSA-N 429.483 2.495 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 766268799 GORBBZMCVPNEHJ-AZUAARDMSA-N 436.574 2.033 10 20 IECD O=S(=O)(Cc1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768192072 OKZCJXCNCKPMPV-UHFFFAOYSA-N 433.549 2.310 10 20 IECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 769320679 UHPBIEQLKJCMDR-FPOVZHCZSA-N 432.584 2.475 10 20 IECD Cc1ncc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)cn1 769762393 HVVHXAKBCBXLCP-UHFFFAOYSA-N 429.414 2.452 10 20 IECD CCc1nn(C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774108603 QJAUSGIRINKKDI-UHFFFAOYSA-N 439.438 2.093 10 20 IECD COc1cc(OC)cc(N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 785434001 RMOIFQHAJATKEB-UHFFFAOYSA-N 440.544 2.125 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc([C@H]4CCCO4)nn3C)CC2)cc1 789448002 HJVNQKJGAWBLDC-LJQANCHMSA-N 427.505 2.004 10 20 IECD CCCCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800150 MCKKPUJSGGAWMG-UHFFFAOYSA-N 444.507 2.169 10 20 IECD O=C(COc1ccc(Br)cc1)N1CCN(C(=O)c2cccc(O)c2O)CC1 790707906 RDZPMBNRGMSLSS-UHFFFAOYSA-N 435.274 2.224 10 20 IECD C[C@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793719015 KVGMHKFPBIRAMG-DOTOQJQBSA-N 440.569 2.212 10 20 IECD CCN(C)Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 793871990 VZEUUBRGJKGLPN-IBGZPJMESA-N 438.572 2.469 10 20 IECD COc1ccc(S(=O)(=O)NC2CC2)cc1NCc1ccc(N2CCN(C)CC2)cc1 796407938 NKRZFPATMLEVDW-UHFFFAOYSA-N 430.574 2.500 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12)c1ccc(N2CCOCC2)cc1 803298409 SSGSSFIYQQZOQN-PIKADFDJSA-N 435.615 2.196 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N(C)Cc1ccccc1 805942132 HXPNFBJJUCHNQP-HXUWFJFHSA-N 438.572 2.118 10 20 IECD CN(C)C(=O)C1(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CCCC1 806264661 GGJXBSNTQUTGNH-UHFFFAOYSA-N 427.501 2.279 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1)c1ccc(N(C)C)cc1 807670536 GGUNYALPYLJPQI-PXNSSMCTSA-N 443.617 2.096 10 20 IECD CCO[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770999 QRGAYQSPFUYLDO-MAUKXSAKSA-N 425.476 2.401 10 20 IECD CCN(CCS(C)(=O)=O)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807951669 DJYRHXLLFLDPOT-HNNXBMFYSA-N 443.997 2.086 10 20 IECD CC(C)OCCN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 808519004 TXQQACVOMSJEEJ-UHFFFAOYSA-N 432.609 2.495 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1 814679868 PSVOEEXKLZFEGR-LJQANCHMSA-N 436.512 2.256 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H](O)CC1 819324514 PKANHUYMYMDOET-OAHLLOKOSA-N 435.458 2.088 10 20 IECD CN(C)c1ccc(CNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1 915926887 FJYKRBQDVQENRG-HXUWFJFHSA-N 446.573 2.209 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(-c1ccc(N3CCOCC3)cc1)n2CCOC 916857184 WYBLPWCJBVDEPK-UHFFFAOYSA-N 427.505 2.249 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(N2CCNC2=O)CC1 917161689 PCXDFQQMPMOSEH-OAHLLOKOSA-N 446.507 2.279 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2)C1 918117684 HPMJTRGZQMMDTQ-FGZHOGPDSA-N 435.572 2.462 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccccc3[N+](=O)[O-])cc2)C1 918118446 SHSJPKWOFZGIQS-QGZVFWFLSA-N 440.504 2.208 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918122488 LMRXOPQVOPMQNJ-HXUWFJFHSA-N 443.592 2.177 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918310580 MUFKSTYASOFPJW-UHFFFAOYSA-N 425.485 2.215 10 20 IECD CNC(=O)c1ccc(C)c(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 920255278 ULRXFJFYXRYQEZ-KHPPLWFESA-N 436.512 2.207 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1778346882 JKOKSMDDHWCLBZ-QIBGMHRESA-N 430.501 2.083 10 20 IECD CC(C)(C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786101941 AIQSEXSOEBWJLE-KRWDZBQOSA-N 449.598 2.388 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1-c1ccccc1)c1cc(O)nc(O)c1 1797237294 WYNSIHURPSCOSA-VBUUOAMHSA-N 433.468 2.244 10 20 IECD Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1805509822 OUKXNPSTRPVPKO-IIBYNOLFSA-N 433.468 2.225 10 20 IECD COc1ncc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cc1F 1807566948 OAMZJCXHLGZFGB-UHFFFAOYSA-N 444.463 2.194 10 20 IECD O=C(COc1ccccc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543085 SMIZLRNNDASJNR-UHFFFAOYSA-N 425.485 2.417 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncccc1F)CC2)c1cc(O)nc(O)c1 1816724894 BZBLSUAAINMYOA-SNVBAGLBSA-N 429.433 2.023 10 20 IECD Cc1nc(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)o1 1819799268 APNWFPLKGUFOIE-AWEZNQCLSA-N 426.433 2.440 10 20 IECD CCn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cc1C 1819907837 LCWAWHAKQTXTQV-INIZCTEOSA-N 439.476 2.360 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1820279660 MEIYDSCHHCICJC-CYBMUJFWSA-N 448.508 2.490 10 20 IECD Cc1nc(F)ccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820948479 AQCWQGXNIIHTLM-LLVKDONJSA-N 443.460 2.331 10 20 IECD Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cs1 1837550896 QCWRZZNVTABVBH-UHFFFAOYSA-N 446.529 2.184 10 20 IECD O=C(c1ccncc1Cl)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441592 HPLUSQCBOLSQRO-UHFFFAOYSA-N 437.887 2.345 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCn2nnc3ccccc3c2=O)cc1 105228424 ZSTJFQJUUAESJI-FQEVSTJZSA-N 435.528 2.455 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 303025242 VQJXEXHVVMAZOW-UHFFFAOYSA-N 438.525 2.214 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccn(CC(=O)N(C)C)n3)cc2F)C[C@@H](C)O1 726080677 LZHLUPJWISVTSB-HUUCEWRRSA-N 432.500 2.046 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(-c4nncn4C)c3)CC2)cc1 726726910 MBTSSMNLLVUWDS-UHFFFAOYSA-N 434.500 2.214 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)NC[C@H]2CCCCO2)c(C)n1-c1ccc(F)cc1 732163895 OQXMOTPRQLVXCI-LJQANCHMSA-N 437.537 2.452 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3cccc(C(=O)NCCC(N)=O)c3)CC2)cc1 733631827 PPJJQJZZJKNEMP-UHFFFAOYSA-N 439.516 2.045 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1O 737283980 JGDXCCJTUSFEII-HOTGVXAUSA-N 427.501 2.265 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1NC(C)=O 740609441 LNXXBXBBBKXAOW-UHFFFAOYSA-N 446.529 2.156 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1 741678312 NMRUMOOGXRAIPE-UHFFFAOYSA-N 431.625 2.024 10 20 IECD CN(Cc1cc2c(cc1OC(F)F)OCO2)C(=O)c1cc(NS(C)(=O)=O)ccc1O 743506258 MXFCLSJKLNICKT-UHFFFAOYSA-N 444.412 2.366 10 20 IECD Cc1ccc2ncccc2c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 748641772 PGSKYZLSOGOJKN-UHFFFAOYSA-N 435.483 2.414 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C(=O)N(C)OC)cc3)CC2)cc1 749642202 KPKFHAMDJGWXHY-UHFFFAOYSA-N 440.500 2.052 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc(OC)c(OC)c3)CC2)cc1 753998353 BDIMCVZPMHEHQV-NRFANRHFSA-N 429.561 2.327 10 20 IECD O=C(CN1CCC[C@H]1C[C@H](O)c1ccco1)NCc1ccc(N2CCOCC2)c(F)c1 758822394 HKWPYICPYXUTFS-RXVVDRJESA-N 431.508 2.460 10 20 IECD Cc1ocnc1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 765341416 XAASBLAPBXFJIA-UHFFFAOYSA-N 432.414 2.328 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 766199842 JUFQMABGJQGCCQ-UHFFFAOYSA-N 430.276 2.185 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)[C@@H]4CCCN4C)CC3)cc2)CC1 766971540 PMAASXDPFBWULA-QFIPXVFZSA-N 427.593 2.371 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 774116976 LOPQTUSPCNJLGL-BEIWTESXSA-N 434.489 2.415 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)CCc3ccccc3)CC2)cc1 774538145 NOZKLSVBTMPFHZ-HXUWFJFHSA-N 438.572 2.071 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 775035965 IAKWDIURWGAHBZ-NRFANRHFSA-N 436.556 2.125 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c1 775147183 UMUQNKGCFFAJAM-UHFFFAOYSA-N 426.517 2.186 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCc2nnc(O)cc2C1 775775673 AERZPCTXQLERTK-ZDUSSCGKSA-N 428.448 2.343 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)CC2)cc1 785802052 GJBJEMVYILLENK-RWQQGDIJSA-N 442.434 2.243 10 20 IECD CC(=O)Nc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 786224794 WHZXRUPPKJAVFC-UHFFFAOYSA-N 426.542 2.131 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(CC4CC4)CC3)cc2F)C[C@@H](C)O1 788486800 YUZYOAKPNWKPTM-IAGOWNOFSA-N 446.567 2.046 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1(c2ccc(F)cc2)CC1 789755685 AJRFWRQZEKMWAJ-UHFFFAOYSA-N 425.504 2.469 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)cc2F)C[C@@H](C)O1 789821520 TVWXRLLMPZNZCC-CLFNVJJBSA-N 445.535 2.129 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@H](N2CCCC2)CC1 789856765 XYZAPIWWRYFWMO-HXUWFJFHSA-N 430.618 2.333 10 20 IECD C[C@@H](N[C@H](C)c1nnnn1C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792474217 PJEKHBZMBVEVIX-CHWSQXEVSA-N 430.468 2.461 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 799762201 QNGDDZAIXXBWJR-UHFFFAOYSA-N 431.436 2.424 10 20 IECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803302627 RZJOHLXHDHTNLZ-KRWDZBQOSA-N 439.512 2.478 10 20 IECD CCN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1)CC(F)(F)F 803664526 NCWLEQYAKVXDCK-OAHLLOKOSA-N 432.462 2.241 10 20 IECD CCS[C@H]1CCC[C@H](NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 803747653 SKQDIVBGTUKDKX-RXVVDRJESA-N 448.633 2.114 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCc4ccccc4[C@H]3C)CC2)cc1 803752076 XVJORHGWIGHASR-LJQANCHMSA-N 436.556 2.079 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)C(=O)NCCCSc1nccs1 804262874 CJORUYWLPUECAM-CYBMUJFWSA-N 428.580 2.257 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc1 906261115 NNZAGHGOGIHPNQ-UHFFFAOYSA-N 444.399 2.439 10 20 IECD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)c1ccc(O)c(O)c1 916590082 GUFAHCJJDFYYGI-UHFFFAOYSA-N 437.445 2.451 10 20 IECD COC(=O)c1cn(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc12 917833391 QUMVNUGTZSDBOM-SFHVURJKSA-N 448.523 2.446 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(N4CCOCC4)c3)CC2)cc1 918462213 UDZWJJJRGZKWFK-UHFFFAOYSA-N 438.528 2.209 10 20 IECD CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969670 WBZJSQWHPBZWKY-UHFFFAOYSA-N 429.492 2.232 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920922563 FFEZDSFNJSXMFH-CQSZACIVSA-N 428.445 2.256 10 20 IECD C[C@]1(CO)CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 1341035054 CQXWKRUXWJVQRW-QHCPKHFHSA-N 442.539 2.246 10 20 IECD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccn1 1782008330 ZSINLZATJIWMMA-PEBXRYMYSA-N 445.903 2.393 10 20 IECD CCN(C)[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792315765 ANALYKDPKGIRJK-AWEZNQCLSA-N 448.614 2.321 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1 1814166651 RVYFWEOHGZGWOZ-UVVPWPQKSA-N 441.459 2.276 10 20 IECD CN(C)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817143904 ADXHBNWDYYPZHU-MNDMWVCDSA-N 443.504 2.184 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844536 CJDTZBUIAZZVHI-OXJNMPFZSA-N 437.456 2.255 10 20 IECD CN1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1823805722 HJDAWRAFJTZTSI-LJQANCHMSA-N 430.549 2.068 10 20 IECD O=C(COC1CCCCC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441125 OCWQDZDHCVEIDS-UHFFFAOYSA-N 438.528 2.332 10 20 IECD CCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251702 RUGWPGVXYCGZMR-INIZCTEOSA-N 447.532 2.147 10 20 IECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NCc2ccc3c(c2)CCCN3C)c1 729262523 UQVPNGFWMIHNPA-UHFFFAOYSA-N 430.530 2.329 10 20 IECD COC[C@@H](C)NC(=O)NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036431 KPJBYOIKCLIZKH-OAHLLOKOSA-N 434.537 2.325 10 20 IECD CCN(C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1)S(C)(=O)=O 731360288 ZTXSVLJJDRLLBH-UHFFFAOYSA-N 440.635 2.195 10 20 IECD Cn1ccc(N2CCC[C@H](NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)C2=O)n1 745882799 JSAWFBZKZGUJGH-MSOLQXFVSA-N 427.505 2.012 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)c1 751415842 ZVYKVUOKBDIGBO-UHFFFAOYSA-N 432.495 2.169 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)NC[C@H]3COc4ccccc4O3)CC2)cc1F 753860577 ITTGNRBJSKUWOW-AEFFLSMTSA-N 429.492 2.301 10 20 IECD CCC[C@@H](C)N1C[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1=O 759222832 XRJAESGIQCPWPD-IAGOWNOFSA-N 433.549 2.398 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765928410 YTQKJNJDECHKTM-UHFFFAOYSA-N 436.306 2.350 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O 767338412 OHFASDNELPHFAI-UTKZUKDTSA-N 433.574 2.137 10 20 IECD O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914056 CBQPYQRIKMQZRB-CVEARBPZSA-N 432.995 2.047 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSCc3cccc(C(N)=O)n3)cc2F)C[C@H](C)O1 779837422 POKBFDQMTKPVFX-GJZGRUSLSA-N 446.548 2.483 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781441065 PUGINPNGBMPLQE-UHFFFAOYSA-N 429.448 2.012 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 785432709 HSHBQZZDWRJOTF-UHFFFAOYSA-N 434.500 2.220 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC(F)F 787298989 RNAFHDBEPVKKCU-UHFFFAOYSA-N 449.454 2.066 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1 788318496 DBRXNRMJTOZVED-VQTJNVASSA-N 443.569 2.316 10 20 IECD Cc1ncsc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822540 XCJWBFGVVSWDRT-KBPBESRZSA-N 434.537 2.479 10 20 IECD CCC[C@H](C)[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793729343 ZSCGMRDYYGEKLC-FBBABVLZSA-N 428.577 2.432 10 20 IECD Cc1nc(C)c(-c2csc(NS(=O)(=O)c3ccc(S(C)(=O)=O)nc3)n2)s1 795612510 NWHSDUCBBPMGEZ-UHFFFAOYSA-N 430.558 2.483 10 20 IECD CN(CCNCc1ccc(N2CCOCC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 797879934 QASLMRVKVSQJQX-UHFFFAOYSA-N 425.501 2.212 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1ccccc1F 803311280 SZUMZUZZPYRCTB-DLBZAZTESA-N 429.492 2.423 10 20 IECD CCC1CCC(N(C)C(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 803748246 ZKORYMMBKWSPMJ-UHFFFAOYSA-N 430.593 2.361 10 20 IECD COCCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 804901051 PAAASWOMODVXKS-SJLPKXTDSA-N 436.984 2.029 10 20 IECD CC1(C)CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1CCO 806878337 PEIFSCMZZMFSFX-INIZCTEOSA-N 426.508 2.355 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(F)c(N4CCCNC4=O)c3)ccc21 806878606 MTKWWQXWXYGYPE-UHFFFAOYSA-N 439.491 2.383 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 807289265 OEEXFOPSRVJHJU-QFIPXVFZSA-N 427.545 2.256 10 20 IECD CN(CC1(N(C)C)CCC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771589 WCOWOLJVOCTYAN-INIZCTEOSA-N 438.519 2.316 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 810207047 CRZYFGHCDNNVTE-SFHVURJKSA-N 431.558 2.296 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn2ccnc12 815549492 HWRBLNVOUHQAFQ-UHFFFAOYSA-N 446.555 2.430 10 20 IECD C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818999569 LDCBNUDQITXMEU-RBZFPXEDSA-N 449.485 2.382 10 20 IECD COc1ccc(OCCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918001417 MNHRTMLWEWVYLS-GOSISDBHSA-N 426.517 2.275 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1 918310537 LZXWXANSNBXYPI-UHFFFAOYSA-N 437.475 2.445 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCC2CC2)c1 919767544 RUGRHWDWZRVQFW-UHFFFAOYSA-N 429.542 2.142 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1 920239242 YKYBOGTYJZXOAD-SFHVURJKSA-N 434.562 2.481 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 920865607 GYBXOYGAAPXDOU-OAHLLOKOSA-N 437.587 2.303 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920880811 IQIXVFRKZLBLQT-MRXNPFEDSA-N 433.530 2.196 10 20 IECD CC(C)CC(=O)N1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 1115858712 BFESBEFJJXAZOX-RTBURBONSA-N 448.583 2.246 10 20 IECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c(=O)[nH]c1C 1800715499 AUEXBVQYDVQVIP-BTTYYORXSA-N 446.891 2.017 10 20 IECD CC(C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803238575 ORPIMZGYMWYPJY-JVPBZIDWSA-N 447.919 2.483 10 20 IECD Cc1noc(C)c1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283691 KQNJIQBELOQKPS-BJKLQHCMSA-N 441.484 2.302 10 20 IECD CCc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1805330203 CGJXAVGKQCVRND-OPAMFIHVSA-N 447.495 2.479 10 20 IECD CC(=O)CCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809108775 RPEMHRAWKROWJJ-UHFFFAOYSA-N 438.528 2.380 10 20 IECD COc1nccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1F 1810543680 NAYDSKZZLVCQAQ-UHFFFAOYSA-N 444.463 2.194 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H](O)c3ccccc3)CC2)C1 1810543910 QEQQQJMJHMDFGZ-FQEVSTJZSA-N 425.485 2.071 10 20 IECD CC[C@H](NC)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804242 SXVMCYLEQNZZNX-LJHODMEESA-N 446.935 2.464 10 20 IECD O=C(Cc1ccsc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722526 KTCWPCHWQPVSPI-GFCCVEGCSA-N 430.511 2.479 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1cc(O)nc(O)c1 1817844757 KEIXYPKXXVUAJX-INIZCTEOSA-N 429.477 2.339 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cn[nH]c2)CC1 1825185179 HMOUMQGLRKWNCC-SFHVURJKSA-N 427.505 2.082 10 20 IECD CC[C@H](NC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1827043350 JXESYUUHQZWJOV-VKJZPDJHSA-N 445.560 2.434 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829073672 PPHLPKOEFJWJCD-YJBOKZPZSA-N 446.548 2.031 10 20 IECD Cc1nc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cs1 1842041494 NFLTZEYPNXXFRB-GQCTYLIASA-N 429.498 2.028 10 20 IECD COc1nc(C)ccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844542571 BISSHXHWVKLYQO-UHFFFAOYSA-N 447.495 2.009 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)n(C)c2ccccc12 580864022 ZCXSFAOYMOKIJJ-UHFFFAOYSA-N 444.438 2.484 10 20 IECD NC(=O)NC[C@@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 726722136 NCRKYYPZFBOIPM-AWEZNQCLSA-N 425.480 2.347 10 20 IECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 731283573 DBYVKXPTKSCDIC-HKUYNNGSSA-N 433.572 2.414 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 731968807 OHELAYCXDZAPNT-QFIPXVFZSA-N 430.593 2.203 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CC(N)=O)Cc3ccccc3)cc2F)C[C@H](C)O1 732808242 KDMOOHYXLHAOJO-ROUUACIJSA-N 442.535 2.043 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C)O[C@H](C(F)(F)F)C3)CC2)cc1 745784513 WHWZXMJFLKSURK-YJBOKZPZSA-N 430.471 2.178 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)c(F)c(C(=O)O)c2)cc1Cl 751147900 WZANNQFNPGHBPE-UHFFFAOYSA-N 440.833 2.489 10 20 IECD C[C@H](NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cc([N+](=O)[O-])ccc1O 756410332 HDRMINBRSSFMIC-HNNXBMFYSA-N 435.502 2.313 10 20 IECD COC(=O)c1cccc(CC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759219563 BFGBUZRJWDIHTH-UHFFFAOYSA-N 428.485 2.390 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc4cc(C)nn4c3C)CC2)cc(OC)c1OC 759226211 WJKPMZSRBSAWKX-UHFFFAOYSA-N 425.489 2.334 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)NCc2cccc(Br)c2O)CC1 764760523 ICSGGPOSFNRORX-UHFFFAOYSA-N 434.356 2.158 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)CC3CC3)cc2F)C[C@@H](C)O1 765680740 ZCQCMMBFKIGTFQ-GASCZTMLSA-N 427.542 2.063 10 20 IECD C[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(=O)(=O)C1CCOCC1 765687623 VALBFXXDVZQDEF-CABCVRRESA-N 446.516 2.355 10 20 IECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NCc1ccc2c(c1)CCCN2C 768350958 XBCBIMAOOPJBMG-FQEVSTJZSA-N 432.565 2.351 10 20 IECD COC(=O)c1ccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cc1 771082150 JJHLKLBTYILOOE-UHFFFAOYSA-N 436.468 2.423 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773847763 OPCXCTWWNSSJOA-JTBPQFFMSA-N 431.558 2.464 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(F)cc1I 774363834 MUDLQSHUQBXKCA-UHFFFAOYSA-N 444.200 2.139 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOc4cc(F)ccc43)CC2)cc1 778286180 WKVZTMOQEYFCEU-CMDGGOBGSA-N 425.460 2.465 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4cccc(OC)c4)CC3)CC2)cc1 779216689 RPUQJCNSKLFLDE-HSZRJFAPSA-N 440.588 2.009 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1-n1cnnn1 781609435 UJXHBEZKGSXBJK-GASCZTMLSA-N 440.479 2.354 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccccc2F)c2nccn2C)cc1F 785601237 APQXKCJGZVMWQI-LJQANCHMSA-N 427.455 2.286 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cn2cc(Cl)ccc2n1 786504535 UBXHMGXLTAAAAB-UHFFFAOYSA-N 441.919 2.099 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1 788320874 QLNUYNAWNAWVON-LJQANCHMSA-N 442.947 2.188 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 788963437 IUTSZLJKBLZDAA-GOSISDBHSA-N 438.528 2.079 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 789823095 YUFGSIGRODMLOO-RHGYRFJNSA-N 447.551 2.475 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](n4ccnc4)C3)cc2F)C[C@@H](C)O1 789827340 SAPOPRPWHTXJEF-ZHALLVOQSA-N 443.523 2.116 10 20 IECD CC(C)N(CCc1nccs1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840456 IPKWBGNRROLPCB-UHFFFAOYSA-N 448.564 2.339 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]1c1ccccc1 793732567 IPVYWTRIIXGQMN-PIPMEXSNSA-N 434.540 2.224 10 20 IECD CC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)[S@]1=O 796365865 IXCFOZRYVAGKNB-VCEPKILLSA-N 439.597 2.287 10 20 IECD Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 796726484 ZJCCOECWAPACOZ-UHFFFAOYSA-N 437.475 2.318 10 20 IECD CCN(CC)c1ccc(CN(C)c2nnc([C@@H]3CCS(=O)(=O)C3)n2CCOC)cc1 802348494 DNWKRCHVUMHWMV-GOSISDBHSA-N 435.594 2.309 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 806276457 DWKHSRWUOGAYRM-GFCCVEGCSA-N 426.514 2.415 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@@H]3c3cnn(C)c3)CC2)cc(OC)c1OC 808176831 LYRWUICFVMNDKO-NRFANRHFSA-N 443.548 2.135 10 20 IECD Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1ccc(N2CCOCC2)cc1 813332234 ZAROBSPCGKCUBD-UHFFFAOYSA-N 431.558 2.465 10 20 IECD CCNC(=O)COC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 913361348 HLCAMTRKXKVRJJ-GHXNOFRVSA-N 443.344 2.330 10 20 IECD CN(C[C@@H]1COc2ccccc2O1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117868 RLVWLORFUVURPA-UYAOXDASSA-N 438.528 2.370 10 20 IECD COC(=O)CC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 918742107 VVWQAHQGRNYLGB-IRXDYDNUSA-N 435.540 2.331 10 20 IECD CC(C)(CC(=O)O)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 920208937 CKBNLJFKOLXRJZ-UHFFFAOYSA-N 429.496 2.450 10 20 IECD Cc1nc2ccc(S(=O)(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2o1 1320647253 QGSKOEIXUFPNKJ-MRXNPFEDSA-N 428.514 2.316 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CC1 1792604341 AQSCESRCRMNXAV-BJWYYQGGSA-N 443.594 2.217 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc2cccn2cn1 1804286260 PXTYRCWFSLSTHB-CMTWWZJASA-N 448.479 2.416 10 20 IECD Cc1noc(C)c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992234 WTQJVSKWLIZWBI-QRWLVFNGSA-N 437.456 2.126 10 20 IECD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)COC1 1832876783 YRNLXFYBHNUEJZ-IWHGQQBYSA-N 444.528 2.473 10 20 IECD O=C(CCc1cc(F)ccn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441361 NGAFLUKZEPNPHU-UHFFFAOYSA-N 449.486 2.150 10 20 IECD O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NCc1ccc(N2CCOCC2)cc1 108804814 WBCPTIXRKKEFDP-UHFFFAOYSA-N 443.569 2.213 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc([N+](=O)[O-])cc3)CC2)cc1 726237902 VCHJFFKXHSPEQH-UHFFFAOYSA-N 427.505 2.267 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2OC(F)(F)F)SC1=S 727175854 BHAAFSHSIFYGTA-FLIBITNWSA-N 426.463 2.336 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@@H](Cc4ccc(F)cc4)C3=O)CC2)cc1 735793616 DXYDOCLSAVRDIV-GOSISDBHSA-N 439.487 2.101 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)c2)CC1 739768937 XIVSDAXTOAYGJJ-UHFFFAOYSA-N 442.541 2.081 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](CN3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739926372 MDCCGXXPOKZKGS-IBGZPJMESA-N 444.601 2.342 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN(C(=O)COc2ccccc2)C1 741214536 XGLVFJKHATZIFF-NRFANRHFSA-N 437.540 2.457 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)cc1 743254401 OMENSZPXYDOQFU-UHFFFAOYSA-N 431.879 2.337 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 752097293 QWEBERRCTOOTRX-UHFFFAOYSA-N 427.526 2.210 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(CCS(C)(=O)=O)C3CC3)cc2F)C[C@@H](C)O1 753572325 NIMJVWMJRVVVDI-GASCZTMLSA-N 427.542 2.158 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc4c(c3)OCCO4)CC2)cc1 754001824 WPWPLKIUEUWUQV-OAQYLSRUSA-N 427.545 2.081 10 20 IECD COC(=O)c1coc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 754002990 VBSKUYCGTMWNEF-CHWSQXEVSA-N 426.466 2.297 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4ccccc4)C[C@H]3C)CC2)cc1 754043543 QFVRAAOENGKTDN-RCZVLFRGSA-N 438.616 2.384 10 20 IECD Cc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 755025691 DGBOKAHEURFUJN-UHFFFAOYSA-N 439.515 2.247 10 20 IECD O=C(COC(=O)C[C@@H](O)c1cccc(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 756261280 OTFUKAXBTBMAQY-HXUWFJFHSA-N 434.439 2.085 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cnn(-c4cnc5ccccc5n4)c3)ccc21 758986978 GIBRJNBFZJNBJZ-UHFFFAOYSA-N 441.495 2.453 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c1 759594923 OPXAHQAXRUZPCV-CLTKARDFSA-N 425.846 2.350 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(F)cc3CS(C)(=O)=O)ccc21 760096809 NDLAEYHAEZFZJI-UHFFFAOYSA-N 433.505 2.008 10 20 IECD C[C@H](NCCCN1CCN(c2ncccn2)CC1)c1ccc(N2CCOCC2)c(F)c1 764846623 IHELGMIAFUMMTO-IBGZPJMESA-N 428.556 2.315 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C 766267132 ATPUZFLWNZBUDO-OAHLLOKOSA-N 429.542 2.463 10 20 IECD Cc1sc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 767726197 DCTRCHIOZXJWHL-AWEZNQCLSA-N 438.531 2.145 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1OC 768498635 LCRHCVBLSFFNMI-UHFFFAOYSA-N 432.451 2.095 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c1 769529563 GBOKACLLUIVPDL-SNVBAGLBSA-N 433.258 2.464 10 20 IECD CCCCCCn1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c(O)nc1=O 769636911 NDPSBVFSLMABBJ-UHFFFAOYSA-N 434.562 2.390 10 20 IECD COCCCS(=O)(=O)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 770351633 TXHGZKURNJYQAC-UHFFFAOYSA-N 440.566 2.069 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCN(C(=O)C4CC4)CC3)cc2)CC1 774192849 WHLFFBMTHHSTJC-UHFFFAOYSA-N 426.561 2.010 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 781271800 RGDQNFWUYCDXBC-UHFFFAOYSA-N 430.530 2.369 10 20 IECD CCOC(=O)[C@@H](C)N(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CC1 787365649 AAUTYEIXDUZCKY-MRXNPFEDSA-N 447.557 2.340 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(N2CCOCC2)cc1 787639428 OWHFURHBYNKHKY-JTSKRJEESA-N 442.535 2.259 10 20 IECD CC1CCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 787894891 MVAJGRBIIQAEPF-UHFFFAOYSA-N 432.634 2.484 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1ccc(Cl)cc1 788331247 IETIJLSIABIHCK-MRXNPFEDSA-N 431.920 2.377 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCNc2ncc(Cl)cc2Cl)cc1F 788443029 XGDUPFLIINMHSP-UHFFFAOYSA-N 428.295 2.438 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O 788932970 SPJJPQARPVZKGJ-OAQYLSRUSA-N 426.561 2.343 10 20 IECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789827382 SHCLSTVPSNHZCG-AWQBJMPUSA-N 435.540 2.375 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CN1CCCCC1 789828275 WUQWRKBCOOBHKS-GUDVDZBRSA-N 448.583 2.294 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1nnnn1C1CC1 791249907 LGFINYMOOVRTIH-UHFFFAOYSA-N 432.550 2.489 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3ccc(Cl)c(F)c3)cc2)CC1 795092485 GKMYYYXPPKFSAQ-UHFFFAOYSA-N 446.953 2.334 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687079 TWFNYNMCOWLKFY-PXNSSMCTSA-N 428.577 2.229 10 20 IECD CC(C)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1=O 806259742 BVRNOZGILBXOGE-YJBOKZPZSA-N 434.968 2.318 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc1 806720302 ZFVJXJLJCAETSX-HNNXBMFYSA-N 434.443 2.093 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COCCN1CC(F)(F)F 807108387 WCUAZTQZIVCRBY-HZPDHXFCSA-N 435.874 2.389 10 20 IECD CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCN(C2CC2)C1 807769667 UXXVZWLAJKLYCZ-YJBOKZPZSA-N 436.503 2.068 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1=O 808545499 CTEWOJLIXHMNPX-JOCHJYFZSA-N 436.556 2.327 10 20 IECD COc1ccc(CCNC(=N)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC 849070206 HXYSTCVKAKXPQM-IBGZPJMESA-N 439.560 2.262 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2cccc(OCC(N)=O)c2)c(C)n1-c1ccccc1 915748311 FHFYILAHDNDAKU-UHFFFAOYSA-N 434.496 2.256 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cccc(C(=O)NC4CC4)c3)CC2)cc1 917759796 ZTDGIMRBNWCUJS-UHFFFAOYSA-N 429.542 2.488 10 20 IECD CC(=O)NCC(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C(C)(C)C)cc2)c1C 919508470 SIWKBQHIWFETRS-UHFFFAOYSA-N 441.528 2.370 10 20 IECD Cc1cc(NC(=O)CSCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 919970999 CLYKUGXLDWUPIA-UHFFFAOYSA-N 436.509 2.071 10 20 IECD CC(C)(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1786379684 LLZNFJRFMNRWQE-QRFRQXIXSA-N 440.544 2.195 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2cc(O)ccc2n1 1796601364 YDABXVNOKKNMAT-MUJYYYPQSA-N 434.452 2.312 10 20 IECD COc1cc(C)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1803589981 GOUPQLADXCCBPN-QDMKHBRRSA-N 447.582 2.116 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccno2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146437 IBYYHXQFPJEHMP-KRWDZBQOSA-N 447.455 2.497 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C23CC(C2)C3)[nH]n1 1823501916 XNFGAPQQBFLGGS-AGPLRWBTSA-N 433.559 2.062 10 20 IECD O=C([C@H](O)c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424781 ODAHTAZPYJOLHD-OXJNMPFZSA-N 429.473 2.053 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)C3CCSCC3)CC2)CC1 1838032165 BUSNLBMFDISRBL-UHFFFAOYSA-N 449.573 2.248 10 20 IECD CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 60093700 LNYBGLFDOORRGJ-ZDUSSCGKSA-N 427.523 2.141 10 20 IECD CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)c2ccccc2O1 472787446 IHWCIAHGAUGMMA-QFIPXVFZSA-N 448.523 2.423 10 20 IECD CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 729525193 GJRCTTAMJXNPNM-HKUYNNGSSA-N 431.581 2.127 10 20 IECD NC(=O)CCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1 733631981 SIHJGUKVCOSNFZ-UHFFFAOYSA-N 441.557 2.167 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1 735576965 KSQQAOZLWWVZNM-UHFFFAOYSA-N 432.546 2.236 10 20 IECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NCc1ccc(N2CCOCC2)c(F)c1 742342033 MUFUKSUYVVUOAB-KPFFTGBYSA-N 436.553 2.004 10 20 IECD COc1ccccc1CC(=O)N1CCC(NC(=O)NCc2cccc(OC)c2O)CC1 745788173 MIPXSROFPQPUQP-UHFFFAOYSA-N 427.501 2.442 10 20 IECD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 746983079 RHYPZFYAWMTRJW-LJQANCHMSA-N 427.593 2.297 10 20 IECD COc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 747153897 DQPMTJCFDGWQRP-UHFFFAOYSA-N 430.526 2.209 10 20 IECD COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 747514165 DFWUEOUBPLXQEX-UHFFFAOYSA-N 441.893 2.184 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2cc3c(cc2Br)OCCO3)c1 751416455 BXUOWRRKIYBTNS-UHFFFAOYSA-N 430.276 2.413 10 20 IECD COC(=O)C[C@@H]1CN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CCO1 751969122 SCOFDJBTHALYBB-MRVPVSSYSA-N 434.199 2.042 10 20 IECD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)C1 759587896 FSYAMJCVRGUOIV-GMNBZTITSA-N 430.501 2.151 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1 773855846 HHKLDBXXOGKFGG-HNNXBMFYSA-N 444.557 2.318 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 774561059 LRAVOSYQRSYYQE-HZPDHXFCSA-N 429.492 2.381 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1CC 775147909 QMBKWTFLKCLQQL-UHFFFAOYSA-N 443.569 2.301 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CC(=O)N(C)C)CC3)cc2F)C[C@@H](C)O1 781347557 YBALJNPLHDOQNB-HDICACEKSA-N 448.583 2.246 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)cc1 785428028 JGBYWPVMPPXZJR-NRFANRHFSA-N 444.963 2.212 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)c(N(C)C)c3)cc2)CC1 786122270 PSDYWERWSRCGHD-UHFFFAOYSA-N 430.574 2.208 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 787709650 YKOXDRUZAHZYPO-KDURUIRLSA-N 430.593 2.264 10 20 IECD COc1c(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)oc2ccccc12 789799089 IJZLSGZXHXWECQ-UHFFFAOYSA-N 441.459 2.350 10 20 IECD CC(C)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789827393 SHCLSTVPSNHZCG-VWFIUDSGSA-N 435.540 2.375 10 20 IECD O=C(NCCc1cc(F)cc(F)c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789835189 PMBAJCQPSQYNHN-UHFFFAOYSA-N 435.446 2.040 10 20 IECD Cc1cc(Cl)nc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789836521 SIIBOJUFGUPCCW-UHFFFAOYSA-N 434.899 2.076 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 793808976 CRAYYKJYIGYAFS-MHECFPHRSA-N 430.593 2.407 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)c(O)c1 797389905 DPXGJOPGAGSOFH-UHFFFAOYSA-N 446.463 2.254 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F 803661773 MMZFJZRWWIYVGB-UHFFFAOYSA-N 436.528 2.366 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCc3cccs3)cc2F)CC1 805007190 GQKVMXRVIYFCAD-UHFFFAOYSA-N 432.565 2.346 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H](OC(F)F)C1 807768846 PRQOQXBCPXCBFI-WFASDCNBSA-N 433.402 2.213 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC1 807826853 VQBYDISCMDAHFL-KRWDZBQOSA-N 432.565 2.474 10 20 IECD COCCN(C)CCN1C[C@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1=O 808270044 QVRGNPJNIKXNDX-LJQANCHMSA-N 442.560 2.012 10 20 IECD C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1 917126507 GTFZBNWYIVJTDF-ZDUSSCGKSA-N 431.543 2.246 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1 917207535 AXTZQTWEOINFED-UHFFFAOYSA-N 428.558 2.495 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803972843 WDRMEAPCMZKYDH-NSAZKJPHSA-N 449.486 2.238 10 20 IECD CC[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)N(CC)CC 1806170075 VVLOZLUAZFNBHZ-GOSISDBHSA-N 432.565 2.458 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)CCc3ccco3)C2)CC1 1807120791 PEGLKZAOTCPFQQ-UHFFFAOYSA-N 449.598 2.304 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1 1814162376 RVYFWEOHGZGWOZ-AUWWNVLGSA-N 441.459 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCO3)sc2C1 1815803433 UROKSEDJDVDIDA-VQGGLNJCSA-N 445.497 2.064 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnoc2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146504 MMAFWYGHGMBXIF-SFHVURJKSA-N 447.455 2.497 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccnc(Cl)n1 1819745356 YRQZLPDYQJIUOX-CYBMUJFWSA-N 443.851 2.279 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCNC(=O)c3occc3C)cc2F)CC1 303876553 YCEJIAUNGDNLID-UHFFFAOYSA-N 445.539 2.488 10 20 IECD Cc1cn(C)c(CC(=O)N2CCOc3ccncc32)c1C(=O)N1CCOc2ccncc21 562343450 RILBBPVFWZNIPN-UHFFFAOYSA-N 433.468 2.131 10 20 IECD Cc1cc(C(=O)Cn2cc(S(=O)(=O)N(C)C)cn2)c(C)n1-c1ccc2c(c1)OCCO2 737411455 VZUSBULZRAEQIB-UHFFFAOYSA-N 444.513 2.195 10 20 IECD CCN1CCCC[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 745084062 FPMGLYDXUBRVQK-XGHQBKJUSA-N 435.540 2.473 10 20 IECD CNS(=O)(=O)c1cccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 747458150 ARPQOLSOZJVXDM-UHFFFAOYSA-N 425.576 2.260 10 20 IECD COc1cccc(CNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)c1O 751309302 KRTTUCIMRKXFJZ-UHFFFAOYSA-N 428.264 2.224 10 20 IECD CC(C)Oc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 755005203 UMVPZVSFZHFWDB-UHFFFAOYSA-N 431.464 2.318 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4cc(C)ccn4)CC3)CC2)cc1 766913585 IOKJFKLTEAELFF-UHFFFAOYSA-N 438.576 2.052 10 20 IECD COC(=O)[C@@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767879713 BGBNRRFNIYNHAN-OFNKIYASSA-N 445.535 2.130 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCSC4(CCOCC4)C3)cc2)C1 771300281 LRYQGYYJIVYDAN-SFHVURJKSA-N 432.590 2.196 10 20 IECD O=C(NC[C@@H](c1ccco1)N1CCCC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 774862017 AJUDXRKFLNCEJP-UXHICEINSA-N 441.528 2.446 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 775402214 AOPZDJIOSPMEPL-HNNXBMFYSA-N 433.530 2.085 10 20 IECD Cc1cc(C(=O)[C@@H](C)OC(=O)Cn2ncn(C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 779128293 KYUQVRGXJXZEGA-CQSZACIVSA-N 448.426 2.405 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1cn2c(n1)CCCC2 779798229 NIVTUEBKOYGEQT-UHFFFAOYSA-N 428.503 2.119 10 20 IECD Cc1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cccc1C(=O)N1CCCC1 785297388 NWEGKRLQXNPZDE-AWEZNQCLSA-N 425.485 2.328 10 20 IECD O=C(NCCSCc1ccccc1F)C(=O)NCc1ccc(N2CCOCC2)cc1 785410895 DNLFICWEQNWUJR-UHFFFAOYSA-N 431.533 2.328 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)NCCCSc2nccs2)cc1 785559782 LETHSOWDYYIRAR-GOSISDBHSA-N 448.614 2.240 10 20 IECD C[C@H](OC(=O)c1ccc2nnnn2c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 786049466 CWMVTGUPHUOIBT-LBPRGKRZSA-N 441.403 2.084 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCCN3CCC[C@H](C)C3)CC2)cc1 787909182 KWTWAKYZYIIOCC-FQEVSTJZSA-N 430.593 2.362 10 20 IECD Cc1nc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 789383537 YQZAJISURXBNES-HNNXBMFYSA-N 429.908 2.000 10 20 IECD Cc1cc(C(=O)CN2C[C@@H](C)O[C@H](C3CC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791561499 YQSXPENMJJVSHG-QRQCRPRQSA-N 431.558 2.424 10 20 IECD C[C@@H]1OCC[C@]12CN(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCO2 792542105 VJPVLIVYPXLRJY-DJJJIMSYSA-N 438.527 2.275 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCS(=O)(=O)c2ccccc21 796545789 MAJUUIGILKSOAG-OAQYLSRUSA-N 428.554 2.473 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448947 IVNSMLGZENEYQW-UHFFFAOYSA-N 440.535 2.419 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(C(=O)c2ccsc2)CC1 807098101 RXGJCMHNFBDLLW-UHFFFAOYSA-N 428.558 2.113 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)nc1 807100906 OHDJPOFYIZSFMX-LJQANCHMSA-N 437.544 2.258 10 20 IECD COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 808072910 XRVRJBXKGJYWOI-UHFFFAOYSA-N 447.922 2.479 10 20 IECD Cc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c(C)o1 814501618 SRZHVZLKJVCRNZ-UHFFFAOYSA-N 431.470 2.386 10 20 IECD C[C@@H](C(=O)NC[C@H]1COc2ccccc2O1)N(C)Cc1ccc(N2CCOCC2)cc1 857758949 VLAMYBDNXOGIIL-RXVVDRJESA-N 425.529 2.300 10 20 IECD Cc1ccc(CN2C[C@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2=O)cc1 917832270 RAEKBKIHFPIWEX-FGZHOGPDSA-N 448.567 2.362 10 20 IECD Cn1cnc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1Cl 917912088 MJJXWBIWGCXOSM-UHFFFAOYSA-N 438.859 2.407 10 20 IECD CC(=O)N1c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc2C[C@@H]1C 919730264 VVBRQQQTFYELOR-INIZCTEOSA-N 429.542 2.299 10 20 IECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 919783347 UGTKSTRJQVQPAE-SFHVURJKSA-N 428.512 2.263 10 20 IECD CN(C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCCc2ccccc21 920637043 XNOKMMCBZKORTA-SFHVURJKSA-N 432.498 2.457 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3ccccc3NS(C)(=O)=O)cc2F)CC1 1322691431 IIXALBDYGVODPP-UHFFFAOYSA-N 448.564 2.198 10 20 IECD Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1781723481 PHGZMENQJZSALB-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1CNc2ccccc2O1)c1cc(O)nc(O)c1 1798367935 MDCCGQFINBEYIY-YYIAUSFCSA-N 438.484 2.008 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CC1)C2)c1cc(O)c(O)c(Cl)c1 1799769276 FQFRHRXAZVKFLJ-GNXNZQSNSA-N 448.825 2.297 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnc2ccccn12 1804286530 UASGZFUFSBNAHK-FJXIAYRNSA-N 448.479 2.416 10 20 IECD Cc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804331753 JXSUBZROJRARER-BJWYYQGGSA-N 431.583 2.036 10 20 IECD CCc1noc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725995 QVMOYPALYNZQMU-NSHDSACASA-N 443.485 2.348 10 20 IECD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250279 HDNARZYWKBDSNU-UHFFFAOYSA-N 441.875 2.082 10 20 IECD C[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccc(O)cc1 1845184406 YQDUQYDKZUTNPY-KRWDZBQOSA-N 446.507 2.492 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc(Cl)n1 1848265916 DVTBXBBGJMDMAU-MCXNIAKKSA-N 443.887 2.310 10 20 IECD Cc1ccccc1C(=O)NC1CCN(C(=O)COC(=O)c2ccc(C)c(O)c2O)CC1 727004849 WPAZQWIYVNPXJP-UHFFFAOYSA-N 426.469 2.292 10 20 IECD COC(=O)c1sc(NC(=O)COC(=O)c2ccc(C)c(O)c2O)c(C(=O)OC)c1C 727005115 GUNAIZKFJLUZED-UHFFFAOYSA-N 437.426 2.145 10 20 IECD Cc1cc(C(=O)COC(=O)CN2CCC(=O)NC2=O)c(C)n1-c1ccc(OC(F)F)cc1 733560704 LLYXZFGGJWDBOX-UHFFFAOYSA-N 449.410 2.363 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1 734687597 LCCNMPZRLJPWJB-UHFFFAOYSA-N 441.551 2.457 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CC3(N4CCOCC4)CCCC3)CC2)cc1 735876195 NNJCXPDCHCUVEZ-UHFFFAOYSA-N 444.620 2.359 10 20 IECD C[C@H](NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)c1ccc(N2CCOCC2)cc1 742376206 FXLZABJOKUEOLJ-QTWZMDIBSA-N 432.590 2.426 10 20 IECD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742632657 HOUFKJXOEDRPDS-QGZVFWFLSA-N 446.529 2.337 10 20 IECD O=C1CCc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 743195502 ZYZHKXZIQDBZHT-UHFFFAOYSA-N 428.514 2.128 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)CC2)cc1F 753858974 YRKZYJDBGPLKBB-UHFFFAOYSA-N 432.408 2.232 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1 758965826 SCCXCACIQJIQDV-UHFFFAOYSA-N 429.484 2.479 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCCN3C(=O)C(C)(C)C)CC2)cc(OC)c1OC 759240508 TVLVVADZIMKDOA-QGZVFWFLSA-N 433.549 2.398 10 20 IECD COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 760193175 CSETWVUUMZEYMV-UHFFFAOYSA-N 447.557 2.182 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](C)NS(=O)(=O)c2cccnc2Cl)c1 761966885 BCQVOWQVMVHRSB-NEPJUHHUSA-N 427.910 2.384 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3csc(S(C)(=O)=O)c3)CC2)cc1 766309465 ZQVVEFJZLIRHSN-UHFFFAOYSA-N 437.587 2.102 10 20 IECD Nc1cccc(S(=O)(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 768809877 BQKXZKLKLLFGDC-UHFFFAOYSA-N 442.520 2.003 10 20 IECD CS(=O)(=O)CCCCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775983448 MTSUPVUSDHOIMR-UHFFFAOYSA-N 446.572 2.199 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCN(C4CCCC4)CC3)CC2)cc1 778286975 GNOPJEHLTWSBPJ-VAWYXSNFSA-N 440.588 2.377 10 20 IECD CCN(C[C@H](O)C(F)(F)F)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 779521437 ZNTIJMINYIFBBY-SFHVURJKSA-N 432.487 2.162 10 20 IECD C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 780312815 SMOZJQSKUSEYAH-RCCFBDPRSA-N 436.572 2.426 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 781270314 IPRJWLMRZTWGMW-UHFFFAOYSA-N 444.557 2.214 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1 785294866 OVRQRUFIXJXPLK-BZUAXINKSA-N 427.501 2.397 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1 785296820 IOSOOXFXCVECCV-HNNXBMFYSA-N 448.479 2.109 10 20 IECD O=C(NCCCCOc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785599451 OPDSWCGWOQOCQO-UHFFFAOYSA-N 447.482 2.393 10 20 IECD CN(C)c1ncccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787631191 IOEWBOLFMALPKE-MRXNPFEDSA-N 447.486 2.150 10 20 IECD COc1cccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789843632 AYFXYTDZAYATIA-UHFFFAOYSA-N 429.492 2.070 10 20 IECD O=C(NCCOC1CCCC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793679198 YYJMJKXOJHBVLH-UHFFFAOYSA-N 425.476 2.448 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](Cc3ccccc3)CN(C)C)CC2)cc1 793721774 ZISKVLIGZKBZKB-OAQYLSRUSA-N 438.572 2.069 10 20 IECD CN(Cc1ccc(Cl)s1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793721836 JMDNKTNQEGZILH-OAHLLOKOSA-N 448.976 2.378 10 20 IECD CC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793726152 RXZIKYAMNWFEML-SFTDATJTSA-N 436.556 2.142 10 20 IECD NC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 798441406 WFCPEDRBHTVCQD-UHFFFAOYSA-N 441.912 2.018 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCN(C4CC4)CC3)cc2F)C[C@@H](C)O1 801874556 GJTVHZAHPTYCTC-IAGOWNOFSA-N 447.551 2.473 10 20 IECD CC(C)(C)CN(CCO)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448303 NXHJQHYPUOPUOE-UHFFFAOYSA-N 427.492 2.240 10 20 IECD CCOC1CC2(CCN(C(=O)/C=C/C(=O)N3CCN(c4ccc(OC)cc4)CC3)C2)C1 804629677 FDPONYDWZYYSKP-CMDGGOBGSA-N 427.545 2.318 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cc(C)no3)cc2F)CC1 805008737 APYJHSPUESUQKY-HXUWFJFHSA-N 443.523 2.244 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(c2nnc3n2CCCC3)CC1 806279249 JGXYGQSNEJYWSN-UHFFFAOYSA-N 434.591 2.076 10 20 IECD O=C(N[C@H]1CCC[C@H]1CCO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768166 DMISUULGHBJIHC-DAYGRLMNSA-N 425.476 2.040 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cc1 808568544 MHRWUTCQPYJPMC-IBGZPJMESA-N 444.482 2.349 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Cl)c2nonc12 814384429 MFPSFWYLFYGJKZ-UHFFFAOYSA-N 440.884 2.455 10 20 IECD COc1ccc(N2CCN(CCNC(=N)NCc3ccc(OC)c(OC)c3)CC2)cc1 849067209 NTXUOHLBBVJCSE-UHFFFAOYSA-N 427.549 2.149 10 20 IECD COc1cccc(CO[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337851 PNLBZHYYBGSMEP-QGZVFWFLSA-N 432.542 2.152 10 20 IECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1-c1ccccc1[N+](=O)[O-] 919860250 RJCOYEXSTJPQLJ-UHFFFAOYSA-N 449.467 2.216 10 20 IECD CN(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919968780 WNBNZMQLNNANKI-UHFFFAOYSA-N 431.558 2.076 10 20 IECD CC(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919969792 YYUMPRKPDQFCCG-UHFFFAOYSA-N 449.548 2.404 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 920926468 PJFILBWMDZILIF-INIZCTEOSA-N 425.485 2.434 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C 1320692648 NLRPGSDGTZVVAU-HOTGVXAUSA-N 436.505 2.478 10 20 IECD CC(C)(O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121506 YZHVRLUSRMFPOE-IIBYNOLFSA-N 440.924 2.040 10 20 IECD Cc1cc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)no1 1782007619 VKBCYLMWURKYAS-ATKOVBFVSA-N 447.875 2.205 10 20 IECD Cn1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1800715311 JCLCLEIXEJDSNL-MUJYYYPQSA-N 432.908 2.369 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c(C)n1C 1807994969 MBYPREZRVVQEBZ-VGSWGCGISA-N 449.511 2.477 10 20 IECD Cn1nncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290590 BJOKCWZBOIBKEM-CYBMUJFWSA-N 445.867 2.223 10 20 IECD Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497287 BUKIQGJPZGXWLF-CQSZACIVSA-N 446.558 2.212 10 20 IECD CO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717572 NHAYURQYPNCLLL-UTKZUKDTSA-N 440.544 2.434 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CC[C@H]2CNc3ccccc3C2)C1 1842955011 ABAZUQYQSIBNPI-MRXNPFEDSA-N 436.512 2.374 10 20 IECD O=C(c1ccnc(Cl)c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441408 SZBLWXHBDOUBOC-UHFFFAOYSA-N 437.887 2.345 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H]2CCC(=O)NC2)cc1 1847321168 KOTMBHHYWPZWIQ-BVSLBCMMSA-N 434.540 2.436 10 20 IECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)NC(=O)NCc1ccco1 10877442 JMZLXXGOIZFNRP-UHFFFAOYSA-N 432.388 2.238 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 437012074 YOEKIGOJPMGDFW-SFHVURJKSA-N 445.541 2.249 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@@H](O)COc3ccc4c(c3)OCO4)CC2)cc1 726714180 UPGNNMADFVUXSI-GOSISDBHSA-N 443.500 2.132 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc2c(c1)OCCCO2 738884788 JNMMPQQPYXTHPM-UHFFFAOYSA-N 431.514 2.404 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccccc3OC(C)C)CC2)cc1 743432772 QYGWJDFKTBCEOX-UHFFFAOYSA-N 440.544 2.359 10 20 IECD C[C@@H](OC(=O)c1ccc(C(N)=O)o1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747173942 CRJVRRSNBGVHFW-LLVKDONJSA-N 432.388 2.338 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1O 750819572 REBKCFLWYFMAES-UHFFFAOYSA-N 432.477 2.117 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)o1 751354073 NQIHQNRISVPIML-BETUJISGSA-N 439.509 2.179 10 20 IECD CCCN(CC(=O)OC(C)(C)C)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 756871148 NMHIOWRSCZYUIE-QXMHVHEDSA-N 445.560 2.480 10 20 IECD COc1cc(N2CCN(CN3C(=O)NC4(CCCCC4)C3=O)CC2)cc(OC)c1OC 758964958 PPFNYIIYKYMJGX-UHFFFAOYSA-N 432.521 2.047 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)cc([N+](=O)[O-])c1 765747013 JTALUZJXBPDMRV-UHFFFAOYSA-N 429.248 2.396 10 20 IECD C[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 769710589 CFXXIISMUZZZEQ-FUHWJXTLSA-N 428.512 2.309 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(OCC(=O)NC)c(OC)c3)c2)CC1 770149502 YWAJIDDUFKTZEN-UHFFFAOYSA-N 426.517 2.214 10 20 IECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 771491148 FNBXRZSTKQYVGC-IBGZPJMESA-N 434.543 2.217 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4cncn4)CC3)cc2F)C[C@@H](C)O1 778226272 PXHPCFFSOWXVJE-QZTJIDSGSA-N 444.555 2.059 10 20 IECD CCOC(=O)c1c(NC(=O)CN2CCO[C@@H](C(=O)NC)C2)sc(C)c1-c1ccccc1 782097425 BDXZUTFXYZYETK-MRXNPFEDSA-N 445.541 2.286 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 782634058 FQKSJQAFALISIR-UHFFFAOYSA-N 426.473 2.427 10 20 IECD Cc1cc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1[N+](=O)[O-] 783379148 QNXPAPQALPPJBN-INIZCTEOSA-N 428.397 2.345 10 20 IECD COC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)O1 784071502 QFKXTBHJBJXZRQ-WMLDXEAASA-N 431.455 2.487 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)cc1 785422963 RRNVUBYXSXDVBC-KDURUIRLSA-N 430.549 2.369 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3c(F)cccc3Cl)CC2)cc1 785439423 OZDKYOCCZILPLE-UHFFFAOYSA-N 446.910 2.146 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)nn1 786018803 DMIMDSFXCFJQBJ-GJZGRUSLSA-N 430.480 2.319 10 20 IECD Cn1cnc(-c2cccc(OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)n1 788791397 MAFIGMUQKWKPBE-UHFFFAOYSA-N 425.464 2.153 10 20 IECD CCCN(C[C@@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842614 FFQVLRMFHYEAEB-IBGZPJMESA-N 435.540 2.211 10 20 IECD COCc1ncc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)s1 795477343 VWKGOILFBOWXQI-UHFFFAOYSA-N 442.520 2.475 10 20 IECD Cc1cc(C(=O)CN2C[C@@H](N3CCCC3)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796427519 DHXWITJVZLLPIN-UZLBHIALSA-N 444.601 2.483 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c(OC)c1 800596976 JOWJHMMYAIVFJG-UHFFFAOYSA-N 431.464 2.243 10 20 IECD C[C@H](Sc1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(N)=O 800854008 IIAUHWRZNYAYNB-DOTOQJQBSA-N 440.569 2.284 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1 807103001 KHKRRDHRKRLLNZ-UHFFFAOYSA-N 440.519 2.237 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O 807290812 AIUUNTWIRZYXQK-QHCPKHFHSA-N 446.551 2.029 10 20 IECD Cc1ccccc1CC(=O)N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807672375 YFKHSKPFHDWOAF-LJQANCHMSA-N 436.556 2.152 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC[C@H]1C 807771065 RGIFDVHWOWEWFB-RVKKMQEKSA-N 425.476 2.256 10 20 IECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C[C@H](C)O1 807954406 QYVUZNNYYSQIQJ-BQFCYCMXSA-N 437.968 2.455 10 20 IECD C[C@H](c1ccccc1)[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(N)=O 813590571 NYJZHBZRRDXWIH-QVKFZJNVSA-N 428.508 2.244 10 20 IECD COc1ccc2c(=O)c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c[nH]c2c1 918372099 LCJDPAZSDXXCPU-INIZCTEOSA-N 434.496 2.168 10 20 IECD COc1ncccc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919060227 WKZWLJVPDWQQTM-GASCZTMLSA-N 431.464 2.316 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccc4c(c3)OCO4)CC2)cc1 920252091 IGDAHRBSKSWHHL-KTKRTIGZSA-N 437.496 2.287 10 20 IECD COCCN1C(=O)/C(=C/Nc2ccc(-c3cn4ccsc4n3)cc2)C(=O)NC1=S 920978632 NKDIWRKXBZEUNV-GXDHUFHOSA-N 427.511 2.248 10 20 IECD Cc1cc(C(=O)N(C)CCNS(C)(=O)=O)c(C)n1-c1ccc(Br)cc1 1318456140 YMPAPVVOPPTFJB-UHFFFAOYSA-N 428.352 2.478 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 1342915937 NJMIPIPDJPPGIS-JYJNAYRXSA-N 436.505 2.382 10 20 IECD Cc1cc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)ccc2[nH]1 1782537432 VEEZYJBBWBEEIB-QHCPKHFHSA-N 436.468 2.040 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(F)c1)C1=NN(c2ccccc2)C(=O)C1 1793790088 QXDOLEOHJREXFI-VBUUOAMHSA-N 435.459 2.265 10 20 IECD CCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1794598297 QVMKONVHKVAXGG-CCWDJLKJSA-N 445.903 2.226 10 20 IECD CNCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877449 LUXLYWLNIMACKV-RQMBKDMJSA-N 445.560 2.436 10 20 IECD Cc1cc(C(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c(C)n1-c1ccc2c(c1)OCCO2 10601801 JWAPYKGPVBEGMV-UHFFFAOYSA-N 425.441 2.247 10 20 IECD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 108871617 UWUPUKPOLBRZFR-UHFFFAOYSA-N 447.557 2.369 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(NC(C)=O)cc3)cc2F)CC1 303322063 RKXGRIYBQHPWOU-UHFFFAOYSA-N 434.537 2.405 10 20 IECD Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 303802905 SULURAUKWUMLNI-QHCPKHFHSA-N 434.544 2.290 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 728208611 OXUHRFOVSNOBCN-IBGZPJMESA-N 445.589 2.344 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCN(c3nc(C)ns3)CC2)c1 743385489 JJJUPNVMMSBBFP-UHFFFAOYSA-N 445.589 2.299 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCC[C@H](O)C1 745738084 SQLZZLWPTRTHJD-HKUYNNGSSA-N 442.539 2.293 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1)c1ccc(N2CCOCC2)cc1 746382245 RBDCKRPHLLEPEB-ZDUSSCGKSA-N 425.411 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@H](C)N3CCCCC3)CC2)cc1 753286507 MZLGFQHTWRDTBB-CFGKVWFZSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3ccc([S@@](C)=O)cc3)CC2)cc1 754163782 HSOUTMGJBLPVGH-QIUKKZFLSA-N 431.602 2.266 10 20 IECD COc1cc(N2CCN(C(=O)NCCN(C)CC(F)(F)F)CC2)cc(OC)c1OC 759265431 MJNYBBAPCYPXQC-UHFFFAOYSA-N 434.459 2.038 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1 769281256 UVHJDXFDJUOCTC-QGZVFWFLSA-N 438.933 2.237 10 20 IECD COCCN(CC(=O)O)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 769464599 PUDSEZCNHFSRDR-JLHYYAGUSA-N 428.557 2.289 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1 774363091 HTWOUXSPJKQOMK-UHFFFAOYSA-N 447.491 2.368 10 20 IECD CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCN(CC)CC3)c(F)c1)CC2 776137808 ZVYKCVVXZLVEEB-FGZHOGPDSA-N 448.583 2.429 10 20 IECD COc1cc(CN2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc(OC)c1OC 779530613 SZWFMLSMQRTKHH-FNORWQNLSA-N 428.485 2.481 10 20 IECD CCOC(=O)c1c(NC(=O)C(=O)N(C)Cc2ccccc2O)cc(OC)c(OC)c1OC 781448501 NDOJFDZULCCTJP-UHFFFAOYSA-N 446.456 2.192 10 20 IECD CC1CCN(CCCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 787896718 YKOSKGFBGKNPDN-FQEVSTJZSA-N 430.593 2.329 10 20 IECD CCn1cc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C(F)(F)F)n1 797934085 LFTRQHCZMKZXHU-UHFFFAOYSA-N 440.422 2.436 10 20 IECD Cc1cc(C(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)c(C)n1-c1ccccn1 799740739 APNWTIAVRVBKBF-UHFFFAOYSA-N 434.468 2.476 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N(Cc3ccc(-n4cncn4)cc3)C3CC3)ccc21 803688391 YIQRRVYTTVMPCH-UHFFFAOYSA-N 444.539 2.457 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCCc2c[nH]nc21 806427602 LJBAJFKRQIPXEH-WMLDXEAASA-N 433.459 2.290 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1F 807385898 TVVTUSWNUUQLSZ-UHFFFAOYSA-N 443.200 2.474 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1[N+](=O)[O-] 814330948 SVVXUASWYUHDAT-UHFFFAOYSA-N 431.514 2.424 10 20 IECD CN(Cc1cnn(C)c1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913674835 JYZLJIZCVIELHQ-UHFFFAOYSA-N 445.457 2.107 10 20 IECD CC(C)CCN(C(=O)/C=C\c1cnn(C)c1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 917108876 XOHIMNBGMBCBNX-KTKRTIGZSA-N 436.516 2.405 10 20 IECD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917709055 PDERHCBHTQSQFR-OAQYLSRUSA-N 442.470 2.197 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC(=O)N3CCCc4ccccc43)cc2)C1 920045586 PPOLVMWOKRHINC-FQEVSTJZSA-N 449.555 2.167 10 20 IECD O=C(NCCN1C(=O)COc2ccccc21)NCc1ccc(N2CCSCC2)cc1 1320426700 RRJUVMRUZFWWGH-UHFFFAOYSA-N 426.542 2.465 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1 1324121723 SOECPCVNVGZGLD-BBRMVZONSA-N 448.422 2.020 10 20 IECD COCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@H]2C1 1790126222 GBWUEQUXSDZCBB-BVSLBCMMSA-N 425.529 2.334 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnccc1C(F)(F)F 1796599540 WHMLPDWPGVSBKT-CLLJXQQHSA-N 436.390 2.472 10 20 IECD O=C(C[C@@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601069 SMOQBVJFEQVDGW-DMUMMCEESA-N 437.496 2.449 10 20 IECD Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816721477 LVRKJYJCPDGEJP-LBPRGKRZSA-N 425.470 2.192 10 20 IECD O=C(CCCn1cccc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729223 YAGTVFAAXMQLBS-AWEZNQCLSA-N 441.513 2.457 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc2ccnn12 1821398048 SHNQSWCMFYIELO-INIZCTEOSA-N 447.455 2.483 10 20 IECD O=C(Cc1ccccc1O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822011662 QBKWCGQBDQACJU-MRXNPFEDSA-N 437.456 2.470 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(Cc4cnn(C)c4)CC3)cc2F)C[C@@H](C)O1 730064868 PXHWSWCTAWWSFI-HDICACEKSA-N 444.555 2.200 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3N3CCOC3=O)CC2)cc1 737137191 ADDZFUHWAQLCQS-UHFFFAOYSA-N 438.484 2.329 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 741097780 YPLBCKXPPIFJSO-UHFFFAOYSA-N 448.523 2.319 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3nnnc3C(C)C)c2C)cc1 747032006 XVIMUXJQTLKTLN-UHFFFAOYSA-N 439.472 2.417 10 20 IECD CCC[C@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748321529 FDRBBBDVSFPVKI-IBGZPJMESA-N 437.474 2.382 10 20 IECD CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 751351896 ZYKSTKSONBHPSJ-WMZOPIPTSA-N 448.589 2.315 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCCOc3ccc(S(N)(=O)=O)cc3)cs2)cc1 751937713 UKCQWGDONPBZSW-UHFFFAOYSA-N 433.511 2.199 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(CC4CCCCC4)CC3)CC2)cc1 754020177 RJVSELKZVXZHSO-DEOSSOPVSA-N 430.637 2.376 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@]4(CCc5ccccc54)C3)CC2)cc1 754071354 PXXVEVWZNOGTKT-ZEQKJWHPSA-N 437.584 2.352 10 20 IECD CCOC(=O)C1(N(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 754072344 TYYBFMFUGLRKFT-OAQYLSRUSA-N 433.593 2.376 10 20 IECD CCCCN(C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 756335181 GCZZPINQDUSZAG-PMACEKPBSA-N 438.590 2.189 10 20 IECD COc1cc(N2CCN(C(=O)CN(C)C(=O)c3cccs3)CC2)cc(OC)c1OC 759222652 VBKMEQVSBVOKEL-UHFFFAOYSA-N 433.530 2.195 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CN(CCc3ccccc3)C(C)=O)CC2)cc1 761406033 WOYZDBWBWUBPCT-UHFFFAOYSA-N 438.572 2.025 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)CC3CC3)cc2F)C[C@@H](C)O1 765680751 ZCQCMMBFKIGTFQ-HUUCEWRRSA-N 427.542 2.063 10 20 IECD O=C(OCc1nnnn1CC1CCOCC1)c1cccc2c1C(=O)c1ccccc1C2=O 768374096 QBIWHIVJUKZCQC-UHFFFAOYSA-N 432.436 2.232 10 20 IECD Cn1cnc(-c2cccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)n1 771786352 WMRMHJBBGLADMJ-UHFFFAOYSA-N 440.529 2.039 10 20 IECD CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC(=O)NCCN2CCOCC2)cc1 772694236 SUOCZTUINSNYTJ-UHFFFAOYSA-N 438.532 2.346 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccccc3C(=O)N(C)C)CC2)cc1 778238243 MKDQWXMJYZKVEE-SEYXRHQNSA-N 436.512 2.241 10 20 IECD CCn1nc(C)c(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778254628 PBVSCPABUZLFRD-ZHACJKMWSA-N 425.533 2.050 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@](C)(O)c3ccc(F)cc3)CC2)cc1 778402653 PYPGCLTZKFSBIV-LCJITAHGSA-N 441.503 2.063 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3ccc(C)cc3C)CC2)cc(OC)c1OC 787296651 AAAHSHDVDXJGHY-UHFFFAOYSA-N 441.528 2.294 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H](COC)Cc1ccccc1 788318910 JISZWNSWDCXASB-HSZRJFAPSA-N 439.556 2.246 10 20 IECD CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788909696 GXJBHSGWCXEKJW-IBGZPJMESA-N 430.549 2.371 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(N4CCC4=O)c3)CC2)cc1 791183764 GQNPGIKGGZEQLE-MDZDMXLPSA-N 434.496 2.275 10 20 IECD CNS(=O)(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 799995484 LQYNGRJCGYBWEV-GOEBONIOSA-N 428.986 2.409 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1F 803662167 SWQWIEAPYYXGPP-QGZVFWFLSA-N 445.470 2.070 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1F 803663010 QYMNFKOBRZTVEP-FQEVSTJZSA-N 427.455 2.286 10 20 IECD C[C@H](CN1CCOCC1)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677091 FRIHQJOMNXOMDB-LJQANCHMSA-N 430.593 2.251 10 20 IECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 806736766 OSOATCLZVJSIQD-CYBMUJFWSA-N 438.502 2.279 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCC[C@H](C)CC3)CC2)cc(OC)c1OC 806965523 JNAPMXKKAQNDIU-IRXDYDNUSA-N 433.549 2.446 10 20 IECD COc1ccc(CNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)c(O)c1 807455116 YRVPSWJOGZMAFL-UHFFFAOYSA-N 448.328 2.485 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1 808032456 XJOFIXIWXRPGLO-IEBWSBKVSA-N 432.565 2.474 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(CO)C[C@@H]3c3ccccc3)cc2)C1 812011330 ZFEZIIXRBAYFDT-QFZWGZQFSA-N 436.556 2.354 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cn(Cc4ccccc4)nn3)CC2)cc1 815458694 AHIVNGUAFAKOJR-UHFFFAOYSA-N 434.500 2.059 10 20 IECD CCN1C[C@H](C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914912242 VDRCMASIYFPGLY-ZIAGYGMSSA-N 434.448 2.201 10 20 IECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 917918521 SSBIPQWJXWQBIP-UHFFFAOYSA-N 425.438 2.058 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)COc3ccccc3)cc2F)C[C@@H](C)O1 918140191 KGGVITSVDWRUHG-CALCHBBNSA-N 429.492 2.251 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H](c1cccs1)N1CCOCC1 919790952 USMWTHXBJIWIIB-HXUWFJFHSA-N 430.574 2.457 10 20 IECD C[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(N2CCOCC2)cc1 920870531 MFZFDGPDNFKNCG-GOSISDBHSA-N 445.589 2.027 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)c2C)cc1 925670006 FJOCHCKFTMZHRP-DLBZAZTESA-N 427.501 2.372 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccsc1)C2)c1cc(O)nc(O)c1 1777848471 VLHWTCKYBDNJLR-VGOFRKELSA-N 445.541 2.315 10 20 IECD CCCc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1780844841 UNQXXNCUZNTYBL-HSZRJFAPSA-N 425.485 2.203 10 20 IECD CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)CC1 1783370807 QLCSTDXUYPUIFB-SEPYTNNBSA-N 431.533 2.399 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ncccn3)cc2)CCC1 1787437415 MBEBTFYYUJGXOH-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990062 DGQQYPFQMNLSJL-VLIAUNLRSA-N 437.431 2.055 10 20 IECD COC1(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1807998815 ONZASRGJYBSZNK-IIBYNOLFSA-N 440.500 2.167 10 20 IECD CO/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901119 CBTXUBNLPKEFFF-WCRPCQDQSA-N 439.603 2.017 10 20 IECD Cc1c(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)oc2ccccc12 1843687246 PKTPDAWKTYWECS-UHFFFAOYSA-N 443.550 2.419 10 20 IECD CN(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847038637 XECKSEODFPEGCV-YRNVUSSQSA-N 437.496 2.400 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccccc2CN2CCOCC2)n(C)c2ccccc12 578343280 JLLXQXCRLVIMEI-UHFFFAOYSA-N 434.540 2.252 10 20 IECD C[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc2O1 730018568 XOYRNMBRVQEPIF-NVXWUHKLSA-N 429.542 2.190 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 730811050 ZHFIHPDTMNNBNN-UHFFFAOYSA-N 448.419 2.400 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(S(=O)(=O)NCCOC)c1 735587376 UNOHUYOJBMCHBG-UHFFFAOYSA-N 448.589 2.409 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc([S@](C)=O)c3)cc2F)C[C@@H](C)O1 737107627 NJNIQNQJSHGXLF-LELMWSPKSA-N 447.532 2.432 10 20 IECD CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)CC(N)=O)cc3)cc2)CC1 742648850 DTELGMLWMUEIFL-UHFFFAOYSA-N 429.542 2.112 10 20 IECD Cc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 745389219 YUFLKCSKGUESIJ-UHFFFAOYSA-N 431.420 2.352 10 20 IECD CCOC(=O)c1c(NC(=O)c2cn(CC(N)=O)nn2)sc(C)c1-c1ccc(F)cc1 749317266 SITNTPMTRPFPPT-UHFFFAOYSA-N 431.449 2.368 10 20 IECD O=C(CN1CCC(N2CCCNC2=O)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 749543515 CLJAZMBVEXFLIZ-UHFFFAOYSA-N 446.507 2.280 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1 755792427 YJECZJQGYYKWKI-LJQANCHMSA-N 435.546 2.417 10 20 IECD Cc1ccc(O)c([C@@H](C)NCCOc2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc2)c1 756787903 SUNHUPPFTFYHMI-OAHLLOKOSA-N 442.559 2.156 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(C(F)(F)F)nc1 761871706 MOADEJONCPSPEZ-UHFFFAOYSA-N 426.370 2.331 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769327778 MDWLYWCBZFWQEV-IBGZPJMESA-N 447.580 2.244 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773848407 WQKISVAYRYRIAC-ZDUSSCGKSA-N 448.520 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3ccc(OCCO)c(OC)c3)CC2)cc1 775190617 ARJZVZFFKSJLPN-GOSISDBHSA-N 443.544 2.074 10 20 IECD CCOc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCOCC1 779474532 AJUCUVYTYHPCQU-YWEYNIOJSA-N 448.497 2.169 10 20 IECD C[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1 784362852 WFEXBLPSOZUJCS-BWAGFHJFSA-N 427.545 2.142 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 785305066 UUXWUOIDZDZPJA-AWEZNQCLSA-N 437.496 2.473 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)cc1F 785589536 ZYEIYFAWTOXYKX-UHFFFAOYSA-N 440.519 2.450 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cc(Cl)c4c(c3)OCCO4)ccc21 787882346 ZLXDVKZABPKANY-UHFFFAOYSA-N 429.904 2.426 10 20 IECD CSCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949716 KGJQALJMXRERGM-CYBMUJFWSA-N 433.496 2.416 10 20 IECD CSC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 789950871 RWIUKEGWYIPHGW-UHFFFAOYSA-N 431.480 2.170 10 20 IECD Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)c4cccc(O)c4O)CC3)cccc2c1 790530771 DFNWYWREIWIEJB-UHFFFAOYSA-N 427.482 2.101 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc(S(=O)(=O)CC)cc3)nc12 792946944 FZPVIYQIPBQCGK-ZDUSSCGKSA-N 432.502 2.256 10 20 IECD COc1c(NC(=O)C(=O)NCCCSc2nccs2)cc(Cl)cc1C(N)=O 792999656 FIVWVUVEJKQWNO-UHFFFAOYSA-N 428.923 2.141 10 20 IECD C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662064 GNFOGUASKMLZGC-ZBFHGGJFSA-N 436.528 2.270 10 20 IECD C[C@@H]1OCC[C@@]12CN(C(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)CCO2 803676558 MIKUPKUXMNFUAZ-MHECFPHRSA-N 429.561 2.478 10 20 IECD COC(=O)c1cc(C(C)(C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 812009710 RMDWLNRUBSMURE-UHFFFAOYSA-N 434.468 2.296 10 20 IECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cc1 812561685 BMFKEZOMNYZBGI-UHFFFAOYSA-N 437.524 2.193 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1 918309960 HWWVZVCIRVUZNE-UHFFFAOYSA-N 436.512 2.469 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC(F)F)cc3)cc2)C1 918463651 MRKSYLBOPMQRBG-OAHLLOKOSA-N 446.454 2.245 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 920340302 KWISNNCERMZPES-UHFFFAOYSA-N 434.518 2.378 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 920926717 UDDLAOQCMDRHOV-INIZCTEOSA-N 434.500 2.228 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CN2CCCC2=O)cc1 1254761719 SQPDHYUHGALTOZ-SFHVURJKSA-N 426.469 2.124 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1F)CCO2 1782000824 BYRHCIYQXAIHBS-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccn4cncc34)CC2)C1 1810547454 XWFCTTGGXZAKEJ-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(/C=C/C1CC1)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1814906267 GJCSZRMQWPHMFX-UZYOAWRESA-N 433.559 2.228 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1cc(O)nc(O)c1 1817843981 LWNIACWIRGSNBW-HNNXBMFYSA-N 426.408 2.370 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)nn2)[nH]n1)c1cc(O)nc(O)c1 1817846269 OEWKVJDZHLHBQA-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD CC(C)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825146823 UPCSGNXAZQXCGB-NSHDSACASA-N 440.616 2.352 10 20 IECD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)no1 1827428717 DWAJWAFRDAMGJH-GOSISDBHSA-N 428.489 2.265 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832845823 MRHWXRSNHHVQHF-OALUTQOASA-N 446.548 2.031 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874686 DNIHICFFKWNORP-SLLDUXSESA-N 446.544 2.453 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3c(c2)OCO3)C1 1843625532 CDMXOAYABUQRAY-UHFFFAOYSA-N 446.463 2.025 10 20 IECD O=C(c1cnccc1Cl)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038150 BBIUBCLUCFYCED-HWKANZROSA-N 429.860 2.382 10 20 IECD COc1cccc(CNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)c1O 727761172 MDYINFZUALWECI-UHFFFAOYSA-N 443.319 2.148 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)Nc1cnn(CCN2CCOCC2)c1 747563082 QRICDZATPLNJEA-UHFFFAOYSA-N 430.578 2.090 10 20 IECD C[C@@H](CC(N)=O)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 748718263 HOQHCJCYNFAKQX-SZUMLMDFSA-N 442.360 2.030 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3c(-c4ncccn4)noc3=O)c2C)cc1 749357274 KGQPWZROJMJDDK-UHFFFAOYSA-N 433.424 2.370 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C(=O)N(C)OC)cc3)CC2)cc1 749632748 HSONLIYWMPGOHV-UHFFFAOYSA-N 440.500 2.006 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751042944 IKHRUUUBBKBXLO-ZDUSSCGKSA-N 439.921 2.398 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCN4C(C)=O)CC2)cc1F 754212155 GNBJBDLDHLYWIQ-UHFFFAOYSA-N 440.475 2.031 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)CC4(CCC(C)CC4)C3=O)CC2)cc1 758219860 KMXWJMUYGPRZQS-WLBKGHODSA-N 429.561 2.134 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1 760992664 BBINGOXNQXCXAK-UHFFFAOYSA-N 431.470 2.055 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4ccc5c(c4)CCO5)C3=O)cc2)C1 761123857 PLNZTVAKVNDBPU-NQIIRXRSSA-N 434.496 2.116 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN(C)CC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)cc1C 764315404 WLBCCNVLVPDKOS-LJQANCHMSA-N 445.585 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H](C)S(=O)(=O)C3CCOCC3)cc2F)C[C@@H](C)O1 764927562 ZOYNNVOCMGURBA-OWCLPIDISA-N 442.553 2.038 10 20 IECD COC(=O)CN(Cc1ccc(S(=O)(=O)N(C)C)cc1)Cc1cc(Cl)ccc1O 766250290 KQZAKYTYOFWPPH-UHFFFAOYSA-N 426.922 2.471 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(Br)nc1 766341650 CJJFIQDDNIXUBF-UHFFFAOYSA-N 433.306 2.278 10 20 IECD C[C@@H](NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccc(N(C)C)cc1 773016347 BPYPBQPRSDQZOO-OAHLLOKOSA-N 437.587 2.255 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)CCc3ccco3)CC2)cc(OC)c1OC 775225165 ORMGMOCJBIFROS-INIZCTEOSA-N 445.516 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3ccccc3Cl)CC2)cc1 778327853 HEHSZIYWFCZSFK-XPTLAUCJSA-N 443.931 2.403 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4cc(OC)c(OC)cc4C3)CC2)cc1 779219619 VUUMCWOLJZGBOG-QFIPXVFZSA-N 441.572 2.254 10 20 IECD Cc1cc(C)nc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 783000493 VLKFDEGLCJPFIV-UHFFFAOYSA-N 428.512 2.101 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1 785298581 WKZKEMOUAOACPL-JTQLQIEISA-N 445.369 2.458 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 785839385 JONXTLFNIIMHDW-OAHLLOKOSA-N 434.443 2.093 10 20 IECD CCN(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822456 AVOAKIIPVZGRLG-CALCHBBNSA-N 428.508 2.499 10 20 IECD CCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccn1 789842673 FUFOGMWMLVUDOX-FQEVSTJZSA-N 428.508 2.456 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 789845090 JXCZOXHKWWGWPR-UHFFFAOYSA-N 431.533 2.363 10 20 IECD COc1ccc(N2CCCN(C(=O)Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 793136688 HLAVJMLGVPPHMR-UHFFFAOYSA-N 431.558 2.227 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(Cl)c(C(=O)O)c2)cc1 797432744 QJMIVJYMDAUQCJ-UHFFFAOYSA-N 433.895 2.024 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H](CO)c2ccc(OC)cc2)cc1F 804851896 RPEBDEKAVYKFKX-OAQYLSRUSA-N 431.508 2.489 10 20 IECD O=C(Nc1ccccc1)NC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807289270 OJZSRLAKKSVBEH-UHFFFAOYSA-N 447.539 2.492 10 20 IECD Cc1cc(C(=O)CS(=O)(=O)CCN2C(=O)NC(C)(C)C2=O)c(C)n1-c1ccccc1 914473251 UERFQNKMBHCJSK-UHFFFAOYSA-N 431.514 2.022 10 20 IECD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)C1 917127297 BCXAGQLCCHXYLY-OKILXGFUSA-N 445.570 2.349 10 20 IECD COc1ccc(N2CCCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 917208021 WMDDKCIRMUYKEX-UHFFFAOYSA-N 440.500 2.327 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@@H]1Cc2ccccc2NC1=O 1254761221 LWBYNEFEBQGNJA-AEFFLSMTSA-N 426.469 2.279 10 20 IECD Cc1ccc([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1 1787295230 XOCLFBVFWPINQO-LQJIQPLVSA-N 439.512 2.198 10 20 IECD O=C(/C=C/c1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804634919 LJHRHAWVDPGVPW-GSBCXDHFSA-N 445.479 2.316 10 20 IECD Cc1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725865 QWZIDFMHHZSOAQ-LBPRGKRZSA-N 425.470 2.192 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cc(O)n1 1817845129 ALHYKKDDNLPVIL-OAHLLOKOSA-N 438.444 2.245 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1 1832002884 SYXRYNDTMQEBSF-KVZIAJEVSA-N 431.533 2.277 10 20 IECD Nc1ccccc1/C=C/C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038758 BCAUZVGAEPTPKO-AMMQDNIMSA-N 435.480 2.316 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCn3cnc4ccccc4c3=O)CC2)cc1 29049590 KHWLZXOBEXXHNA-UHFFFAOYSA-N 449.555 2.124 10 20 IECD C[C@H](OC(=O)CN(C)C(=O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733513272 DALKIPCUUPREJF-ZDUSSCGKSA-N 434.448 2.201 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1 743906686 PUGKBPLTYIPNHW-NSHDSACASA-N 440.435 2.209 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(OC)c(OC)c1 743958017 HJROBYCWPULBMU-UHFFFAOYSA-N 442.468 2.330 10 20 IECD CN1CCC(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 746146763 JIRAFMQINAWHJT-SFHVURJKSA-N 435.528 2.097 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnnn1-c1ccccc1Cl 748712321 GPZAUKJDDRTKFJ-UHFFFAOYSA-N 445.932 2.086 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)CC2)cc1F 753745526 OEQISOVCJNOWCW-UHFFFAOYSA-N 437.449 2.108 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)N1CC[C@H](O)C1 754356131 NEPXYKMAGJHARV-BPLGCGBFSA-N 427.345 2.244 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncc(F)cn4)CC3)cc2F)C[C@@H](C)O1 759219984 AAEULHHSUSKZSR-IYBDPMFKSA-N 446.502 2.400 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](C)NS(=O)(=O)c2cccnc2Cl)c1 761966894 BCQVOWQVMVHRSB-VXGBXAGGSA-N 427.910 2.384 10 20 IECD CCNc1nc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 770069757 MZPBOTZXNOYGKM-UHFFFAOYSA-N 436.509 2.332 10 20 IECD CC[C@](C)(CCO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 771547424 RUQITAOFXZMKCF-JOCHJYFZSA-N 430.528 2.293 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 772947045 QCCIAZMWXWFUQK-SFHVURJKSA-N 438.528 2.269 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCCCCS(C)(=O)=O)cc2F)C[C@@H](C)O1 773236258 JBULULKWDYMBDI-IYBDPMFKSA-N 429.558 2.453 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(=O)(=O)c4ccc(F)cc4)CC3)cc2)CC1 775639286 SHSBGYAITNBGCC-UHFFFAOYSA-N 432.565 2.084 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1cc(Br)ccc1=O 777827173 XAYUQNAPKUYUCZ-UHFFFAOYSA-N 443.681 2.172 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)cc(C)c3F)c2)CC1 780408091 AADHRLMAXNKYBS-UHFFFAOYSA-N 435.477 2.302 10 20 IECD COc1cc2ncn(CCCC(=O)OCC(=O)c3ccc(O)c(O)c3)c(=O)c2cc1OC 782220205 BXIVMTFQRRDBAG-UHFFFAOYSA-N 442.424 2.031 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)c3ccccc3)cc2F)C[C@@H](C)O1 785621687 GNXOXFZVECPLKO-HDICACEKSA-N 442.535 2.308 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(CN4CCOCC4)c3)cc2)CC1 787321763 JBZVWRKMRLOKRG-UHFFFAOYSA-N 436.556 2.117 10 20 IECD CCCCCNC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788911136 JHYLAQLXLFJQEW-UHFFFAOYSA-N 428.577 2.448 10 20 IECD Cc1ncc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789822093 VRGPKONTQASQPY-OKILXGFUSA-N 434.537 2.179 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)cn3)cc2F)C[C@@H](C)O1 789829028 ZZXYGTUHSCEWHL-ZIAGYGMSSA-N 434.899 2.420 10 20 IECD COc1cc(N2CCN(C(=O)Cn3ccc4ccccc4c3=O)CC2)cc(OC)c1OC 790563156 AVWIURCJPRIZNZ-UHFFFAOYSA-N 437.496 2.376 10 20 IECD CN(C)c1noc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 793853523 QWEATCRBZZXFIR-FMIVXFBMSA-N 437.572 2.495 10 20 IECD Cc1cnn(C)c1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 795280912 VLRSZOAIBCOGDC-ZDUSSCGKSA-N 438.575 2.378 10 20 IECD C[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OCO2 795925284 YTWLEMAGYQDRCS-HNNXBMFYSA-N 444.459 2.354 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)CCc3ccccc3)cc2)CC1 799371583 KMQJEYVRMZSSIM-LJQANCHMSA-N 436.556 2.109 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)cc1F 803242975 IPWVTWGTCZRBAM-OAHLLOKOSA-N 434.462 2.429 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 803388386 ZSRUKXSJRFKIPF-QGZVFWFLSA-N 426.483 2.388 10 20 IECD O=C(NCc1ccn2ccnc2c1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806987376 QWXJTRQJLQHCAA-MRXNPFEDSA-N 443.454 2.337 10 20 IECD C[C@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808854255 AKIMVVAWHCAONJ-GOSISDBHSA-N 430.618 2.046 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 809542086 CHZPTXPXZVFRFH-HBMCJLEFSA-N 427.545 2.198 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cn2n1 810349883 MXYXJZSDSAWVRA-ZIAGYGMSSA-N 440.479 2.045 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(CS(C)(=O)=O)CC3)cc2F)C[C@H](C)O1 813589474 AEOKHZLMCZBJAW-HOTGVXAUSA-N 441.569 2.406 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@H](C4CCC4)C3)CC2)cc1 817041745 KDPVDSMJSGRPFK-SQUSKLHYSA-N 427.545 2.175 10 20 IECD CC(C)(O)CONC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 819542003 LVUIIYXBSPSMOV-KPKJPENVSA-N 445.360 2.469 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 917371820 VWLVXQAOPXGRTM-UHFFFAOYSA-N 444.553 2.346 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(F)nc3)C2)C1 1779440384 OESCWTOEYACKAQ-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(CCc1c[nH]c2ncccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603436 LGDUZWHESZYHPU-BJWYYQGGSA-N 435.484 2.254 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnc(Cl)nc1 1804283571 PIHRXLNWHMAJTJ-BPQKRJORSA-N 444.875 2.212 10 20 IECD COCCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715792 SLMULCXVLNIKRA-OAQYLSRUSA-N 440.544 2.436 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2)C1 1843276983 PXKDQFIEIICFNW-HWKANZROSA-N 434.452 2.162 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cnc3c(F)c(F)ccc3c2)C1 1845687809 WXSKWFBHOFGSIK-UHFFFAOYSA-N 440.406 2.450 10 20 IECD CC(C)N1CCC(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)CC1 1847034064 ZODYNIZALUBQMH-FNORWQNLSA-N 443.544 2.140 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(CN2CCS(=O)(=O)CC2)c1 116574972 CWGBDJFZDFSOMS-UHFFFAOYSA-N 429.542 2.006 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)C3=Cc4ccccc4CC3)cc2)CC1 726976159 JEEUUZWJDUMZEB-UHFFFAOYSA-N 432.567 2.328 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc(Cl)c3c(c2)OCCCO3)SC1=S 727177499 LANJMZINVLYDNH-LCYFTJDESA-N 448.975 2.252 10 20 IECD O=C(CNC(=O)c1ccc(O)cc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 727483820 PHBBAAWPOKZVTI-UHFFFAOYSA-N 437.418 2.294 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4ccc(C)nc34)CC2)cc1 727615907 PIQBQNKIGAQLNQ-UHFFFAOYSA-N 447.539 2.429 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(OC)c(OCCO)c3)cc2F)CC1 730291255 PCMHTJOGOLPLOS-UHFFFAOYSA-N 431.508 2.277 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cc4c(nc3O)CCC4)CC2)cc1 733641827 PHNHZTMKZODHGO-UHFFFAOYSA-N 439.560 2.296 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 734639301 TYIHIZSPGQXMAA-UHFFFAOYSA-N 432.546 2.404 10 20 IECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)cc1 739922925 RKXVLZMNUVJKAI-JOCHJYFZSA-N 426.473 2.029 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(N=c2cc[nH]cc2)cc1 746136417 RAWLPNHWIKEURE-UHFFFAOYSA-N 436.537 2.412 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1 746702089 ICHNMHLOJHAFMR-UHFFFAOYSA-N 443.566 2.401 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754039930 GJGMMGGEYZIHLZ-UHFFFAOYSA-N 426.441 2.271 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc([S@@](C)=O)cc3)CC2)cc1 754050945 NMNHLIYJIJSRRP-URAOTHONSA-N 431.602 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@](C)(c4ccc(C)cc4)C3=O)CC2)cc1 758436168 PQXYZYYDWCVWFK-RUZDIDTESA-N 435.524 2.369 10 20 IECD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)CC2)C1 759587893 FSYAMJCVRGUOIV-BIENSFFJSA-N 430.501 2.151 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)c1 761966820 AMSWPZRGJRHIJP-ZDUSSCGKSA-N 440.543 2.038 10 20 IECD C[C@H](CO)N(C)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 765216270 GJTCEXGTRSXSSC-QVASGMJFSA-N 429.361 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ncn(-c5ccccc5)n4)n3)CC2)cc1 771067750 OQCPQBUMUUZMTP-UHFFFAOYSA-N 445.483 2.217 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(S(=O)(=O)NC)nc1 771409058 WTSUCELQSHJLGO-UHFFFAOYSA-N 428.308 2.120 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3CCCN(CC(C)C)C3)CC2)cc1 773000692 YVFSASNYFYZNCL-OAQYLSRUSA-N 431.625 2.484 10 20 IECD C[C@H](NC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccc(N(C)C)cc1 773995236 SAHRUMRMGVSSBH-HNNXBMFYSA-N 435.521 2.404 10 20 IECD COc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc(OC)c1Br 776050362 GSOHUWJGIXIIIS-UHFFFAOYSA-N 439.262 2.175 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](C)C(=O)NC(C)(C)C)cc2F)C[C@@H](C)O1 776849710 LVJOVSJCCKZIPP-IXDOHACOSA-N 436.572 2.291 10 20 IECD COCc1cccc(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 778521385 VDWNLFCMGUUHBF-UHFFFAOYSA-N 430.476 2.211 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C)cc(C(=O)O)c3F)c2)CC1 780407136 FPUHFMGSPCSWMH-UHFFFAOYSA-N 435.477 2.302 10 20 IECD COCCn1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 784313482 NUQUWYAHAKOMMP-UHFFFAOYSA-N 433.420 2.100 10 20 IECD CC(C)(CO)CCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787040420 NZEDMTUVUIFEGZ-OAHLLOKOSA-N 427.492 2.288 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)nc1)c1ccc(N2CCOCC2)cc1 787180248 JOPKUNGFPOPSPH-GOSISDBHSA-N 437.544 2.012 10 20 IECD C[C@@H]1CCCN(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 787671672 PAGYDRSDEZCAKE-IAGOWNOFSA-N 438.519 2.221 10 20 IECD C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309203 CWWQNGSLLDIIEL-AUMHUTNHSA-N 443.569 2.096 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H](c1cccnc1)C1CC1 789841280 WOYBTBKQUATXGT-NRFANRHFSA-N 426.492 2.066 10 20 IECD CC[C@H](C)N(C)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949830 KXXZXNMUFNAWBF-HNNXBMFYSA-N 444.498 2.005 10 20 IECD C[C@@H](NC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 793207463 HLDDNTKQEXHDRR-QGZVFWFLSA-N 431.558 2.193 10 20 IECD CC[C@H](C)[C@H](C)N(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CC1 793735143 XDXSGAFJEJUPBQ-JENIJYKNSA-N 428.577 2.430 10 20 IECD O=C(NCCN1CCOCC1)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1 802761485 NIMOVUAXFUWUPR-UHFFFAOYSA-N 442.535 2.336 10 20 IECD C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665382 ZWGKIOSIIPRXSP-GOEBONIOSA-N 436.528 2.412 10 20 IECD Cc1csc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 804502569 VEJUOMHFZNVTEN-KRWDZBQOSA-N 441.601 2.477 10 20 IECD CNc1nc(C)cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 805617022 QSHFSHBOOKUUBA-GASCZTMLSA-N 445.495 2.053 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccn2ccnc2c1 806992851 YKARPYVZDLSLOC-UHFFFAOYSA-N 431.290 2.467 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807450458 JODZACRZALQBAM-VQTJNVASSA-N 437.588 2.257 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C(=O)OC)ccc3Cl)nc12 811292013 QBEMCVSFBGSYGM-UHFFFAOYSA-N 433.804 2.409 10 20 IECD CN(C)c1ccc(S(=O)(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)cn1 811829979 WZVAZNAIINWQNG-UHFFFAOYSA-N 439.541 2.440 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](c2nc(O)n[nH]2)C1 816541781 UNCRZJBTZNBVTJ-LLVKDONJSA-N 449.514 2.098 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(N4CCCC4)nc3)CC2)cc1 916233963 RPZXPNCYVIUXTN-UHFFFAOYSA-N 438.576 2.312 10 20 IECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1ccccc1 918119192 YBIRBHWOGAMJIB-GGAORHGYSA-N 437.588 2.360 10 20 IECD Cc1cc(C(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccn1 918382663 BVMLOFKUUBTSFU-UHFFFAOYSA-N 441.532 2.298 10 20 IECD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(Cl)cc1 1792735231 GPQHAHGSFSMPRB-NZNSQFJMSA-N 445.903 2.153 10 20 IECD CC(C)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)CC1 1796141176 NBFYJFSNRLBWHE-NDJUXDTMSA-N 431.533 2.158 10 20 IECD O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807459454 NAXATOAKLUWYEO-ZHRRBRCNSA-N 435.484 2.168 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3ncc[nH]3)C2)CC1 1807826173 FPYCPUTWVZLJJC-HWKANZROSA-N 426.473 2.085 10 20 IECD CCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843897 GRPBSZQDFVATFZ-AWEZNQCLSA-N 426.433 2.386 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncon1)CC2)c1cc(O)c(O)c(Cl)c1 1823712714 VHAULTOAOBGCDA-MRVPVSSYSA-N 435.849 2.130 10 20 IECD COC(OC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832875454 LXXOXRBPACPITA-LKUPDRCFSA-N 448.516 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2n[nH]c3ccccc23)C1 1844057353 MIACRRQUQBECSS-VQHVLOKHSA-N 434.452 2.210 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 754097511 OXZULHNASXANSX-CTNGQTDRSA-N 433.593 2.089 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H](C(N)=O)c3cccc(Br)c3)cc2)C1 763376416 LGGALIPWOZAKTQ-VQIMIIECSA-N 445.361 2.467 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)cc1 768797774 NAEPLYWFKCERSI-UHFFFAOYSA-N 440.547 2.156 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)Cc3cccnc3)cc2F)C[C@@H](C)O1 771663844 BIKIBQPOWJDRGY-IYBDPMFKSA-N 429.496 2.192 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 774407221 CLGWOYNSUHPDKH-HUUCEWRRSA-N 443.475 2.101 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c1O 776043456 FDRTUMBCCYNMET-UHFFFAOYSA-N 431.342 2.330 10 20 IECD CCOc1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1CO 778390231 YTMSVQIDJVPAPN-KHPPLWFESA-N 439.512 2.430 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cccc(-n2cnnn2)c1 785191801 HRLGJOJHWBCLGA-UHFFFAOYSA-N 445.277 2.118 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CC34CCOCC4)cc2F)C[C@@H](C)O1 786456411 IJGJCCQHQJFNCA-JZXOWHBKSA-N 434.508 2.415 10 20 IECD Cc1nc(Cn2nnc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c2C)no1 787268940 AOIYSDXPTGXQAT-LJQANCHMSA-N 439.520 2.214 10 20 IECD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 787330214 VAMRYFXMUGYNAQ-MDYRTPRTSA-N 438.528 2.037 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1 788937918 OSQFTROKCWGZBN-WOJBJXKFSA-N 443.569 2.316 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC4(CCOCC4)C3)cc2F)C[C@H](C)O1 789826238 PHDPPRVIFDRBKS-IRXDYDNUSA-N 433.524 2.085 10 20 IECD Cc1ccn(C[C@](C)(O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)c1 790801741 RRFNDMJQEGYHPR-ZHRRBRCNSA-N 435.471 2.294 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2ccccc2F)C1)c1ccc(N2CCOCC2)cc1 803304659 GODXDKLDZMEIQJ-JTSKRJEESA-N 441.503 2.440 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1F 804005513 ZKXANDACCYZKKI-HXUWFJFHSA-N 440.519 2.205 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cccn3C)cc2F)CC1 805007594 MSUYFKZIQAYYNC-JOCHJYFZSA-N 441.551 2.286 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289147 KLXARIBPXZRCRR-PXNSSMCTSA-N 442.560 2.441 10 20 IECD CCOC(=O)c1c(NC(=O)Cn2c(=O)ccn(C)c2=O)sc(C)c1-c1ccccc1 913615197 DAKMQEOVCBPYHF-UHFFFAOYSA-N 427.482 2.399 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCc4nc(C)ncc4C3)CC2)cc1 916197146 VPYVVDOBEXACQQ-FQEVSTJZSA-N 438.576 2.162 10 20 IECD CC(=O)N1c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C[C@H]1C 917918548 TXNINYNJPHUUHT-OAHLLOKOSA-N 447.532 2.438 10 20 IECD CNC(=O)c1ccc(OC)c(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918034931 BCFSOQUQGHCZAZ-QGZVFWFLSA-N 439.516 2.078 10 20 IECD CCOC(=O)C1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCC1 1521783853 BANFOHXWGVPFGQ-SFHVURJKSA-N 430.549 2.311 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ccon3)CCC2)cc1 1792313926 KWXXMQDSVLJAGY-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1[C@@H]2C=CS[C@@H]12 1804289823 WBWSPVIKKTYHNK-OEWYJSRKSA-N 428.510 2.330 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cc(O)nc(O)c1 1804342607 RPSXRJZXTDKKLT-ORIYUZMUSA-N 438.440 2.366 10 20 IECD C[C@H](CC(N)=O)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1806138142 RHLYBNHHVHFRLC-CYBMUJFWSA-N 437.924 2.108 10 20 IECD CCOc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1 1844833759 SETVJSWAENSKOH-UHFFFAOYSA-N 432.864 2.071 10 20 IECD CN(C)c1cncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)c1 1848315826 VHQFSHSQTAROPT-IRXDYDNUSA-N 430.892 2.341 10 20 IECD COc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)NC1CC1 437004599 BTIOCEJTLFSDCV-UHFFFAOYSA-N 431.514 2.241 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)c1 729067685 XAZXMRMLQOQRQJ-ZDUSSCGKSA-N 425.441 2.260 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4cccnc4)CC3)cc2F)CC1 730133602 ZZMYTKPGKUUWEW-UHFFFAOYSA-N 440.567 2.390 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1N1CCCCC1=O 737285591 JSWHLRZXBKAFJF-UHFFFAOYSA-N 427.457 2.181 10 20 IECD CC1(C)NC(=O)N(CCCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742805759 NQAACCDWQIJCEF-AWEZNQCLSA-N 438.475 2.484 10 20 IECD CCOC(=O)N1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 748014501 YQIXLLVWADOLPR-UHFFFAOYSA-N 439.515 2.169 10 20 IECD NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 748631972 GDZLFSRDCKOLGN-GOSISDBHSA-N 443.415 2.197 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 749638435 BRCQJMGAVMSXJI-UHFFFAOYSA-N 430.530 2.086 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754218603 ZRIFKQVIPBKJFN-UHFFFAOYSA-N 433.411 2.047 10 20 IECD C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cc([N+](=O)[O-])ccc1O 756410333 HDRMINBRSSFMIC-OAHLLOKOSA-N 435.502 2.313 10 20 IECD CCS(=O)(=O)CCN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759367898 UFXDMFKBKQWWEO-AWEZNQCLSA-N 428.510 2.156 10 20 IECD COC(=O)C1=C(COC(=O)/C=C\c2ccc(O)c(O)c2)N(C)C(=O)N[C@@H]1c1ccccc1 759590995 YQNDVSKUSPRRPS-FYJQUHEMSA-N 438.436 2.478 10 20 IECD COc1cc(N2CCN(C(=O)CSc3nnc4ccccn34)CC2)cc(OC)c1OC 760084645 OEJJXPMJRSYIEK-UHFFFAOYSA-N 443.529 2.196 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)cc1C(=O)O 761260661 YQHRPGOZRMKMGD-UHFFFAOYSA-N 440.905 2.362 10 20 IECD CS(=O)(=O)c1cc(Br)cc(C(=O)NCCc2ccc(O)c(O)c2)c1F 762263265 DCTDCWPJNAUSEU-UHFFFAOYSA-N 432.267 2.375 10 20 IECD CN1CCN(c2ccc(CNCc3cccc(CN4CCC[C@H](C(N)=O)C4)c3)cc2)CC1 771839638 BPVXRNKNXGDISN-DEOSSOPVSA-N 435.616 2.426 10 20 IECD CNC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Cl 772904685 SSUKRBJDAWVFSW-UHFFFAOYSA-N 434.899 2.404 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC(F)F)cn3)CC2)cc1 774820401 JPTAIZCRGKQBOY-UHFFFAOYSA-N 435.475 2.313 10 20 IECD CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(=O)N1CCCC1 775419916 CETFUEPIZGQHIY-BSRJHKFKSA-N 448.583 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(c4nc5ccccc5[nH]4)C3)CC2)cc1 778315334 ACGTUPQGNLQTTG-ZHACJKMWSA-N 445.523 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 778391194 KHHKJRVDQPUXKX-SVHBDMKASA-N 437.540 2.008 10 20 IECD C[C@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 778552607 PDELUFLHIFXWHN-MRXNPFEDSA-N 425.533 2.318 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 779478106 FMGMIZIQCIITMJ-IZTUGPKFSA-N 426.469 2.101 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 779480735 HZRJDKZDDOMELM-VQTJNVASSA-N 427.526 2.484 10 20 IECD CCOC(=O)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 782740667 RZDGAAIBEZZOSG-ZHACJKMWSA-N 438.484 2.110 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 787196936 IIJBQVSRIFETAU-KZNAEPCWSA-N 439.560 2.255 10 20 IECD CC(C)Oc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 787243673 UWIXVLFLTPXAQP-UHFFFAOYSA-N 425.529 2.286 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(C(F)(F)F)nn1 788299237 LWAAUFCWADHWRZ-UHFFFAOYSA-N 429.424 2.052 10 20 IECD COc1ccc(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(C(C)=O)cc2)c(O)c1 794389975 USFMXXVIXDBPBV-UHFFFAOYSA-N 434.514 2.321 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 799260417 VMJBEHFMNVTOKQ-HRAATJIYSA-N 438.528 2.486 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(N2CCOCC2)cc1 803301581 UIMPPULMYVDELQ-DVWBAYGPSA-N 427.545 2.164 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N2CCOCC2)cc1 803310622 IHRPUOKPNWAPEA-QZTJIDSGSA-N 448.527 2.159 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450495 IYVRRORWZALSRC-MRXNPFEDSA-N 438.519 2.364 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC3C[C@@H](C)C[C@H](C)C3)CC2)cc(OC)c1OC 806901273 HMSUOHURFPJCRH-HOTGVXAUSA-N 433.549 2.302 10 20 IECD C[C@@H]1C[C@H](N(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1C 807770742 NVOHZBNPIWRWDG-JFIYKMOQSA-N 438.519 2.314 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CC4)C(=O)C3)cc2Cl)C1 807952021 JARCLGWBVXZOHJ-HNNXBMFYSA-N 432.952 2.026 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCc2ccccc2CC1 808854431 YDOKFKYYBZBRBA-UHFFFAOYSA-N 446.595 2.462 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1F 810356872 OKWHPRONIQRQPW-CYBMUJFWSA-N 447.438 2.404 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(CN2CCNC(=O)C2)c1 812993680 VZYUZMFHEGUNJY-UHFFFAOYSA-N 438.528 2.091 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2cc([N+](=O)[O-])cn2)c(C)n1-c1ccc2c(c1)OCCO2 913303030 MQBHWRVBJNBKFK-UHFFFAOYSA-N 440.412 2.396 10 20 IECD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918340127 LQHKYZJSDOFJCL-UHFFFAOYSA-N 435.527 2.482 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)c1 921085858 XSXMKKFIFGXBGO-LBPRGKRZSA-N 425.457 2.298 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3CCCC[C@@H]3C)CC2)cc1 1325006059 GAYUZOWOBMIIAA-SGWGQVFISA-N 428.577 2.281 10 20 IECD CC(F)(F)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777849314 SIWLWZFEJUEGFZ-SPLOXXLWSA-N 441.475 2.302 10 20 IECD Cc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)s1 1782005385 CATKLTYNNPDSPE-LJQANCHMSA-N 437.905 2.273 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)[C@@H]1CC=CCC1 1783988939 OJWUVYHMTAOHLQ-YTLAJJPVSA-N 442.512 2.153 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@@H]3CCCOC3)CCC2)cc1 1792315455 PTVYMQJKOZJBQU-CQSZACIVSA-N 447.582 2.407 10 20 IECD CC(=O)NCC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793706597 KCTHPTODLSIDLF-QDMKHBRRSA-N 437.924 2.165 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770323 MSPQIFXWRULXPZ-NFWAQSGPSA-N 448.903 2.426 10 20 IECD CCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806028387 AEOMXHVMJXGNBJ-JLTOFOAXSA-N 437.456 2.072 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C[C@H]2CCCCO2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994095 RMZSIUIQLOECKA-AQOAWAETSA-N 440.500 2.167 10 20 IECD CC1(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CCC1 1814185228 NPJVJZINCOSTIA-QAPCUYQASA-N 446.598 2.138 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362578 ZYHZAQNNVICLLS-KWCYVHTRSA-N 441.488 2.206 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccnc(Cl)n1 1819745358 YRQZLPDYQJIUOX-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD Cc1ccoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498766 VRQUMXYKSLMKHN-CYBMUJFWSA-N 447.542 2.477 10 20 IECD CN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824199410 RLNNXMZZPZIIEK-RBUKOAKNSA-N 430.549 2.210 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2c[nH]c3ncccc23)C1 1843674468 WTADFVIEKFFHSJ-FNORWQNLSA-N 434.452 2.210 10 20 IECD O=S(=O)(c1cccc2nsnc12)N1CCN(Cc2c(O)ccc3ccncc23)CC1 28891295 YEMZYJZYIKPPLN-UHFFFAOYSA-N 441.538 2.452 10 20 IECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 726098940 VFQXCGPIVWXFCR-PKOBYXMFSA-N 434.606 2.313 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C4OCCO4)CC3)cc2F)C[C@H](C)O1 726789593 OOHJPHXFTCOGRT-IRXDYDNUSA-N 435.540 2.140 10 20 IECD CC(C)C(=O)N1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 727930932 BZSPQBOWPYIOOB-KDURUIRLSA-N 448.583 2.246 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c1 734072909 URGOCLAAZLMQOB-UHFFFAOYSA-N 432.908 2.061 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])cc1 739700958 UXMRLGFPZNXGDK-UHFFFAOYSA-N 431.514 2.424 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(OCC(=O)N(C)C)c1 743958391 UWOXEFYURUFQNS-UHFFFAOYSA-N 439.512 2.301 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc21 746036737 GBTDUXOJZBXQAS-UHFFFAOYSA-N 433.512 2.410 10 20 IECD CS(=O)(=O)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 746989123 DPOJAZWXPRJDFL-IBGZPJMESA-N 446.525 2.083 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccc([S@](C)=O)cc1 749808544 FKXNVKMLFAQVLC-PMERELPUSA-N 433.549 2.148 10 20 IECD COC(=O)/C=C1/SCC(=O)N1CCCOC(=O)c1csc(Cc2ccc(N)cc2)n1 751929982 FFDSZLXFNZPGJA-VCHYOVAHSA-N 447.538 2.453 10 20 IECD CCCC1(CCC)NC(=O)N(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1=O 758198286 NQIZLZMUQFLVAX-LJQANCHMSA-N 432.565 2.069 10 20 IECD COC(=O)C1=C(COC(=O)/C=C\c2ccc(O)c(O)c2)N(C)C(=O)N[C@H]1c1ccccc1 759590998 YQNDVSKUSPRRPS-IZKUIKQZSA-N 438.436 2.478 10 20 IECD CCc1csc(-n2cc(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)cn2)n1 762686535 LEPMXLHODCRJKN-UHFFFAOYSA-N 440.573 2.452 10 20 IECD O=C(COC(=O)c1cccc(C2OCCO2)c1)NCc1ccc(N2CCOCC2)c(F)c1 766907661 RGUUATSZJKQBES-UHFFFAOYSA-N 444.459 2.181 10 20 IECD COc1cc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c(O)cc1C 768442560 SQAVOCFPXRRDQS-UHFFFAOYSA-N 435.502 2.343 10 20 IECD CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769933015 UOLIXOPECGWRSE-UHFFFAOYSA-N 448.545 2.167 10 20 IECD Cc1nnc(-c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2)o1 774125064 UZGAHIZELLYJAV-UHFFFAOYSA-N 435.484 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 778248513 UVLWASADWMDJSJ-ANMDKAQQSA-N 428.577 2.137 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ncn(C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 779129501 ZSCSWNAAUCDGKD-UHFFFAOYSA-N 434.399 2.017 10 20 IECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 779337112 XBVNYZABPFIKHZ-FUHWJXTLSA-N 447.580 2.491 10 20 IECD C[C@H](NC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 782717442 RXTKSMWVAKDUJX-KRWDZBQOSA-N 446.573 2.334 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@H]4C3)CC2)cc1 785610500 XSFATDZVXSETOZ-QHAWAJNXSA-N 442.604 2.409 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)C3CCN(C)CC3)cc2F)C[C@@H](C)O1 789829002 ZUZJCLVBBMGFJW-FGTMMUONSA-N 448.583 2.244 10 20 IECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CN1CCN(C)CC1 790195851 PEEKZNNMNIUTIE-LJQANCHMSA-N 430.593 2.053 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c1 800840044 WFMNJQLCSWPFDB-UHFFFAOYSA-N 426.516 2.426 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H](c4ccnn4C)C3)CC2)cc1 801518183 YZSKRJZHPGJBPB-VJIACCKLSA-N 437.544 2.040 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)nc1 803686776 PRPPYWJFVIGHDV-UHFFFAOYSA-N 449.555 2.266 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCN1C(=O)OC(C)(C)C 803687425 MJCTZLAMMCHRSM-MRXNPFEDSA-N 430.549 2.153 10 20 IECD C[C@@H]1CSC[C@H]1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977642 VMMSRKIYIVENBZ-CRAIPNDOSA-N 430.553 2.493 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)OCc3ccccc3)cc2F)CC1 805009315 HDWDJMHSFPDTNX-UHFFFAOYSA-N 428.508 2.174 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccncc1OC[C@@H]1CCOC1 806511873 LCRCOXLLYIACBZ-LJQANCHMSA-N 426.517 2.333 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cn(C)nc3C3CC3)cc2F)C[C@@H](C)O1 812957546 VYIFXKHIBISPNU-OKILXGFUSA-N 429.496 2.305 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3ccccc3F)CC2)cc1 916196831 QCAWDNFJSNNCRY-QFIPXVFZSA-N 430.524 2.379 10 20 IECD CCNC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 919791869 DOFVICZJNQNJSX-UHFFFAOYSA-N 426.517 2.038 10 20 IECD CC(C)NS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 919863083 GKLIXBYPNIQHEZ-UHFFFAOYSA-N 435.521 2.279 10 20 IECD CCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C)c1ccc(OC)c(OC)c1 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COc1ccc(N2CCCN(C(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)CC2)cc1 108432347 LPMARGQMEOVLSR-UHFFFAOYSA-N 440.456 2.068 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3sc(NC(C)=O)nc3C)n2)c[nH]1 727247775 MQNPAGHLQXILEW-UHFFFAOYSA-N 441.516 2.449 10 20 IECD NC(=O)N1CCCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 729361766 RBZURLAUAHSBBH-WYMLVPIESA-N 438.600 2.343 10 20 IECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OC 730679489 DDBAXQMOBKTQHE-UHFFFAOYSA-N 445.491 2.307 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccn(CC(F)(F)F)n3)CC2)cc1 746370702 BHAOOVRZXFAIIQ-UHFFFAOYSA-N 425.411 2.131 10 20 IECD C[C@H](O)C[C@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748374102 HQJSGGWYYBOMFK-STQMWFEESA-N 437.474 2.238 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 749730722 CDYXZQCQGZQITI-UHFFFAOYSA-N 429.531 2.369 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751137465 SBNJIBUXSUKVJQ-HXUWFJFHSA-N 432.542 2.441 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)(C)[C@@H]3[C@H]3CCCO3)CC2)cc1 752974211 BZHDNTZAZKFQPG-CTVFRGBDSA-N 427.545 2.316 10 20 IECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)C2=O 756946387 DOJWEPXBPRPESP-NDBKNAECSA-N 442.560 2.447 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@H]2c2ccccc2C)c1 758994706 WOOXZZLTDUKPEL-HSZRJFAPSA-N 437.540 2.409 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3F)CC2)cc(OC)c1OC 759988378 SSMIYZBFWOPBLA-UHFFFAOYSA-N 432.452 2.305 10 20 IECD CCC(=O)N[C@@H](CCSC)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760084201 LTNSBLAIRAMVCH-INIZCTEOSA-N 439.578 2.009 10 20 IECD C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)S(=O)(=O)C1CCOCC1 765344553 PSGDPKYQSJYOPR-FXAWDEMLSA-N 438.590 2.243 10 20 IECD C[C@@]1(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCOC1 772447457 OTGBOLQAVRQXRL-JOCHJYFZSA-N 428.512 2.311 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(F)cc3)cc2F)CC1 774712952 MBSXLGIMIILDJQ-UHFFFAOYSA-N 430.499 2.082 10 20 IECD CCN(Cc1ccc2c(c1)OCCO2)C(=O)CN(C)c1ccc(OCC(=O)OC)cc1 784557757 URDBNQQLNMJBBR-UHFFFAOYSA-N 428.485 2.495 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3ccsc3)N(C)C)CC2)cc1 787652295 IJQCWDCIGDUPAF-HXUWFJFHSA-N 430.574 2.261 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1cccc(F)c1 789799592 KBOBNMMRWRIABQ-OAHLLOKOSA-N 433.455 2.001 10 20 IECD C[C@@H](N[C@H](C)c1nnnn1C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 790554288 IXYBMENHQWFSMV-CHWSQXEVSA-N 430.468 2.461 10 20 IECD CCC1(CC)CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCS1 793730044 BORKSIZDNNBXDV-GOSISDBHSA-N 446.617 2.139 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccc(N2CCOCC2)cc1 803303890 VTONDHHQWMGJRH-WKHFQEMYSA-N 440.588 2.033 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3ccn(-c4ccc(F)cc4)n3)ccc21 803686559 DQCAJDCTRDZWOK-UHFFFAOYSA-N 435.503 2.369 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1 807452067 ZYNLPKCCLFDZKS-HXUWFJFHSA-N 438.572 2.458 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)Oc3ccc(F)cc3)CC2)cc1 807633245 VSDGFYQHSCICGY-QGZVFWFLSA-N 429.492 2.457 10 20 IECD Cc1nnc([C@@H](C)NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768135 CWWDKPPWKOLUJU-DGCLKSJQSA-N 439.488 2.410 10 20 IECD COC[C@H](C)[C@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 812623297 QLRWURSQVMQPGH-ZFWWWQNUSA-N 436.530 2.386 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc(N4CCCNC4=O)cc3)nc12 812899204 ITLKEVDAHNQHQU-AWEZNQCLSA-N 438.488 2.382 10 20 IECD O=C1CC[C@](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(c2ccccc2)CN1 816891138 JOKZFXKVJCIERE-XMMPIXPASA-N 425.504 2.251 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCCN3Cc3ccncc3)CC2)cc1 1327569387 LTBHKCACYPYNCK-DEOSSOPVSA-N 437.588 2.383 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(F)c(F)c1 1780493125 GDJYLVBSNMUBKC-VGOFRKELSA-N 447.438 2.212 10 20 IECD Cc1cc[nH]c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790241978 AOGMCQBPWHLGJQ-JDFRZJQESA-N 433.892 2.295 10 20 IECD C[C@@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802890480 XUJQEJFBCSDEBV-DMRZNYOFSA-N 428.514 2.320 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cccc(F)n3)sc2C1)c1cc(O)nc(O)c1 1820442167 LIUMBRTZGUWNKA-SNVBAGLBSA-N 429.433 2.023 10 20 IECD O=C(CC1CCC1)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1828120692 PWBWGIWULJFDQZ-NSHDSACASA-N 438.600 2.106 10 20 IECD CC(=O)N1CCC[C@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 10703976 JCKKBFGAOZZFFV-HNNXBMFYSA-N 434.448 2.202 10 20 IECD CCOc1ccccc1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 12069555 ZYBROSXLHWZRKV-UHFFFAOYSA-N 440.544 2.361 10 20 IECD CN(C)CCOc1ccccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 606466004 GKYMHNCGIKTDHE-UHFFFAOYSA-N 447.586 2.143 10 20 IECD O=C(COC(=O)c1oc2ccccc2c1CO)NCc1ccc(N2CCOCC2)c(F)c1 726016184 WBOJSTKJYBYQJP-UHFFFAOYSA-N 442.443 2.374 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F 727928184 RAUJALBQWDAABN-INIZCTEOSA-N 445.438 2.418 10 20 IECD CCc1ccc(C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1S(=O)(=O)N1CCOCC1 728979197 ZNVQXIGISZWRJS-OAHLLOKOSA-N 448.541 2.475 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)cc1F 731408570 QLDSFAGOJTUHNB-UHFFFAOYSA-N 435.521 2.471 10 20 IECD C[C@H](NC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOCC1)c1ccccc1 733370114 VFRIPWNCEJYBRY-INIZCTEOSA-N 447.557 2.394 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 734406085 MMIMVUKSCUHQAN-MKGTUJQCSA-N 434.540 2.481 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(N4CCCCC4)n3)CC2)cc1 739494763 PYAWJOASIKCBMH-UHFFFAOYSA-N 438.576 2.418 10 20 IECD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NCc1c(O)ccc2c1CCCC2 743717974 ZIQLGFDCHYOUBQ-UHFFFAOYSA-N 446.525 2.027 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1cc(Br)ccc1N1CCOCC1 748480850 DBGAVBILBKSBPU-UHFFFAOYSA-N 434.290 2.246 10 20 IECD O=C(CN1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1)NCc1ccc(N2CCOCC2)c(F)c1 748830887 NKZJIHQDIWUEMR-LEDOBFOHSA-N 430.568 2.085 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 749130286 IFLLSIVLOZJECH-UHFFFAOYSA-N 445.522 2.337 10 20 IECD NC(=O)COc1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 751059558 ATXROOZGLUCXIX-UHFFFAOYSA-N 447.494 2.371 10 20 IECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CCC[C@]34NC(=O)N(C)C4=O)cc2)CC1 752010414 PFIYIQRTQDLFPM-JPYJTQIMSA-N 427.549 2.443 10 20 IECD COc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)NCC4CC4)c3)CC2)cc1F 753740835 WCYLFBMKOKNNMK-UHFFFAOYSA-N 447.532 2.485 10 20 IECD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 758559798 SSWVRQHMNVWKJL-CQSZACIVSA-N 448.497 2.456 10 20 IECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(C(=O)O)c1C 760357464 UOYDJFGLFWGBQH-UHFFFAOYSA-N 438.527 2.037 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(C)=O)C4(CCCCC4)C3)CC2)cc1 766246085 KISXHHDDPVVYQY-UHFFFAOYSA-N 428.577 2.211 10 20 IECD C[C@@H](NC(=O)N(C)[C@@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 771768570 KZNJRRDFIXSCPE-AUSIDOKSSA-N 429.609 2.394 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1 773750185 CXASYVSPPRRIEM-QGZVFWFLSA-N 427.501 2.099 10 20 IECD CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1Cl 774269039 DVHIXYJZGJZWJU-UHFFFAOYSA-N 448.932 2.343 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccs1 774862203 WGTWASNSQBZEAQ-QZTJIDSGSA-N 431.558 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccc(Cl)cn3)CC2)cc1 778329970 ZDIKGLABMBJLQZ-CLFYSBASSA-N 444.919 2.144 10 20 IECD O=C(COC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc(O)c(O)c1 784157801 NBWKXAMJHJPCCR-UHFFFAOYSA-N 434.451 2.395 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ccc(O)cc4C3)cc2F)C[C@@H](C)O1 789811786 IBLOOAKBNVPGJM-HZPDHXFCSA-N 441.503 2.346 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)sc1C 789826691 QIVKZFWHPPKGDX-ZIAGYGMSSA-N 448.564 2.488 10 20 IECD CC1=CCCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 797998503 IDAQPEJYFGMUIR-VCHYOVAHSA-N 445.566 2.385 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCN1C(=O)OC(C)(C)C 806276583 QUEMOLWZEOFNRV-CYBMUJFWSA-N 428.580 2.209 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)cc1 807811166 WRFKZJXRQUOBIB-UHFFFAOYSA-N 426.473 2.267 10 20 IECD C[C@H](OC(=O)C[C@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808687894 OQZOSIODBBWLCK-UONOGXRCSA-N 434.448 2.391 10 20 IECD COc1ccc(N2CCN(CCN[C@H]3CCCc4ccc(S(N)(=O)=O)cc43)CC2)cc1 810212851 ZQVYTJDXYBHDEV-QHCPKHFHSA-N 444.601 2.132 10 20 IECD N=C(NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCN(c2ccc(F)cc2)CC1 849069901 ZRBPOGJRUWNJHB-IBGZPJMESA-N 438.551 2.374 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](c3ccsc3)N(C)C)CC2)cc1 920254638 LYPCSYCCGWGJBI-GEPASTNRSA-N 442.585 2.381 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1780411362 HALOSUFAOXKQSD-NRFANRHFSA-N 433.892 2.155 10 20 IECD Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815942700 DXSPYEPPZFEHCG-VIFPVBQESA-N 448.892 2.174 10 20 IECD CCOC(=O)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821687064 JFSSZUHEMOAWAA-BXUZGUMPSA-N 447.448 2.083 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)c2ncon2)CC1 1829503987 MKTROKCDPRSPDJ-YERXGYGTSA-N 442.472 2.133 10 20 IECD C[C@@H](NC=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740268 MEQKQQNMLZZWEJ-DYVFJYSZSA-N 437.924 2.119 10 20 IECD O=C(Cn1cnc2ccccc21)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847036758 AZFQXYJODCTQBN-VQHVLOKHSA-N 448.479 2.070 10 20 IECD CCOc1cccc(N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)n1 554644466 NJBCRMYFTIGOGA-UHFFFAOYSA-N 435.528 2.245 10 20 IECD COc1ccc(N2CCC(NC(=O)Cc3c(C)[nH]c(-c4ccncc4)nc3=O)CC2)cc1 726561544 DJOXPZIOSZWBNZ-UHFFFAOYSA-N 433.512 2.477 10 20 IECD CNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 734269310 CZOFWVPWWRNLOT-OAHLLOKOSA-N 428.455 2.210 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c1 739085413 IXRUBOZRXGCBAY-HZPDHXFCSA-N 427.501 2.265 10 20 IECD CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 748485186 DKXPQNVAZDHJND-UHFFFAOYSA-N 439.493 2.472 10 20 IECD CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)c2ccccc2O1 750351125 BETVSPSSGCJQMO-NRFANRHFSA-N 439.512 2.450 10 20 IECD Cc1nc2cc(O)nn2c(C)c1CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 751347247 RTLSNSWRAGZRDH-UHFFFAOYSA-N 427.480 2.276 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(F)c1 754213949 XOQLZEHFDYNBGW-UHFFFAOYSA-N 433.411 2.047 10 20 IECD CCn1cc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])n1 754804395 GHVDUTNALVNPES-CQSZACIVSA-N 443.913 2.113 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNCc3ccc(Cn4cccn4)cc3)CC2)cc1 758198508 SKMNQGFSQOJATL-DEOSSOPVSA-N 435.572 2.213 10 20 IECD O=C(Nc1ccn(-c2ncccc2F)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 758966861 OKDJKIPXDDXXIL-MRXNPFEDSA-N 439.447 2.258 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 768522395 MTJQKKWRLRLBFH-AVRDEDQJSA-N 434.606 2.171 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 769164036 TZHWNPRZXXRQJR-ZEQRLZLVSA-N 444.620 2.462 10 20 IECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3ccc(N(C)C)c(F)c3)CC2)cc1 769380280 RAWVUBKNRQXBQF-UHFFFAOYSA-N 434.581 2.296 10 20 IECD COc1cccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)c1O 771416485 HMMFHPKQHABPJK-FQEVSTJZSA-N 435.839 2.277 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(Oc2ccccc2)cn1 773260583 XZQZCXKWMVQYKD-UHFFFAOYSA-N 438.509 2.434 10 20 IECD O=C(NCc1nc(C(F)(F)F)n[nH]1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775914745 YDHMCMWHJZIUCB-UHFFFAOYSA-N 447.420 2.321 10 20 IECD COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778417920 CQWVAVONNWBNGM-SJUVIOCWSA-N 443.544 2.138 10 20 IECD COCCn1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(C)n1 782412788 CIGGDLCTVQTIEG-UHFFFAOYSA-N 447.447 2.409 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1I 785294211 LONASWKOIKSWAO-SNVBAGLBSA-N 440.237 2.388 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 788318494 DBRXNRMJTOZVED-UXHICEINSA-N 443.569 2.316 10 20 IECD CCOc1ccc2c(c1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCO2 788318610 GALNATLWMSFTBD-NRFANRHFSA-N 439.512 2.178 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CCCOc2ccccc21 789799710 KPGIGVGEFPKGHP-LJQANCHMSA-N 427.476 2.309 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3ccncc3)cc2F)C[C@@H](C)O1 789819081 LHODDZGEFCKKON-IAGOWNOFSA-N 428.508 2.152 10 20 IECD CC(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)on1 789819441 MYPKVXNYAVNXOZ-GJZGRUSLSA-N 432.496 2.483 10 20 IECD CCS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734993 WNWGVTFDKQEABR-AZUAARDMSA-N 446.617 2.139 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Br)ccc2F)cc1 797430827 AZKZYRAXMBUVBW-UHFFFAOYSA-N 438.300 2.265 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2Cl)C1 800049328 IGFQDQZJAUOTJJ-XYRDGILRSA-N 445.947 2.355 10 20 IECD Cc1ccccc1N1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803298469 BCUNSUFWQDDKST-FQEVSTJZSA-N 436.556 2.358 10 20 IECD CN(C[C@@H]1CCCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451762 VLSONTPIQWDGDQ-SFHVURJKSA-N 425.476 2.401 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3nc4c(s3)CCCC4)CC2)cc1 804086267 PDVHSNCJMMTWSD-UHFFFAOYSA-N 442.585 2.474 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3c3c(C)n[nH]c3C)CC2)cc1 804315128 FPHBRFGCKYSXBF-HXUWFJFHSA-N 425.533 2.484 10 20 IECD CNc1nc(C)cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 805617024 QSHFSHBOOKUUBA-HUUCEWRRSA-N 445.495 2.053 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCCCSc2nccs2)C1 806281294 SWMXLWREKSLXMF-LSDHHAIUSA-N 426.608 2.285 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3[C@H](O)c3cccs3)CC2)cc1 811818436 NIWMFTYCILZRSO-GHTZIAJQSA-N 428.558 2.218 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 914756113 GENPHGHVGQSDDQ-SFHVURJKSA-N 431.558 2.168 10 20 IECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 915906239 UINPXJDHOCULHU-SFHVURJKSA-N 444.532 2.338 10 20 IECD CCN(CC)S(=O)(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1 917080368 HNUSSVYQJZRUJV-UHFFFAOYSA-N 432.590 2.481 10 20 IECD CN(C)CCOc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918294589 HFAXQCNOESTIGY-OAQYLSRUSA-N 441.528 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccccc3OC)CC2)cc1 920254605 LIGCUYNUCVOHSX-QXMHVHEDSA-N 439.512 2.104 10 20 IECD O=C(COC(=O)Cn1cc(C2CC2)nn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1319145714 ZYYSQPKQPHUCBX-UHFFFAOYSA-N 430.420 2.113 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 1319613925 HVYGOXWZJNGHLS-UHFFFAOYSA-N 446.573 2.096 10 20 IECD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)n1cccc1 1782009291 VLWIODOKAOGLGR-QKKBWIMNSA-N 433.892 2.257 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2nccc2c1 1798231184 XTKNGSNPIDMMAO-XBMZCVMLSA-N 448.479 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(Cl)o1 1804333227 DPYXUQCBZYTTQF-JGPRNRPPSA-N 427.935 2.045 10 20 IECD CC(C)N1CCC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823020404 JYEVMCRWVORDIA-IRXDYDNUSA-N 442.520 2.395 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccsc1 1834119091 KJLUCKXFAGYEFD-UHFFFAOYSA-N 430.530 2.053 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccc(F)cc1 1836290194 NFLCIGZNSLNMRD-UHFFFAOYSA-N 442.491 2.131 10 20 IECD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)ccn1 1838029699 BXNGWJZSWWHKDC-UHFFFAOYSA-N 440.500 2.122 10 20 IECD CCc1noc(C)c1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844502546 PDUXMFQSTICIIQ-SOFGYWHQSA-N 427.457 2.193 10 20 IECD COc1cccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1O 727761056 LLLGTVWHDZSVRX-GJZGRUSLSA-N 434.514 2.129 10 20 IECD CN1CCN(C)[C@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 732149400 INMKFABIQGICEY-VQCBNXJZSA-N 438.644 2.092 10 20 IECD COc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1 734016405 OZONJJIDMNAPOD-HUUCEWRRSA-N 434.514 2.129 10 20 IECD CCOCc1cc(CNC2CCN(S(=O)(=O)C3CCOCC3)CC2)ccc1OC 736360399 BUTLLZHZAZEDGE-UHFFFAOYSA-N 426.579 2.295 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)OC)c2)cc1 739670027 CTAUZPUWWXOKOY-UHFFFAOYSA-N 428.488 2.044 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 743579564 VHBRGZGEMXFPOV-UHFFFAOYSA-N 446.548 2.150 10 20 IECD CON(C)S(=O)(=O)c1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 753639801 DWXHLXCPSUQRRS-NSHDSACASA-N 428.894 2.294 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NC1CCN(C(=O)C2CCCCC2)CC1 759595175 IZAYTXNGDLBORX-VQHVLOKHSA-N 430.501 2.342 10 20 IECD O=C(CN1CCn2c(nnc2C(F)F)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761106688 ZRLUDYQJOBEPBB-UHFFFAOYSA-N 437.406 2.445 10 20 IECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCc2cccc(Br)c2O)C1 764780594 PXPWJLSWTCNTNC-CYBMUJFWSA-N 433.306 2.332 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(n2ccnn2)CC1 764991339 VBSASSPMAAKMCE-UHFFFAOYSA-N 433.515 2.323 10 20 IECD C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(N2CCOCC2)cc1Cl 765026055 PIFUMAAYOJGZOL-OAHLLOKOSA-N 430.936 2.243 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](Cc3ccccc3)N(C)C)CC2)cc1 774916310 BEXZFNJTLZURSI-QFIPXVFZSA-N 438.572 2.023 10 20 IECD COCCCOCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 775924712 NTIFVWQYAWPUKM-AWEZNQCLSA-N 425.437 2.385 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCN(C(C)(C)C)CC3)CC2)cc1 778251943 HOWZWRNZZUPMAS-ZHACJKMWSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccn(-c4ccncc4)n3)CC2)cc1 778277894 QZPJKNFRVLMFFF-VOTSOKGWSA-N 432.484 2.119 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 785296650 OMDKZDWCPOVKOX-OAHLLOKOSA-N 425.485 2.410 10 20 IECD O=C(NCCc1csc(O)n1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788162583 BCKURRRJIUSEQS-UHFFFAOYSA-N 425.513 2.389 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C3CCN(C(C)C)CC3)CC2)cc1 788978797 RVXBUDHUSOHTJL-UHFFFAOYSA-N 443.636 2.166 10 20 IECD COCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCC1 789954259 HZGLVQLDYRVFAA-UHFFFAOYSA-N 443.466 2.091 10 20 IECD Cc1cccc(OC[C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 793803889 YWYYNCUNWKICCU-IBGZPJMESA-N 425.529 2.374 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc(N2CCOCC2)cc1 793808505 BVRVBAMIJICLIU-IBGZPJMESA-N 447.539 2.262 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCS(=O)(=O)CCc1ccccc1 800066440 FTMMQTJGSYZEIG-UHFFFAOYSA-N 445.585 2.322 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@@H]3C[C@H](O)c3ccccc3)ccc21 803685768 KDYXCJGAQQICJW-GMAHTHKFSA-N 437.540 2.036 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805166840 PZBIXEYBDUGNAN-OAHLLOKOSA-N 436.459 2.337 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H](c3nncn3C)C(C)C)CC2)cc(OC)c1OC 805768555 KGSIFKBOINKROJ-GOSISDBHSA-N 432.525 2.070 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 807253901 LHSCUBPJKNQOQT-UHFFFAOYSA-N 446.551 2.348 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 807287284 IRYFPYUZUNDPTF-XZOQPEGZSA-N 435.524 2.030 10 20 IECD Cn1ccnc1[C@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769544 HHSQLHFNWIBSMA-JKSUJKDBSA-N 447.486 2.123 10 20 IECD COCC1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 807770384 LILQRIISLUSLKV-HNNXBMFYSA-N 425.476 2.306 10 20 IECD COc1cc(OC)cc(N2CC[C@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 808956132 RNEFRNITXXDSDO-SFHVURJKSA-N 440.544 2.123 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)cc3OC)CC2)cc1 915744232 YUBVQVRLGAMFOF-UHFFFAOYSA-N 444.507 2.110 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 915778816 RFYWNPYESBHXQQ-UHFFFAOYSA-N 436.512 2.014 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)OCCO4)cc2)C1 918001886 YOVACGCDGFLSEU-IBGZPJMESA-N 438.528 2.201 10 20 IECD Cn1c(S)nc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2c1=O 918138780 SSXXOZQJFPDOFG-UHFFFAOYSA-N 428.489 2.128 10 20 IECD C[C@@H](NC(=O)NCC1(NS(C)(=O)=O)CCCCC1)c1ccc(N2CCOCC2)cc1 920920132 AZRGCURREGHHHP-QGZVFWFLSA-N 438.594 2.136 10 20 IECD CCOC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1320473319 VOWFZZJUIOJVPS-LMMKCTJWSA-N 435.540 2.473 10 20 IECD O=C(CC[C@H]1CCOC1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784817546 VTHTULCUXIYIFA-QKKBWIMNSA-N 438.908 2.011 10 20 IECD O=C(CC1CCOCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931850 OYLYMZHBIFIUEI-FNLKRUPLSA-N 438.528 2.234 10 20 IECD CN1CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1814544614 CPBZSBQWWPHZTB-KRWDZBQOSA-N 442.520 2.254 10 20 IECD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)nc1 1816722227 FKHZAVBUXJMKKA-LBPRGKRZSA-N 425.470 2.192 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n[nH]1 1817844837 MQQLWXJDONASHB-OAHLLOKOSA-N 425.449 2.121 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1827429158 QETNKBKCDLGRGT-QAPCUYQASA-N 427.505 2.184 10 20 IECD O=C(Cc1cc2cccnc2cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250521 IFVVOTSNFVBPPP-UHFFFAOYSA-N 436.443 2.240 10 20 IECD O=C(NCC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1cccs1 1845500690 BIWBRXXZQUGXDF-UHFFFAOYSA-N 449.916 2.060 10 20 IECD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1cccc1C=O 1845500920 FJUSRSACKWIGQI-CYBMUJFWSA-N 431.876 2.443 10 20 IECD CC[C@@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)N(CC)CC 1847034850 PLVODZIKYPKMLP-KAMXEHQASA-N 431.533 2.140 10 20 IECD Cc1nc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)c(C)s1 1848255570 SVQHCBGPXUJYPE-XQTSXYSPSA-N 443.525 2.334 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 303011761 QYWXPXIPBALDIL-UHFFFAOYSA-N 446.573 2.391 10 20 IECD COc1cccc(CNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c1O 729858961 IRGOTSCGEXWZGP-UHFFFAOYSA-N 428.304 2.395 10 20 IECD COc1cccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)c1O 729861130 DSPLWSITKTVBHO-OAHLLOKOSA-N 442.534 2.256 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3CN(CC(C)C)CCO3)cc2F)CC1 730113046 MOEULVSVPOJGGC-FQEVSTJZSA-N 435.588 2.124 10 20 IECD CCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCN(c2ccccc2)C1=O 731848459 SGFSBIRUTKOCBW-HSZRJFAPSA-N 436.556 2.471 10 20 IECD CN(c1ccc(CNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1)C1CCCCC1 742416217 OLWVWUMHGJTWQS-RXVVDRJESA-N 447.601 2.107 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3cccc(OCC(N)=O)c3)cc2F)C[C@@H](C)O1 745649858 ZRCNFFNVKWEWIL-IYBDPMFKSA-N 444.507 2.303 10 20 IECD NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 746751898 YKHNSLASGVCSJN-CQSZACIVSA-N 428.455 2.339 10 20 IECD C[C@H](N1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1)C(F)(F)F 749555580 QGEWFWWFAGHGSF-RDJZCZTQSA-N 441.498 2.166 10 20 IECD CN(C[C@H]1CCOC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749566794 ZGVXYTJXNRPDHA-GOSISDBHSA-N 428.512 2.120 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 754140344 MXHMCZWRDWQYEX-AVRDEDQJSA-N 438.572 2.048 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 755190624 APBFWDUNIWSAQC-UHFFFAOYSA-N 446.511 2.135 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)CC4(CCCCC4)CC3=O)CC2)cc1 758220717 RSHQAPBQAUHZGA-FQEVSTJZSA-N 429.561 2.278 10 20 IECD CC1(O)CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 760141806 ZAJCEUHCVGPJKJ-UHFFFAOYSA-N 435.458 2.088 10 20 IECD O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NCCc1ccc(O)c(O)c1 767785404 JMKYRAHZGRCTLR-UHFFFAOYSA-N 432.542 2.394 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C\c2scnc2C)c(O)nc1=O 776731564 OICKWZXRWJISTF-HJWRWDBZSA-N 441.513 2.189 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@H]3C(=O)Nc4ccccc43)CC2)cc1 778222183 VNJCUQPLALRJOF-KUFMOJEASA-N 448.523 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3csc([C@H](C)OC)n3)CC2)cc1 778314751 UTBNPOASNINUAG-FDMDGMSGSA-N 444.557 2.380 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1 778686476 ZUQCDANHQRWOBX-AWEZNQCLSA-N 434.876 2.464 10 20 IECD Cc1nc([C@@H]2COCCN2C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 780055133 LDSVIGIBPXSCKA-INIZCTEOSA-N 448.391 2.275 10 20 IECD CN1CCO[C@H]([C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c2ccc(Cl)cc2)C1 785434864 VRFZUJGGCRXYOO-LEWJYISDSA-N 444.963 2.210 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656128 KRNWEBDMYSRUIM-WBKUHODZSA-N 444.601 2.229 10 20 IECD O=C(Cc1ccccc1CO)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 787138233 DFLUGJPQGFNJHL-UHFFFAOYSA-N 435.503 2.294 10 20 IECD CN(Cc1ccccc1)C(=O)CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 787756419 ZBXZAZSFWZWJRO-UHFFFAOYSA-N 435.480 2.289 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1 788302631 QMKSGWCRHDMKGF-UHFFFAOYSA-N 432.565 2.474 10 20 IECD C[C@H](COc1ccc(F)cc1F)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323141 JMJJIPNWBCSLGE-OAHLLOKOSA-N 433.455 2.001 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 789867920 JNWYXSULVLMNDK-ZCNNSNEGSA-N 429.586 2.320 10 20 IECD C[C@H](O)COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1O 792202517 JVLZWFSEBQZDKP-VIFPVBQESA-N 430.822 2.292 10 20 IECD CN(C)CCNS(=O)(=O)c1cccc(NCc2cc(Cl)cc([N+](=O)[O-])c2O)c1 796427881 CQYLCFDOQOHLPD-UHFFFAOYSA-N 428.898 2.406 10 20 IECD O=C(N[C@H]1CCOC1)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806513009 WYTRTKLLRRGBQY-PZJWPPBQSA-N 446.548 2.102 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1 807379159 RWTDHBSBOQQRQD-UHFFFAOYSA-N 428.508 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C(N)=O)[C@H](C)c3ccccc3)cc2F)CC1 813632486 HBHATYRAAAAZOC-VGOFRKELSA-N 441.551 2.424 10 20 IECD COCCCN(C(=O)/C=C\c1cccnc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 864046151 BDVBHUQXBULGEB-KHPPLWFESA-N 435.484 2.057 10 20 IECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918309366 YBTVLLRQSQHJCI-UHFFFAOYSA-N 440.544 2.191 10 20 IECD O=C(CCc1nnc(-c2ccsc2)o1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339767 HAEWFWAXLJLHHL-UHFFFAOYSA-N 446.554 2.282 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 918644740 IOWHIJMBILEFJG-UHFFFAOYSA-N 428.470 2.241 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 920195290 PFQYWTYERIVPGY-JOCHJYFZSA-N 439.512 2.336 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C(N)=O)cs3)cc2F)C[C@@H](C)O1 920602895 VKAKHTWDOCTWLZ-CHWSQXEVSA-N 449.504 2.073 10 20 IECD C[C@@H](NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O)c1ccc(N2CCOCC2)cc1 920880281 BKXHSEVPTBQCQX-OSPHWJPCSA-N 436.512 2.168 10 20 IECD C[C@@H](OC[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 921006563 CYQSICVDAFTBII-MJGOQNOKSA-N 443.523 2.143 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)N3CCC[C@@H](C)C3)cc2F)CC1 1122007792 QKDZUMHXLJYZST-GOSISDBHSA-N 433.572 2.415 10 20 IECD COCCn1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1=O 1318039126 ZDOJORFMNFWZLC-UHFFFAOYSA-N 447.403 2.431 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 1320437059 RQNDWTFOJNFGEA-CCRGXQTGSA-N 432.517 2.115 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc1OC 1339505749 ILJBKCWVFFLRIA-UHFFFAOYSA-N 445.494 2.355 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CC2)C1 1781619994 FHUOCAQRUQMQHJ-DNVCBOLYSA-N 426.872 2.381 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCCC3)C[C@@H]21 1792218857 UZHYILZBJLRATQ-AIONWGCTSA-N 444.528 2.377 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847002 GTSVJTNSWZKDJE-RISCZKNCSA-N 447.448 2.083 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nc1 1842044784 STLIXPKOGWDPOL-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3nc4nc(C)cc(C)n4n3)CC2)cc1 725853150 KNJPQTPDFLCYLF-UHFFFAOYSA-N 438.536 2.084 10 20 IECD Cc1cc(C(=O)N2CCCN(CC(N)=O)CC2)c(C)n1-c1ccc(Br)cc1 728867405 OOKGQRICKDWKOD-UHFFFAOYSA-N 433.350 2.490 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccccc1N1CCOC1=O 737118074 QDDIQXAESPGONG-UHFFFAOYSA-N 438.484 2.077 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCN3C(=O)CCc4ccccc43)CC2)cc1 737818917 MZUGLQWJIVFTGK-UHFFFAOYSA-N 436.556 2.303 10 20 IECD C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746155525 LGBOESDTLUPBTK-ROUUACIJSA-N 426.540 2.431 10 20 IECD O=C(NCC1CCOCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 749271703 HHXIBEATVXATLS-UHFFFAOYSA-N 435.458 2.258 10 20 IECD O=c1onc(-c2ccccc2)n1C[C@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 749298634 QGLXVKUIEXHBCT-WOJBJXKFSA-N 425.485 2.251 10 20 IECD CC(C)N1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1=O 750638869 RGPCNKGFEHIIPX-OAHLLOKOSA-N 428.455 2.351 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](Cc3cccc(F)c3)n3nnnc3C)CC2)cc1F 753739171 QZPHWUAQNWZRMN-FQEVSTJZSA-N 442.470 2.401 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 756158034 ZIZVZGTWDNCOLP-UHFFFAOYSA-N 431.464 2.277 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1F 762472831 GLYQZHDBLVZALZ-UHFFFAOYSA-N 432.451 2.182 10 20 IECD Cn1c(=O)nc(O)c2c(C(=O)NCc3cccc(Br)c3O)cc(C3CC3)nc21 765770984 UQSAWHNUOBRNKS-UHFFFAOYSA-N 445.273 2.310 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN([C@H](C)c4nccs4)CC3)CC2)cc1 767009475 ZXCTYOHNJMSDGK-CTNGQTDRSA-N 445.633 2.013 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3c3nncn3C)cc2F)C[C@@H](C)O1 767761733 RTGHBOFVJVBJJQ-GQIGUUNPSA-N 430.528 2.021 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)CN3CCCCC3)CC2)cc1 778248274 UTJKGPJSESZKLF-CTDFXDFQSA-N 428.577 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCO[C@@H]3C(C)C)CC2)cc1 778305563 BFNVMOVLAJKNMV-TYQJYFJLSA-N 429.561 2.467 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC 778535592 PGLUJYRJJBBSDP-UHFFFAOYSA-N 438.528 2.275 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(-n2cc(Cl)cn2)n1 785433673 OJYPXIAVWPBFPY-UHFFFAOYSA-N 426.908 2.228 10 20 IECD C[C@@H](CN1CCCCC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 787753354 YIJYGKMZVQBELH-INIZCTEOSA-N 438.519 2.364 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCN(c2ccccc2)C1 788331313 JMXCQOSGBCWPCU-OAQYLSRUSA-N 436.556 2.172 10 20 IECD O=C(NCCCc1nc2ccccc2[nH]1)C(=O)NCc1ccc(N2CCSCC2)cc1 788462361 WYZZKCLXEYOOEE-UHFFFAOYSA-N 437.569 2.481 10 20 IECD COC(=O)c1cncc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 788549096 QJCNSYMHEGFSKS-UHFFFAOYSA-N 430.530 2.201 10 20 IECD Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801495 UHICKESHFJBGGQ-HNNXBMFYSA-N 445.539 2.416 10 20 IECD COc1cc(C)cc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789845940 XGOKARQXJVBXET-UHFFFAOYSA-N 429.492 2.036 10 20 IECD COC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H]1CCCO1 790281210 PAFFHFMTBIAHBN-GOEBONIOSA-N 426.516 2.178 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794831735 PYRDFHCXBBMNAE-XOBRGWDASA-N 429.521 2.050 10 20 IECD Cc1cnn(C)c1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795964889 VLHCHISRLXBHOG-KRWDZBQOSA-N 437.566 2.339 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)Cc3ccccn3)cc2F)CC1 805007571 MHXZCIZSNRUADP-UHFFFAOYSA-N 427.524 2.028 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](Cn3cccn3)c3ccccc3)CC2)cc1 806163938 LCPAGXOULPPUNO-HSZRJFAPSA-N 447.539 2.488 10 20 IECD CCc1ccccc1CNC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 807367430 QUNDTGRIYPSYGG-UHFFFAOYSA-N 441.528 2.240 10 20 IECD CCN(C[C@H]1CCOC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769857 JCHBKGCCEGIBLL-HZPDHXFCSA-N 425.476 2.258 10 20 IECD C[C@@H]1C[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CN1C1CC1 807770561 MOQGTUYYTHWHQB-PMPSAXMXSA-N 436.503 2.114 10 20 IECD COC(=O)[C@H](C)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 914436979 ASQUQSVUMTVMTJ-SZUMLMDFSA-N 443.344 2.328 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(O)c(C(=O)O)c3)cc2F)C[C@@H](C)O1 917918647 RNLNANHOFSODKW-BETUJISGSA-N 438.477 2.322 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(N4CCN(C)CC4)nc3)CC2)cc1 918005686 GQBFUDPFKAPORU-UHFFFAOYSA-N 438.576 2.264 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N2C[C@H](C(=O)OC)Oc3ccccc32)cc1 918308700 BTYOHOPDQARZCB-OAQYLSRUSA-N 439.512 2.458 10 20 IECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918633826 PHAGWGOMQNJPRV-RYUDHWBXSA-N 439.509 2.227 10 20 IECD C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 920881431 NKJPXGWURDNIAD-CQSZACIVSA-N 433.486 2.326 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(CO)c3)cc2F)C[C@@H](C)O1 921224577 AWVCSZIFDCJROQ-IYBDPMFKSA-N 430.476 2.405 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccc(F)cc2C)nn1 1320394673 UNMVXPHVGXGJJX-HNNXBMFYSA-N 428.420 2.030 10 20 IECD CC1=CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1778110337 QUCKOKXYDSWVGG-MOMHAMLUSA-N 442.512 2.393 10 20 IECD CC(=O)N(C)[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788654613 PDGCLAVPFIQZNT-ZDUSSCGKSA-N 426.473 2.107 10 20 IECD Cn1cnc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc(O)c(O)c4O)cc3)CCC2)n1 1792298179 OGHAQFRNCSQAOY-ONNFQVAWSA-N 449.467 2.393 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812481265 ORXUOJBLVQGREL-NPTQTRLDSA-N 441.459 2.276 10 20 IECD CCOCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1816886158 BBMGQERJAKRCAU-HEWZJLJBSA-N 430.461 2.269 10 20 IECD Cc1[nH]nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817843800 AQDZADLFHLIBBI-LBPRGKRZSA-N 429.412 2.006 10 20 IECD Cn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c1 1825732981 ZRTPFQWIOROZQJ-KRWDZBQOSA-N 448.614 2.119 10 20 IECD O=C(c1ccc(CO)o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428271 LXFVOSPSOKGOHO-KRWDZBQOSA-N 429.473 2.125 10 20 IECD Cn1ncc2cc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)ccc21 1847037198 FNRQUVDZECDSMW-VMPITWQZSA-N 448.479 2.221 10 20 IECD Cc1nc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cn1C 72075722 GJQAUGOVVZDVEX-UHFFFAOYSA-N 447.605 2.482 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2cccc(O)c2)CC1 725865410 WDAJFHAWBKVGMD-UHFFFAOYSA-N 442.491 2.036 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C(=O)N3CCCC[C@H]3C)CC2)cc1 726616484 MWCNWSLRLYIYLN-UXHICEINSA-N 445.608 2.296 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NCCCSc2nccs2)cc1 736680392 KDGGLUSOLHYMQC-UHFFFAOYSA-N 442.588 2.069 10 20 IECD Cc1nnc(-c2cccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)o1 746136581 ZGHBBOJIHBQVFA-UHFFFAOYSA-N 426.498 2.210 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)C3CCN(C(=O)OC(C)(C)C)CC3)nc12 746662090 RTFMFXJJDLRKGZ-UHFFFAOYSA-N 433.509 2.443 10 20 IECD O=C(CN1CCC(=O)Nc2cc(F)ccc21)NCc1ccc(N2CCOCC2)c(F)c1 749844936 ARSRUNPEQUSWHQ-UHFFFAOYSA-N 430.455 2.266 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1cccc(-n2cnnn2)c1 751469524 XYFRLPCNWDIWSH-UHFFFAOYSA-N 438.307 2.341 10 20 IECD COC(=O)CCC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 753351515 XDQSEYBXQVWFOK-LJQANCHMSA-N 430.549 2.263 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccc(OCc2ccccc2)cc1O 753539741 SYJZEHHDWBRSLI-IBGZPJMESA-N 432.542 2.096 10 20 IECD COC(=O)COc1cccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759220962 LIYOFFNISYFXTL-UHFFFAOYSA-N 444.484 2.227 10 20 IECD CCS(=O)(=O)Cc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 762363005 LJIFZDTXZWTGLM-UHFFFAOYSA-N 429.501 2.239 10 20 IECD COc1ccc(N2CCN(C(=O)CNC(C)(C)C(=O)NCC3CCCCC3)CC2)cc1 767671498 NLRBWBCRPKZMHX-UHFFFAOYSA-N 430.593 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc5nc(O)oc45)n3)CC2)cc1 771065577 FYGXMSWWMHPLJW-UHFFFAOYSA-N 435.440 2.483 10 20 IECD CCOc1cnc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 778536672 VROQBQPWHVOSDM-HUUCEWRRSA-N 446.479 2.101 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCO4)cc2F)C[C@H](C)O1 782776910 VIBSTYBSHGUIDE-KBPBESRZSA-N 429.448 2.423 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3c[nH]nc3-c3ccccc3)cc2)C1 782777852 NOKDZZFDDUNZBC-GOSISDBHSA-N 446.511 2.033 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCCC(C)(C)CC3)CC2)cc1 785526192 DGLFYTXSANJEOT-UHFFFAOYSA-N 430.593 2.362 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 785563133 ZATAYFVQUYBNQR-QHCPKHFHSA-N 438.572 2.175 10 20 IECD O=C(NCc1ccc(-n2cncn2)nc1)C(=O)N(Cc1ccccc1O)C1CCCCC1 787258943 YVNZQXGLJOFBJG-UHFFFAOYSA-N 434.500 2.346 10 20 IECD Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843108 IQSOCJWQCSOGKX-KRWDZBQOSA-N 443.519 2.295 10 20 IECD CCC1(CC)[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H]1OC 789847520 SNZKIZCWROBQDN-PMACEKPBSA-N 435.540 2.113 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3cccs3)cc2)C1 793732558 IMZTXNBQBHSCNC-PKOBYXMFSA-N 440.569 2.430 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]2CCCC[C@@H]12 793735885 ZGXOGQBNHSNBFN-LGYWMIHWSA-N 426.561 2.042 10 20 IECD Cn1ncc2c1C[C@H](C(=O)OCC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CC2 798769226 YCZFVVZCQYEVLA-CQSZACIVSA-N 443.459 2.482 10 20 IECD CC[C@@H](C)[C@H](C)N(C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CC1 803750373 LWLPIXGBSJMGGR-MOPGFXCFSA-N 430.593 2.359 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)CC2)cc1 806334887 XCMYPDNVXOBIQG-REWPJTCUSA-N 429.609 2.476 10 20 IECD COCC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(C)o1 809692911 JEMDIIUVJKWGPA-FQEVSTJZSA-N 429.517 2.277 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C 810207507 KNRJVFHUWRCPLT-SFHVURJKSA-N 431.558 2.296 10 20 IECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C(F)(F)F)n1 815016028 WDYLJTCDYLGQLE-UHFFFAOYSA-N 432.468 2.126 10 20 IECD O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676138 AEMLXHABCGAMQF-UHFFFAOYSA-N 435.527 2.238 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCN(CC(F)(F)F)C3)cc2)C1 918116900 CAKANGITHQKOHF-DLBZAZTESA-N 441.498 2.072 10 20 IECD COc1cc(C)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 918309513 AATMWEXBNYHQAH-UHFFFAOYSA-N 427.501 2.446 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(OC)c1 918439148 TWUXXANFQYPWHM-UHFFFAOYSA-N 431.464 2.059 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 919088886 UDOYRYAMHCDWIO-IYBDPMFKSA-N 444.507 2.374 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C(F)(F)F)CCC1 1795921528 REHUIFYCGOFVIN-ZSBIGDGJSA-N 449.520 2.218 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc[nH]1)C1=NN(c2ccccc2)C(=O)C1 1796229400 ISCJWDAMXOQNCM-FNLKRUPLSA-N 433.512 2.378 10 20 IECD COCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620444 NYXNPGZCBFMUCQ-JHDGKUDLSA-N 425.529 2.334 10 20 IECD CSCC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1802365949 JNJKKJXHBOLSON-QVHKTLOISA-N 428.938 2.117 10 20 IECD COCCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809404161 BOGSNKIKQUYDHX-UHFFFAOYSA-N 426.517 2.047 10 20 IECD CN(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811802716 ABRNQCVFPFIPMQ-MGPUTAFESA-N 446.935 2.418 10 20 IECD C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499666 SLPDQEZJFDCZHC-MVBJNABHSA-N 435.575 2.308 10 20 IECD C[C@H](Cc1ccncc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1845765888 GIGYAWQJXPGCBI-MQDFFIGUSA-N 437.496 2.294 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1sccc1S(=O)(=O)N1CCCC1 108809049 BLCPBSJCSXSXII-UHFFFAOYSA-N 435.571 2.299 10 20 IECD CCN1CCN(c2ccc(CNc3ccc([N+](=O)[O-])cc3S(N)(=O)=O)cc2F)CC1 301212298 XOCNJUQCRIYMAB-UHFFFAOYSA-N 437.497 2.135 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)cc2)CC1 729062497 CGOILIKVWOEJER-MRXNPFEDSA-N 426.517 2.359 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729176911 GVNXAOHCYMCYOA-UHFFFAOYSA-N 449.433 2.045 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(CN2CCCC2)cc1 729325816 DLNCCPOKVQIDGC-UHFFFAOYSA-N 427.570 2.447 10 20 IECD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 729523519 PDZVIQPVOIMSSB-UHFFFAOYSA-N 441.507 2.250 10 20 IECD COC(=O)C[C@@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc21 741795296 YXPXEUMIALBLKM-GOSISDBHSA-N 441.503 2.445 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C[C@H](NC(N)=O)c3cccc(C)c3)CC2)cc1 742920713 MUQNXZXNEBQHJR-QFIPXVFZSA-N 439.560 2.042 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)NC(=O)OCc3ccccc3)CC2)cc1 742927404 QFYFBKCKDMQHCB-IBGZPJMESA-N 440.544 2.248 10 20 IECD CCO[C@@H](C)c1noc(CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 743859414 ZWPANZUBLAQECU-SFHVURJKSA-N 444.580 2.009 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc(O)ccc2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 745076966 PHPQSXJPQFISJK-UHFFFAOYSA-N 444.465 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3c(C)nc4nc(SC)nn4c3C)CC2)cc1 747470398 OVOUAEFZGUDTKS-UHFFFAOYSA-N 426.546 2.363 10 20 IECD CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748042704 MOBXGCPJRLFNEO-NEPJUHHUSA-N 425.532 2.288 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)n1-c1ccccn1 748116172 YWTHMWVVAXIYQZ-UHFFFAOYSA-N 445.413 2.424 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 750861817 ITVLRHFCBYUJHQ-UHFFFAOYSA-N 433.530 2.410 10 20 IECD O=C(NCc1cccc(Br)c1O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 765754869 XMLHQYBCAHMWHN-UHFFFAOYSA-N 431.246 2.230 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1 774363202 IFGZRDVQDWWEED-UHFFFAOYSA-N 445.431 2.196 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1 777632930 PPVRQUGKODSGLA-UHFFFAOYSA-N 448.457 2.205 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778313201 QAUUGSVPCFQLRV-CAGLQZERSA-N 447.601 2.096 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 781477786 ZKOONKZYGKGEAU-UHFFFAOYSA-N 441.484 2.128 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)c(F)c3)cc2)CC1 786121170 CDULBJUJNZHGLD-UHFFFAOYSA-N 427.448 2.251 10 20 IECD CCOC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 787364136 NSEVYRMSCREGCI-ULQDDVLXSA-N 435.540 2.472 10 20 IECD CCN(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccsc1 787613577 AFCLNMJSMYRGBS-OAQYLSRUSA-N 444.601 2.400 10 20 IECD COc1cc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc(OC)c1OC 787857643 UYHFZEIXNPXZOJ-CYBMUJFWSA-N 433.480 2.411 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 788401933 NJFCGIMCLWSRMM-LAUBAEHRSA-N 442.512 2.492 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@@H]1CCc2ccccc21 789840398 GYHURSCABMOXAC-SFHVURJKSA-N 425.504 2.249 10 20 IECD CS(=O)(=O)[C@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 800458819 VWULIPQMQQAYMC-INIZCTEOSA-N 440.521 2.300 10 20 IECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306727 WXZJCHZFYADTPQ-KNQAVFIVSA-N 430.593 2.471 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803661625 HXFAXWDFASANIG-GDBMZVCRSA-N 436.528 2.270 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](CCNC(C)=O)C3)cc2F)CC1 806750545 UVJTZKZRAVCJHP-LJQANCHMSA-N 433.572 2.415 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1=CCN(C(=O)OC(C)(C)C)CC1 807098470 YOYSIFOFOZWLMT-UHFFFAOYSA-N 430.549 2.361 10 20 IECD COC[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769396 FOMDSCPYRHIXQV-HZPDHXFCSA-N 425.476 2.258 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](n4cc(Cl)cn4)C3)cc2)C1 812009327 FTJCFDAINKHVNQ-VQIMIIECSA-N 430.940 2.395 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1Cl 918284740 QTDJFRZSCMIIKD-UHFFFAOYSA-N 449.866 2.357 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(NC(=O)C2CC2)c1 918333642 AECDWDFPDKQKGO-UHFFFAOYSA-N 427.526 2.200 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)CC2)cc1 1319624686 UTMVGNOWUJIOTE-UHFFFAOYSA-N 433.530 2.425 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(NC(=O)NC(C)C)CCCCC1 1344348013 KNMMRKJTECQBNQ-INIZCTEOSA-N 435.521 2.099 10 20 IECD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)n1cccc1 1782009289 VLWIODOKAOGLGR-LHSJRXKWSA-N 433.892 2.257 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cn2cccnc2n1 1800717881 AKXSIRSYWAPNNT-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2c(O)cccc12)c1cc(O)nc(O)c1 1801143231 ZFUAOPPPYRKVKG-QDMKHBRRSA-N 434.452 2.312 10 20 IECD CCOc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336060 RQVVAGTWPZPYIP-QDMKHBRRSA-N 447.582 2.197 10 20 IECD O=C(C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1)C1CC1 1805432363 KCGQOKPLVKKNAO-FNORWQNLSA-N 428.485 2.027 10 20 IECD CN(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806463149 IXWUGZHUTRWJOR-LIRRHRJNSA-N 432.908 2.027 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1 1810548823 IDGMVETYSDQLCP-UHFFFAOYSA-N 430.417 2.153 10 20 IECD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C1(O)CCC1 1817842797 OSXWHQKQIWFNNO-DOMZBBRYSA-N 429.477 2.073 10 20 IECD CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(NC(=O)C(N)=O)c2)C1 513900719 DTURSUPGIHTCLJ-UHFFFAOYSA-N 433.512 2.470 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1 729536880 NNHIKFRUBDYAAX-VIFPVBQESA-N 429.292 2.302 10 20 IECD O=C(NCCN1CCSCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732885762 MKOQRYKQKUKNRV-UHFFFAOYSA-N 432.512 2.390 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1F 742070918 BTWKTFZWQNTLSQ-UHFFFAOYSA-N 449.548 2.464 10 20 IECD COC(=O)c1cc2c(cc1NC(=O)C(=O)NCc1c(O)ccc3c1CCCC3)OCO2 753833416 AKPHHCYZKNXWAZ-UHFFFAOYSA-N 426.425 2.041 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C)c(NC(C)=O)c3)CC2)cc1F 754217669 WVEVLIJZUIVOSS-UHFFFAOYSA-N 428.464 2.388 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)nc2)cc1 769629702 BJIOKOKLIIHXPE-UHFFFAOYSA-N 427.504 2.211 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cs1 773630636 VAAHJFZLIABARJ-CQSZACIVSA-N 437.591 2.295 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1Cl 775089052 ZXASTYUHRGIDRC-OAQYLSRUSA-N 444.963 2.212 10 20 IECD CN1CCN(c2ccc(CN3CCN(c4ccc(NS(C)(=O)=O)cc4)CC3)cc2)CC1 775746908 HPOIBNNJCCTNHB-UHFFFAOYSA-N 443.617 2.132 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCn3cnc4ccccc43)CC2)cc1 778253635 RDIGSRVGXDONMZ-KHPPLWFESA-N 433.512 2.066 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H]1CC(=O)N(C2CC2)C1 780820318 IKWWHMAPFFYMNO-AWEZNQCLSA-N 440.466 2.352 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 785294150 CLJGYCXVWJAJIQ-LLVKDONJSA-N 439.390 2.076 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1 786734571 CPVGQRQSAROSED-UHFFFAOYSA-N 449.577 2.425 10 20 IECD C[C@H]1CCCN(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 787671674 PAGYDRSDEZCAKE-IRXDYDNUSA-N 438.519 2.221 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCN(c2ccccc2)CC1 788010520 MFNMNAKPTWPGAC-OAQYLSRUSA-N 447.583 2.006 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1-n1cccn1 788321867 CSXLESQDPGMBJD-SFHVURJKSA-N 433.512 2.203 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 788951135 IGCROADNPJHWDJ-UHFFFAOYSA-N 428.493 2.117 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCCC3)C2)cc1 788978436 XKMIRIFYZRNQNX-HXUWFJFHSA-N 428.577 2.446 10 20 IECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792474226 PJEKHBZMBVEVIX-STQMWFEESA-N 430.468 2.461 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCC1=O 793868468 KRFXKZFIZAHBFS-LBPRGKRZSA-N 433.442 2.152 10 20 IECD O=C(CN[C@]1(CO)CCCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 799335960 GGRNHLAGCJBVAA-DEOSSOPVSA-N 427.520 2.092 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)NC(=O)CCc3ccccc3)CC2)cc1 799413044 KFHHSXVBRZOZEM-HXUWFJFHSA-N 438.572 2.071 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1 800709966 OHSUBANZRGIJLQ-HXUWFJFHSA-N 447.605 2.468 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C1CCCCC1 803677031 DGTSKXXYFRJFPU-LJQANCHMSA-N 441.576 2.134 10 20 IECD CCN1CCCC[C@H]1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804420701 DITDQMOMAVLSSO-AEFFLSMTSA-N 438.519 2.364 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 808623074 XUHKHRIUMWXNSU-GOSISDBHSA-N 432.883 2.083 10 20 IECD CCOC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 811276392 LPTYWRPUSJJVAX-UHFFFAOYSA-N 444.459 2.312 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3nncn3C(C)C)CC2)cc1 813563796 NRUGUGSRTUQXBP-UHFFFAOYSA-N 429.569 2.221 10 20 IECD CCOC(=O)[C@H](F)C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 817690659 FKGNZGWWLMOAKH-MRXNPFEDSA-N 442.490 2.228 10 20 IECD Cc1cc(C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)c(C)n1-c1ccccn1 914903883 SVJSPHYLNUUYAN-SIKLNZKXSA-N 447.557 2.364 10 20 IECD CN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1 917311250 XQFYYUSIFGSMIJ-UHFFFAOYSA-N 427.320 2.434 10 20 IECD CCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918464772 ZTIVOAXBFVKYCF-GOSISDBHSA-N 438.528 2.432 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1 920482419 OMTOIVCMYSWYRG-UHFFFAOYSA-N 425.532 2.341 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2 1782007204 DREJTSMWAZJDNF-RBZFPXEDSA-N 440.949 2.338 10 20 IECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cs1 1796932681 RFCUKMMTRQEYCO-ACHSLPGTSA-N 437.525 2.496 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1805643640 XGTVGCOKXNYCOA-OAQYLSRUSA-N 440.544 2.027 10 20 IECD Cc1ncc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)s1 1810550714 RBCVCQPDVSEQRE-UHFFFAOYSA-N 430.530 2.345 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1[C@H]2SC=C[C@H]21 1812384970 VPLZXSAIAIILNE-ORDFMZHBSA-N 438.509 2.083 10 20 IECD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)ccn1 1817846226 LIGXJZADQSTOTM-HNNXBMFYSA-N 438.444 2.239 10 20 IECD O=C(c1n[nH]c2ccccc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441871 SUKSJICVJJYRDH-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CCC(CC)(NC(=O)C1CN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)C1)C(N)=O 561416799 JNGBQRNEFOQBKT-UHFFFAOYSA-N 442.560 2.137 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ccc(-n4cccn4)cc3)CC2)cc1 729875753 CFEQJHLRKHNHNK-HKBQPEDESA-N 438.553 2.478 10 20 IECD CCc1nsc(N2CCN(Cc3cc(C(C)=O)cc(CN4CCOCC4)c3O)CC2)n1 743395661 JVOOMBWGUKLDRW-UHFFFAOYSA-N 445.589 2.163 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c1 743911256 XSTDRDIOYJBEEK-AWEZNQCLSA-N 445.903 2.279 10 20 IECD CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745648656 SUNSYFONVWNAAK-HXUWFJFHSA-N 449.615 2.344 10 20 IECD COC(=O)[C@H](O)C1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 747402228 HZHHUBIBCFCDKO-GOSISDBHSA-N 441.475 2.212 10 20 IECD C[C@@H](CC(N)=O)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 748718258 HOQHCJCYNFAKQX-PPLKPFPSSA-N 442.360 2.030 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 751137325 PTWKACCHMLMXFG-OAHLLOKOSA-N 443.518 2.305 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(c4ccccc4OC)C3=O)CC2)cc1F 757284168 FCSVJTKSVNLQSY-SFHVURJKSA-N 442.491 2.480 10 20 IECD Cc1nc([C@@H]2CCCN(CC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C2)n[nH]1 760960132 NCAFWGCFNDTCQC-TXPKVOOTSA-N 444.555 2.362 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(-c4nc(CC)cs4)c3)nc12 762889197 OWZCPSVLVKWMEQ-UHFFFAOYSA-N 442.457 2.173 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccnn2-c2ccc(C)nn2)cc1F 773308982 JJBRPLQCCAPODC-UHFFFAOYSA-N 425.468 2.211 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)c2)CC1 780407731 ORROKUROISCKIP-UHFFFAOYSA-N 431.514 2.317 10 20 IECD COc1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)cc1C(N)=O 782896027 JNBNGUKUKYEJLE-UHFFFAOYSA-N 426.473 2.195 10 20 IECD O=C(NCc1ccccc1Cn1cccn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785639631 HKIZKMMVRNHCRA-QFIPXVFZSA-N 448.523 2.461 10 20 IECD O=C(NCCc1nnc2n1CCCCC2)C(=O)N(Cc1ccco1)Cc1ccccc1O 785924451 JFAXZTMSFSOOQB-UHFFFAOYSA-N 437.500 2.191 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 787189860 HXTOIDNMVVYXJA-HXUWFJFHSA-N 440.544 2.457 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(N3CCNC(=O)C3)ccn2)cc1 787907660 HYIXRYQCJFUVIO-UHFFFAOYSA-N 435.450 2.289 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1F 788758395 PKWHDFRGXAEPGE-HNNXBMFYSA-N 432.462 2.289 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CCCN(c2ccccc2)C1 789799778 LNZJKPWAMJBHIU-LJQANCHMSA-N 440.519 2.064 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccn(-c4ccccc4)n3)CC2)cc1 793657299 YFTDTPZWYUJISM-UHFFFAOYSA-N 433.512 2.236 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCC(=O)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796250889 MXGQQHRQESQNCI-ZBFHGGJFSA-N 446.525 2.473 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(Br)s2)cc1 797432939 ZCLKEVLJPYJTFV-UHFFFAOYSA-N 440.366 2.496 10 20 IECD COc1cc2c(cc1S(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)OCC(=O)N2 797442840 JLNYOHKBYSBIMC-UHFFFAOYSA-N 431.514 2.445 10 20 IECD CC(=O)N[C@@](C)(C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797495127 QULOMBTZTMEUHA-IVZQSRNASA-N 431.558 2.385 10 20 IECD O=C(CN[C@@]1(CO)CCCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 799335963 GGRNHLAGCJBVAA-XMMPIXPASA-N 427.520 2.092 10 20 IECD CC(C)Oc1cncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 801404746 KNEZVAQQVRRQJF-UHFFFAOYSA-N 431.464 2.318 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 802553002 VUTSUABWPLUWBD-CYBMUJFWSA-N 447.438 2.404 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803145854 AMPMNMNHMBRMFF-IBGZPJMESA-N 427.501 2.400 10 20 IECD C[C@@H](NC(=O)C(=O)NCC[C@@](C)(O)c1ccccc1)c1ccc(N2CCOCC2)cc1 803315490 JTLBBXBJUQSDFZ-HOYKHHGWSA-N 425.529 2.114 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@](C)(O)c3ccccc3)CC2)cc1 804319938 VUCIHKQDHICEJY-XMMPIXPASA-N 425.529 2.194 10 20 IECD O=C(NC[C@H]1CCCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 806040391 GPUBLPNARHHXJS-CQSZACIVSA-N 431.505 2.381 10 20 IECD COCCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 806626849 GUZQBFMYRMWIPA-UHFFFAOYSA-N 430.480 2.360 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O 808189491 SLNHCAJBWMIZMM-OAQYLSRUSA-N 437.544 2.196 10 20 IECD COc1cc(Br)cc(CN2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)c1O 809784799 NOHXJQRBHINLCM-LBPRGKRZSA-N 433.368 2.457 10 20 IECD Cc1nn(C)c2cc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc12 812991114 LKWUYXSJJZJFBL-UHFFFAOYSA-N 427.530 2.438 10 20 IECD C[C@H](C(=O)Nc1ccccc1S(C)(=O)=O)N(C)Cc1ccc(N2CCOCC2)cc1 857758630 PCEMNLYLBBKQFL-QGZVFWFLSA-N 431.558 2.386 10 20 IECD Cc1cc(CCNC(=O)CN(C)S(=O)(=O)c2cccnc2)c(C)n1-c1ccccc1 915141063 ULHWWVXMMLGEBK-UHFFFAOYSA-N 426.542 2.469 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(F)c3F)cc2)C1 917929229 AMNHAKRNECYWPT-ZDUSSCGKSA-N 427.448 2.284 10 20 IECD COc1cc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1OCCO 918224671 TTYARHVPSWOTIY-UHFFFAOYSA-N 433.480 2.041 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442237 CFCYZPCJVXLLNA-UHFFFAOYSA-N 440.500 2.329 10 20 IECD CCc1noc(C)c1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779638804 YBVMMYVFTVJADN-OAQYLSRUSA-N 449.891 2.367 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)F)C2 1804283342 SSQAKCMLNFXMHJ-NMHLOJTESA-N 432.370 2.355 10 20 IECD CCN(CC)C[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289629 MWEQGHMNFGVUPQ-OICROHLBSA-N 445.560 2.433 10 20 IECD Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805496115 QKAQCHRHVSCADS-IERDGZPVSA-N 433.468 2.225 10 20 IECD CC(C)(O)CC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809426687 KIIOXGKQRWEUQU-UHFFFAOYSA-N 440.544 2.172 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428154 KFHSYVSSCFUEBC-CRAIPNDOSA-N 446.548 2.031 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CCCSC3)CC2)CC1 1838032172 CJDIBGWGAIDGJE-OAHLLOKOSA-N 449.573 2.248 10 20 IECD Cc1cc(CCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccn1 1847033824 HNKLNTMOZZDTBS-VMPITWQZSA-N 437.496 2.356 10 20 IECD Cc1ncc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847037879 XNNDMCBPIUQFFJ-GQCTYLIASA-N 429.498 2.028 10 20 IECD COC(=O)C1CCN(C(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 10876538 WLHMGWKMDZBGIG-UHFFFAOYSA-N 435.432 2.030 10 20 IECD CCc1noc(-c2ccc(CCNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)n1 727860848 RJTMSYHFYFHDOD-UHFFFAOYSA-N 430.486 2.349 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 729784886 BSJRTGVQZQNMMD-UHFFFAOYSA-N 438.528 2.399 10 20 IECD CC(C)n1c(S)nnc1C1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 731828349 JVIFNPGAUTZTMF-UHFFFAOYSA-N 439.563 2.245 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc2nc(O)nc(O)c12 740741162 QBNPLYORNNEANY-STQMWFEESA-N 441.463 2.427 10 20 IECD CC(=O)c1cccc(O[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 745109376 RLAYKUPUFGJPOE-KRWDZBQOSA-N 430.526 2.208 10 20 IECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1-c1nnnn1C1CC1 753283324 QKICCLUERNFKRB-UHFFFAOYSA-N 428.474 2.313 10 20 IECD Cc1ccc2cccc(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2n1 754028231 PPDGLYIJUWPDCR-UHFFFAOYSA-N 445.566 2.257 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)c1 756336795 QAPJUDBAVAMOBY-OAQYLSRUSA-N 441.528 2.479 10 20 IECD COc1cc(N2CCN(C(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])CC2)cc(OC)c1OC 760086454 MJFDVKTZAAYIMT-UHFFFAOYSA-N 433.465 2.430 10 20 IECD COc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1NC(C)=O 765924763 AVHOLQYKIHBXDQ-UHFFFAOYSA-N 436.262 2.377 10 20 IECD CN(CCN(C)C(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 768928782 CUSFPQKZARUTGR-GOSISDBHSA-N 447.580 2.397 10 20 IECD CN1CCc2ccc(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C1=O 772904733 PCAPEGUKBVYARV-UHFFFAOYSA-N 426.492 2.019 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)O1 774773830 ZEHRGWSMCAUOPD-ROUUACIJSA-N 440.491 2.192 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(N(C)C)cc1 774809228 OHZVPQVBGHMSDA-LPHOPBHVSA-N 430.574 2.181 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccco1)N1CCCC1)c1ccc(N2CCOCC2)cc1 774871340 PSOHDOFQCYGXHI-NQIIRXRSSA-N 440.544 2.247 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3ccc(C[C@@H]4NC(=O)NC4=O)cc3)CC2)cc1 775702497 LHHGAHMUNKQAJH-FQEVSTJZSA-N 437.500 2.236 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC4COC4)cc3)CC2)cc1 782107503 KFTYVWLWUYVMML-UHFFFAOYSA-N 425.485 2.197 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cnc2c(c1)CCCC2 782778776 SQHIDEXINHFQAB-UHFFFAOYSA-N 426.492 2.316 10 20 IECD CCn1cc([C@H](O)CN(Cc2ccccc2)C(=O)C(=O)NCc2ccc(N(C)C)cc2)cn1 785432328 ANYBJPIDXSSEAI-HSZRJFAPSA-N 449.555 2.348 10 20 IECD C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788324654 XNTCNCKILIGZDL-UGKGYDQZSA-N 436.556 2.091 10 20 IECD CCOC1CC(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789823519 DVJGEBDAMDUYHO-HNXFYBAISA-N 435.540 2.377 10 20 IECD O=C(NCCCc1ccccc1F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844175 QDJNPGUGFJVYFJ-UHFFFAOYSA-N 431.483 2.291 10 20 IECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c(O)c1 794377990 RWLOUPQHZDQXDE-HNNXBMFYSA-N 449.485 2.026 10 20 IECD O=C1N[C@H]2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C[C@@H]2CO1 798367560 DNPWWDPZPUNCFT-PBHICJAKSA-N 442.438 2.182 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccnc3c2nnn3C)NC(=O)OC(C)(C)C)cc1 801162163 NOWYFSHLACFVAR-KRWDZBQOSA-N 439.520 2.425 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCc4ccccc4OC3)CC2)cc1 801442532 XKBKNKXTVCPDGL-DRUFCSCSSA-N 435.524 2.410 10 20 IECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2=O)cc1 803664768 RCJXQDBLWPIQAP-LJQANCHMSA-N 426.492 2.128 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)nc1 803688558 UHEHURAUBOJEIO-FQEVSTJZSA-N 449.555 2.266 10 20 IECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCCCSc3nccs3)C2)c1 804084001 ZMOXGHJZMYBGPA-OAHLLOKOSA-N 434.587 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCOc4ccccc4C3)cc2F)CC1 805007120 OBBRBWYTTOWZFX-UHFFFAOYSA-N 440.519 2.005 10 20 IECD O=C(CN1CC[C@@H](C(=O)N2CCCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 805813978 KVBIBCRVTYLURY-MRXNPFEDSA-N 431.492 2.345 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1nc2c(s1)CSCC2 806855514 OWPWXBKJFBKQSB-UHFFFAOYSA-N 446.598 2.396 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809243039 FZZGCBNMVZSGDV-QFBILLFUSA-N 432.565 2.473 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@H](C)O1 917710445 JFTTWUDRMIYLHH-HOTGVXAUSA-N 446.523 2.310 10 20 IECD CN(C[C@H]1COc2ccccc2O1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117866 RLVWLORFUVURPA-ICSRJNTNSA-N 438.528 2.370 10 20 IECD Cc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1780578599 ZZOGZUOOXFLHQT-RUZDIDTESA-N 446.507 2.231 10 20 IECD CC/C=C(\C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1791874386 HGMOGHDZSQBHGG-WOHHUZNTSA-N 430.501 2.153 10 20 IECD O=C(/C=C/c1cccnc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794153087 KVUZINTXHOCFHV-MEXLWANDSA-N 443.887 2.063 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc(F)cc(F)c1 1804335664 AFZCXCOUKGPUHG-QDMKHBRRSA-N 439.509 2.077 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnccc1F 1807824739 IGOZNIVKMXOGFD-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cnccc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992936 FBGIWSJFJYGLMM-VBKZILBWSA-N 437.431 2.055 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995690 TUPZDXNLCYNBOE-IERDGZPVSA-N 435.484 2.168 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)[nH]n1)c1cc(O)nc(O)c1 1817845098 YQZYKDVRCSVZKQ-AWEZNQCLSA-N 445.867 2.072 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCOC2)[nH]n1 1823479801 QPZIUBXIBUNCLY-YOFOWSBGSA-N 442.472 2.269 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)c2cn[nH]c2)CC1 1827801127 GPODGVRKQXMYAX-FZMUQLTDSA-N 440.500 2.473 10 20 IECD Cc1nnsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827816969 XNWWVKLRSGCISG-OAHLLOKOSA-N 431.518 2.200 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2)cc1 23752717 IOSYLHNGRUNOBB-UHFFFAOYSA-N 439.516 2.074 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(S(=O)(=O)N(C)C)ccc3C)CC2)cc1 104805521 VWBJDYVDDRWGQG-UHFFFAOYSA-N 446.573 2.015 10 20 IECD CCn1c(CCC(=O)NCc2ccccc2O)nc2cc(S(=O)(=O)N(C)C)ccc21 109677121 XNVCYZXRADWPPQ-UHFFFAOYSA-N 430.530 2.261 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccnc3-n3ccnc3C)CC2)cc1 726236193 IGBHTLBPZDVIAB-UHFFFAOYSA-N 449.559 2.206 10 20 IECD C[C@H](CCN(C)C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237460 MLCYUWRSEYKPBG-QGZVFWFLSA-N 429.544 2.082 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)OC(=O)c2ccc(C)c(O)c2O)c1 727005921 XOPYUKWDGWSVGT-NSHDSACASA-N 431.397 2.163 10 20 IECD Cn1cnc(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)c1Cl 727245039 SPJGNQDKJIDVID-UHFFFAOYSA-N 447.951 2.369 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1cc(-n2cnnn2)ccc1F 728119810 SJNBWNRFBNILGI-UHFFFAOYSA-N 425.468 2.332 10 20 IECD COc1ccnc(N2CCN(Cc3cc(C(C)=O)cc(CN4CCOCC4)c3O)CC2)c1 729468917 YZWNALWKHKVXHP-UHFFFAOYSA-N 440.544 2.153 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnnn1-c1ccc2c(c1)OCCO2 734982246 POYMWJCLQNIXIL-UHFFFAOYSA-N 440.529 2.250 10 20 IECD COc1ccc(Cl)c(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1 742976016 VJKCCKQFNYKQOO-UHFFFAOYSA-N 431.883 2.218 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@H]4[C@H](C3=O)[C@H]3CC[C@H]4O3)cc2)CC1 746237558 OVDLUVUQUSXHIE-FHKHNKIZSA-N 425.529 2.090 10 20 IECD O=C(NCCCN1CCCCC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060574 HVCABSJAAQEERE-UHFFFAOYSA-N 437.543 2.387 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771069372 YFWJNDYCSLHHGK-OAHLLOKOSA-N 441.937 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CNC(=O)CCC(C)C)n3)CC2)cc1 771081401 HDUANNHHNKUUGT-UHFFFAOYSA-N 429.521 2.022 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1 771215956 ZAFXVBJGTAGKLE-HXUWFJFHSA-N 446.507 2.269 10 20 IECD Cn1ccnc1[C@H](O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 771962581 JELHIIJWYOZNHP-HXUWFJFHSA-N 431.512 2.051 10 20 IECD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295604 XCYQWBAKNXGCQW-HNNXBMFYSA-N 425.485 2.328 10 20 IECD CCO[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCC1 789800729 OAIBSSHXJWGZAF-NRFANRHFSA-N 435.540 2.380 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC2(CCCC2)O1 789811790 IISGUJVDNFYUEU-UHFFFAOYSA-N 433.524 2.229 10 20 IECD CCCC[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734117 PYSVKUZYANLALE-SVFBPWRDSA-N 428.577 2.480 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)CCO1 803131007 FTPAFEYGPCFJCZ-FQEVSTJZSA-N 448.567 2.216 10 20 IECD CO[C@@]1(C)CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448336 OMRQCGQQRWWTGT-NRFANRHFSA-N 425.476 2.401 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1F 803662088 RCCJIEMPBSNHLC-HNNXBMFYSA-N 436.528 2.271 10 20 IECD COC(=O)c1cc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1C 809608030 GZHVOFSOXURBRD-UHFFFAOYSA-N 438.507 2.357 10 20 IECD C[C@H](OC(=O)c1cc2n(n1)CCO2)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 811351917 YORKDZBEWGJJSK-LBPRGKRZSA-N 431.404 2.235 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(F)(F)[C@H](CO)C3)cc2F)C[C@@H](C)O1 812858888 FGXJGSJNAGILLE-INMHGKMJSA-N 429.483 2.005 10 20 IECD C[C@H](C(=O)NC[C@H]1COc2ccccc2O1)N(C)Cc1ccc(N2CCOCC2)cc1 857758946 VLAMYBDNXOGIIL-NQIIRXRSSA-N 425.529 2.300 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1C(=O)O 917735746 RHIKHWBEZRLSTQ-UHFFFAOYSA-N 434.879 2.219 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918297837 UYFYSIIDWAMWED-NRFANRHFSA-N 441.528 2.479 10 20 IECD CCN1CCC(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 919784047 ZJIYEDNTSAZRTP-UHFFFAOYSA-N 441.555 2.226 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920923995 ZOOXIMVHJLKKLP-KRWDZBQOSA-N 427.501 2.364 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cc(O)n1 1804286492 RLENKTSFQOOZCB-ZURAMSNBSA-N 439.468 2.178 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1C 1804330788 FZQQDQOXWVBBOB-BCDXTJNWSA-N 445.610 2.344 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c(C)c1 1804335790 GENMNHCSHLEYSO-MUJYYYPQSA-N 431.583 2.416 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2[nH]cc3c2CCC3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994265 FHSHGFAACJEEML-ZHRRBRCNSA-N 447.495 2.338 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3c[nH]c4nccc-4c3)C2)CC1 1810637533 MJWWSNJGDLHDHF-UHFFFAOYSA-N 435.484 2.479 10 20 IECD Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)on1 1815713022 VSZNMBLUMZDVBA-HNNXBMFYSA-N 426.433 2.061 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)CC2CCC2)[nH]n1 1823501977 YTTPZPPDYZJABD-AWEZNQCLSA-N 435.575 2.452 10 20 IECD CCN(CC)C[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1824582072 RWVLWUJIVQHQSN-OCCSQVGLSA-N 447.561 2.153 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)C(F)F 1834455305 CVWWAKCRDXVQTC-UHFFFAOYSA-N 431.867 2.202 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c2cc(O)ccc2n1 1844020661 FLIBCVJCTWZZDC-UHFFFAOYSA-N 434.452 2.186 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCCN(C(N)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 10598722 UNCBPHHDAMKVFG-INIZCTEOSA-N 441.484 2.382 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 16134668 AISYPOIYWSKSEJ-UHFFFAOYSA-N 444.513 2.281 10 20 IECD Cc1nc(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cs1 24853890 QPFPIZKHKMLYDD-UHFFFAOYSA-N 447.538 2.475 10 20 IECD CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1OCC 108804832 CHBHJBTYPRMKCS-UHFFFAOYSA-N 441.528 2.367 10 20 IECD Cc1cc(C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1-c1cccc(Cl)c1 735822647 GTCWZTCPMDJIST-IBGZPJMESA-N 444.963 2.410 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1 737117988 OJYCKKIVQMZPSK-UHFFFAOYSA-N 446.573 2.179 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1C 741100279 XHUHXTNDCUMBAP-UHFFFAOYSA-N 442.541 2.388 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 742079775 MRAAUEVVMCJGCA-JOCHJYFZSA-N 436.556 2.459 10 20 IECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)N1c1ccccc1 745690497 CEAVXSAYBDSBPL-ZWCUEREDSA-N 449.555 2.382 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCS(=O)(=O)c1ccc(F)cc1 748982900 SFWDQKPJLNQDBS-UHFFFAOYSA-N 436.505 2.257 10 20 IECD COc1ccccc1NC(=O)CN1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 750296032 WYKYNXRWOSDWIV-UHFFFAOYSA-N 443.523 2.366 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H](O)c1cccc(F)c1 752878947 HEVVYGGOBMWFKU-UQASEVPWSA-N 428.508 2.449 10 20 IECD Cc1ccc([C@H](C)NCCOc2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc2)c(O)c1 756785148 AZQHVUMZIBJLBB-HNNXBMFYSA-N 442.559 2.156 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(N4CCOC4=O)cc3)CC2)cc1 758229670 FYCKJCXGCUSAMY-FQEVSTJZSA-N 427.501 2.214 10 20 IECD NC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 768545713 BPQWUAROEWXXHB-KRWDZBQOSA-N 449.485 2.350 10 20 IECD CCN1CCOC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 769080154 YURXGKKPTJLSSJ-LIRRHRJNSA-N 436.464 2.053 10 20 IECD CC(C)(O)[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770072086 WIOWUZKVEINTHG-GOSISDBHSA-N 449.485 2.477 10 20 IECD COc1ccc(N2CCC(NC3CCN(S(=O)(=O)C4CCOCC4)CC3)CC2)cc1 773003006 VJTVSNOJBOAHPJ-UHFFFAOYSA-N 437.606 2.227 10 20 IECD C[C@H]1[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 776718449 QXTWTLDZQMUXAE-STQMWFEESA-N 427.523 2.234 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1 784106678 MBLDKLRLRLLNLD-UHFFFAOYSA-N 430.530 2.339 10 20 IECD COCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 788463669 GKPVZSCYXMJFLG-UHFFFAOYSA-N 441.528 2.319 10 20 IECD C[C@H](O)C[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820934 RABFBGFHKWDCGC-BMFAXAFESA-N 435.540 2.208 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)N(C)[C@H](C)c3ccccc3)nc12 800499117 CGJSXCBHCMRKDC-OAHLLOKOSA-N 425.489 2.263 10 20 IECD CNC(=O)CNC(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 800595785 GPBFSJQXZVVSIY-LJQANCHMSA-N 440.500 2.081 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCN(c4ccccc4F)C3=O)ccc21 803688786 BFHDRHYRRDRQEK-IBGZPJMESA-N 438.503 2.136 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccnc(OC(C)C)c3)CC2)cc1 804317659 LEQXQWKRSCELFJ-UHFFFAOYSA-N 426.517 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(F)(F)Br)CC2)cc1 805249088 RJYVSFPNGFEXOA-VOTSOKGWSA-N 432.265 2.004 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCC[C@@H]1CCO 807771015 QZUHXLDYVAUPKN-NVXWUHKLSA-N 425.476 2.137 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 807842046 NRTMCWHWKFKEKG-FQEVSTJZSA-N 428.577 2.397 10 20 IECD COc1ccc(C[C@@](C)(O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 811868155 XUCLFLZNVFIPMJ-XMMPIXPASA-N 443.544 2.333 10 20 IECD Cc1cc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)n([C@@H]2CCS(=O)(=O)C2)n1 917073998 LVDHXXGOUUXGGE-HXUWFJFHSA-N 445.589 2.220 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 917833932 DMHQAPMTNFMION-RBUKOAKNSA-N 426.561 2.186 10 20 IECD C[C@H](NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(N2CCOCC2)cc1 920866231 ZNYVNDYMZIPLNM-AWEZNQCLSA-N 448.497 2.032 10 20 IECD Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920870455 FXGPDWFZBHVVFV-SFHVURJKSA-N 446.573 2.170 10 20 IECD O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NCc1ccc(N2CCOCC2)cc1 1317966807 NPVSGQYQFUNWJD-UHFFFAOYSA-N 429.561 2.339 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c[nH]c2c(C)cc(F)cc2c1=O 1341817008 WVEGBNHGSRGGLW-INIZCTEOSA-N 428.416 2.291 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1[nH]cc2c1CCC2 1811291856 PDRXNXDQOQMXKS-ZHRRBRCNSA-N 447.495 2.338 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)[nH]n1)c1cc(O)nc(O)c1 1817845099 YQZYKDVRCSVZKQ-CQSZACIVSA-N 445.867 2.072 10 20 IECD Cc1nccn1[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822879135 DQVGOOLYNKJNNM-WBMJQRKESA-N 439.476 2.288 10 20 IECD O=C(c1cc2cnccc2[nH]1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441645 LJFJIIBLQQXMJY-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CC(C)n1nccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844489822 LQNCJUWEUIHMJL-FNORWQNLSA-N 426.473 2.111 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2CCc3nc[nH]c3C2)C1 1846551674 OJOAMXIYFWISIM-LBPRGKRZSA-N 430.892 2.096 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 16134657 BUFUIVBVRNGOKC-UHFFFAOYSA-N 445.585 2.467 10 20 IECD CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 195596996 OPQQOFLPFFFNJJ-UHFFFAOYSA-N 431.493 2.302 10 20 IECD NC(=O)[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Br)cc1 729676999 WVXXNSVNBHTRMY-APWZRJJASA-N 445.361 2.467 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H](O)c1ccc(S(C)(=O)=O)cc1 732203091 OKGSPUCLDXXOSV-SFHVURJKSA-N 427.906 2.158 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cn1 742279506 WKILINIDPFMPLG-UHFFFAOYSA-N 430.299 2.298 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccn(CCN2CCOCC2)n1 743168782 LWWVFGXBQFFRKU-UHFFFAOYSA-N 430.578 2.090 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 747803009 ZAQXRWRSBLUULT-GOSISDBHSA-N 449.548 2.041 10 20 IECD CCOC(=O)NCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 751682659 DEOFWWAGNZAWFP-UHFFFAOYSA-N 444.511 2.085 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)Nc3ccccc3F)CC2)cc1F 756691999 MZPAYHTZGGXIPU-UHFFFAOYSA-N 431.487 2.497 10 20 IECD COc1cc(N2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 759238815 QQWRUEDHPVPIHY-UHFFFAOYSA-N 431.445 2.348 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H](NC3CCOCC3)C(C)C)CC2)cc(OC)c1OC 760454201 LQXVXQWFASNVAH-NRFANRHFSA-N 435.565 2.154 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc(N2CCOCC2)cc1 760546146 UGMBWGVWRORZFH-CQSZACIVSA-N 442.534 2.105 10 20 IECD C[C@@H]1CCS(=O)(=O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 763199036 ZJGWBFNCUCHGOK-CQSZACIVSA-N 449.495 2.261 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3nc(-c4nccn4C)cs3)CC2)cc1 768719455 OHJRLNMFJSKWTI-UHFFFAOYSA-N 440.529 2.276 10 20 IECD COCCOC(=O)C1=S=c2nc(/C(Cl)=C/c3cccc4nccn34)nc(O)c2=C1C 769606947 GGSLMKSBBATOEI-RAXLEYEMSA-N 444.900 2.097 10 20 IECD CCCCCCN(CCN1CCOCC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769733675 ZZHJKYFDHVOFNJ-UHFFFAOYSA-N 427.567 2.118 10 20 IECD O=C(c1cccc(O)c1O)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 776317575 GRLQOQXTNCDPHC-UHFFFAOYSA-N 441.303 2.007 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cc1 778255116 BNNVLPPIIXKLAW-VOTSOKGWSA-N 446.511 2.179 10 20 IECD C[C@H]1CCCCN1CCCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787903474 LUYPNVXBUICGBL-FQEVSTJZSA-N 430.593 2.252 10 20 IECD C[C@H](NC(=O)C(=O)NCCCCN1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 787914271 YNKNXWLVOUHJCE-UXHICEINSA-N 430.593 2.329 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H](C)c1cccnc1 793722963 MBIWDKMHSXWNFQ-FXAWDEMLSA-N 437.544 2.009 10 20 IECD CC[C@](O)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cl)c1 800436574 HMYZEZJZGPJOHQ-OAQYLSRUSA-N 436.961 2.489 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2cccc(F)c2)C1)c1ccc(N2CCOCC2)cc1 803308822 KTENLMYTSWJMCI-JTSKRJEESA-N 441.503 2.440 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3(CN4CCOCC4)CCCCC3)ccc21 803688612 WTVVFFGTGFESKP-UHFFFAOYSA-N 442.604 2.084 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H]3CN3CCOCC3)cc2)CC1 805026041 ZXXLGHVAPVNZDE-HSZRJFAPSA-N 442.604 2.252 10 20 IECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)N(CC)Cc3ccc(N(C)C)cc3)C2)ncn1 806270141 SOQLQWIHZIYHIO-HXUWFJFHSA-N 438.576 2.239 10 20 IECD Cc1nc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)sc1C 806279246 JFOIBOMAPLFXPA-UHFFFAOYSA-N 425.605 2.164 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(C(=O)N3CCCC3)CC2)c1 813060143 QRILZXLJUUDYER-UHFFFAOYSA-N 429.561 2.261 10 20 IECD CCCNC(=O)C1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 917008369 PSRGNFOVIVGQJL-HDICACEKSA-N 448.583 2.294 10 20 IECD CCN1C(=O)C(=CNC[C@H](c2cccc(OC)c2)N2CCCC2)C(=O)N(CC)C1=S 920980721 YJFBTDQOKQBGTJ-LJQANCHMSA-N 430.574 2.301 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 1116570500 AACAURGCZGACSM-RKVPGOIHSA-N 443.500 2.011 10 20 IECD O=C(COC(=O)CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCOCC2)c(F)c1 1322483475 FOHOXMFOOLVXJX-UHFFFAOYSA-N 442.487 2.389 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3CCCC[C@H]3C)CC2)cc1 1325006061 GAYUZOWOBMIIAA-YVNCXZRQSA-N 428.577 2.281 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779171250 MPGWFCZSWJVICL-ZUOKHONESA-N 426.897 2.008 10 20 IECD CC(C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004478 WLJZTZLYUYIZKK-FQEVSTJZSA-N 426.897 2.010 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1ccccc1 1789427208 KQHIRVAXIVLPQS-VCOUNFBDSA-N 446.507 2.073 10 20 IECD O=C(CCc1cncnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715716 XARBIAZLTFCHAN-MUJYYYPQSA-N 430.892 2.426 10 20 IECD Cc1noc(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805530809 BELBYJUBTZZFND-YWZLYKJASA-N 437.456 2.126 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@@H]1CCOC1 1822957581 PADWBCQFGDKIJU-HMQGTJFBSA-N 442.472 2.269 10 20 IECD CO[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823713906 UJYXISICNQPRFI-SCZZXKLOSA-N 425.894 2.468 10 20 IECD COc1cc(F)ccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037903 YYUMWUSZOZUCKB-XBXARRHUSA-N 442.443 2.482 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3CN3CCCC3)CC2)cc1 729587096 OBCZVCFUMCINPF-QFIPXVFZSA-N 429.609 2.477 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)cc2F)CC1 730391412 MNFMTAYRMJMKQK-UHFFFAOYSA-N 443.479 2.439 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3[nH]cc4c(=O)ncnc3-4)c2C)cc1F 730658300 SSOZCNDEPPDNNM-UHFFFAOYSA-N 437.431 2.352 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1C(=O)NC(C)C 731286446 XHYDRVZWGKRUQL-UHFFFAOYSA-N 438.528 2.225 10 20 IECD COc1ccc(N2CCN(C(=O)c3nnn(-c4ccc5c(c4)OCCO5)c3C)CC2)cc1 731453592 NHVRTKHTVFQGPW-UHFFFAOYSA-N 435.484 2.318 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 742049915 HXMFPOSAMNPFIJ-MRXNPFEDSA-N 435.594 2.207 10 20 IECD CS(=O)(=O)c1ccc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 749751497 LIOTUWVYTZRNGR-UHFFFAOYSA-N 438.546 2.474 10 20 IECD C/C=C(\C)C(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 750895434 IBSOQANIXZAWKA-XHWQJNAXSA-N 448.522 2.242 10 20 IECD COCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227023 AGGSSOOUKVJNFK-UHFFFAOYSA-N 438.521 2.291 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc4c3oc(=O)n4C)CC2)cc1 753348758 LBQXHDNEQLTWRL-UHFFFAOYSA-N 439.516 2.474 10 20 IECD CCn1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 757247772 LUWMFYMDILMDHH-UHFFFAOYSA-N 425.411 2.013 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1S(C)(=O)=O 758983905 ULEIFSVLDNPWBC-MRXNPFEDSA-N 445.541 2.051 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)CC2)cc(OC)c1OC 759984560 DBEFSNRZSIFIAI-GOSISDBHSA-N 445.520 2.442 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnc1Cl 760095047 DKJYGDCLJKVHQP-HNNXBMFYSA-N 429.908 2.000 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1 761276511 YKEDCXDRGCTQGP-UHFFFAOYSA-N 441.575 2.310 10 20 IECD CCNS(=O)(=O)c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 762157463 JPFZQIQNJUOUGJ-UHFFFAOYSA-N 437.905 2.308 10 20 IECD CC(C)NS(=O)(=O)c1cccnc1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 763034395 HRZUQIVVCAXAEH-QGZVFWFLSA-N 431.562 2.082 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 767495523 VEGLFLUVVYZHRJ-LJQANCHMSA-N 449.548 2.280 10 20 IECD COc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 774789674 USVUBGZJNLKSFZ-HZPDHXFCSA-N 429.492 2.381 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)n1nnc(-c2ccccc2)n1 777829411 WNZNWGWDCMPMJM-ZDUSSCGKSA-N 429.864 2.462 10 20 IECD Cn1cnc(-c2ccc(OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)n1 786758306 MRUJBEBMWOPIPP-UHFFFAOYSA-N 425.464 2.153 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1 787736927 NGEZSBRQGPZVQG-QFIPXVFZSA-N 438.572 2.236 10 20 IECD Fc1cc(CN[C@@H](c2cccnc2)c2nc[nH]n2)ccc1N1CCN(c2ncccn2)CC1 788564564 WSFHYXQYESNPIM-NRFANRHFSA-N 445.506 2.335 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@](C)(C4(C)CC4)C3=O)cc2F)C[C@@H](C)O1 789655427 YSRZUIUXCVSOJD-WBPRFABPSA-N 446.523 2.166 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3CCCCCCC3)cc2)C1 793731586 FUVJCOIHCSZRQV-HXUWFJFHSA-N 428.577 2.481 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1ccc(N2CCOCC2)cc1 796390986 DBLCGIOIPHGUJO-UHFFFAOYSA-N 447.557 2.165 10 20 IECD Cn1ncc2c1C[C@@H](C(=O)OCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 798767057 YIJQWCHXCRBGRS-AWEZNQCLSA-N 443.459 2.482 10 20 IECD COc1cc(N2CCN(c3nnc(Cn4nc(C)cc4C)n3C)CC2)cc(OC)c1OC 800741959 MEPQIFXXNZLIMX-UHFFFAOYSA-N 441.536 2.029 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(=O)OC)C1 802530898 GBABRYXFXIAAMK-HXUWFJFHSA-N 439.516 2.377 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C(C)(C)N3CCCC3)cc2F)C[C@@H](C)O1 805608912 JXLNPNKGIADYTA-IAGOWNOFSA-N 435.540 2.473 10 20 IECD CCN(CC)[C@@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771226 TXMONZRJSICIIK-FUHWJXTLSA-N 438.519 2.316 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2n1 810396641 LYIUFZROHFMYKM-INIZCTEOSA-N 442.907 2.116 10 20 IECD CCCN(C(=O)[C@@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 914903515 MWXZVKICPQHBFQ-MSOLQXFVSA-N 447.557 2.460 10 20 IECD NC(=O)COc1cccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 917380681 LFBKTMZORSIAAR-UHFFFAOYSA-N 437.418 2.336 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918436767 BVNXZWNBCJCFIB-UHFFFAOYSA-N 431.489 2.420 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2ccc(F)cc2)CCOCC1 919985507 JGJKVPVTWBZPTO-UHFFFAOYSA-N 446.544 2.425 10 20 IECD CC(C)(C)OC(=O)NCc1cnn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1319427285 LMILDMXCEMXSKR-UHFFFAOYSA-N 447.511 2.200 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O 1325762001 GOONCKSDFDYPSV-SJORKVTESA-N 446.887 2.395 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 1338534414 BZQFTSOJUBLHJA-VBURHUQHSA-N 448.516 2.335 10 20 IECD CC[C@@H](NC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620427 MEYPOIAOYMPOTG-IRMYBRCSSA-N 438.572 2.295 10 20 IECD Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995178 DSWBAHVUFDUOME-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cc[nH]c4nccc3-4)C2)CC1 1810631615 MRQJEDAVXUJGPP-UHFFFAOYSA-N 435.484 2.479 10 20 IECD Cc1[nH]nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816229946 NIYKVEAKERJTDV-LBPRGKRZSA-N 429.412 2.006 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc[nH]1)CC2)c1cc(O)c(O)c(Cl)c1 1823709113 ZOHXRFPORFKCLQ-SECBINFHSA-N 433.877 2.470 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825335634 YTJZERVKBSGHNM-QFBILLFUSA-N 441.532 2.259 10 20 IECD COc1ccc(CC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1842719853 KFCDBISJXNQBLY-UHFFFAOYSA-N 446.507 2.234 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 444641656 GLVMEAJYHCACFI-UHFFFAOYSA-N 425.426 2.106 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)n(C)c2ccccc12 557934110 BAOQRIWVKHQMKJ-HXUWFJFHSA-N 446.551 2.453 10 20 IECD Cc1cc(C(=O)NC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c(C)o1 727488621 BPEKHHYKWUVVCA-UHFFFAOYSA-N 435.502 2.008 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 732061470 LEICRCGISPHRTA-QGZVFWFLSA-N 444.513 2.414 10 20 IECD NC(=O)CCn1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 735451442 JXANGYKHKCUZAU-QBFSEMIESA-N 449.583 2.440 10 20 IECD CC(=O)N1CCCc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc21 736330456 VWGBTRAXFNNBIR-UHFFFAOYSA-N 429.542 2.301 10 20 IECD Cc1cc(C(=O)O)cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1C 748674870 PWXUZBJZTKYMMC-UHFFFAOYSA-N 438.527 2.037 10 20 IECD COC(=O)Cc1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c(F)c1 758230996 MXCJPRMQWVFYTH-LJQANCHMSA-N 432.492 2.112 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc(OC)c1OC 759102399 MYDTVTNXLKRNHW-UHFFFAOYSA-N 427.910 2.272 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1 759502259 YFZBQGXETPUREV-UHFFFAOYSA-N 435.521 2.471 10 20 IECD COc1cc(N2CCN(C(=O)c3ccccc3NS(C)(=O)=O)CC2)cc(OC)c1OC 760086261 SNPVFGIIPYOSLR-UHFFFAOYSA-N 449.529 2.046 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1Cl 765904801 WRYOKQMAXHZGAK-UHFFFAOYSA-N 426.654 2.162 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765931584 OGKCQZLLCCRRAD-UHFFFAOYSA-N 440.681 2.423 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H]2CCCC[C@H]2N1 769025651 WUTYWKFSRGGMEX-MSOLQXFVSA-N 440.466 2.495 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(-c1ccc(N3CCN(C)CC3)cc1)n2CCOC 771513475 MABMTKLVXCWZRY-UHFFFAOYSA-N 440.548 2.164 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1 772775704 OCEMRJOVXRSHBV-GJIAFCOMSA-N 448.497 2.368 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCCCS2(=O)=O)NC(=O)OC(C)(C)C)cc1 773194311 WBPMVOIIOPKAGR-MSOLQXFVSA-N 439.578 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 778236284 WUGDHXQLORCORK-ZNFPLGDCSA-N 449.511 2.359 10 20 IECD CN(C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)C(=O)OC(C)(C)C 785439821 WKCKXJAXLSZEEK-SFHVURJKSA-N 432.565 2.474 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)c3ccc(Cl)cc3)cc2)CC1 786254311 CDPMCNJABKGRNK-MRXNPFEDSA-N 442.947 2.443 10 20 IECD COc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)c2C)cc1 786655699 HKQBGOPPGQOUPV-UHFFFAOYSA-N 448.527 2.183 10 20 IECD CN(Cc1ccccc1O)c1nc(N(C)Cc2ccccc2O)nc(N2CCOCC2)n1 786794203 WRFFHHZFLZRXAW-UHFFFAOYSA-N 436.516 2.392 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCC3CCOCC3)cc2F)C[C@H](C)O1 789821416 SQOOYHMFQLOOBV-IRXDYDNUSA-N 435.540 2.331 10 20 IECD CC(C)(C)C[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734105 PRTKOLVRYIZVHT-ICSRJNTNSA-N 428.577 2.432 10 20 IECD CN(C)[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cncn1C 798163607 YIANNWRGMLQNMH-SFHVURJKSA-N 425.455 2.195 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCN(C)C(C)(C)C3)cc2F)C[C@@H](C)O1 799364897 PZFCEWJIFJAGKR-HDICACEKSA-N 435.588 2.265 10 20 IECD CN(Cc1cc(Br)cn1C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686822 HVISTCSFVZVCBG-UHFFFAOYSA-N 433.350 2.445 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(OC)cc3C)cc2F)CC1 805008767 BJPZJXHDOUZFFC-UHFFFAOYSA-N 442.535 2.217 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 815420599 UMCUMWRLFJPZPR-HNNXBMFYSA-N 426.473 2.057 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCOc3cccc([N+](=O)[O-])c3)CC2)cc1 915447586 AOSGFHNZOKTYHW-UHFFFAOYSA-N 443.456 2.264 10 20 IECD COc1cc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)ccc1OCC(N)=O 916624515 CYHPIGKBGWQXNW-UHFFFAOYSA-N 444.557 2.112 10 20 IECD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 916639147 IJTSCPOYDQKAQM-UHFFFAOYSA-N 447.580 2.411 10 20 IECD Cc1ccccc1N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 917000855 ZANPCWRZRDQPHH-UHFFFAOYSA-N 426.536 2.409 10 20 IECD O=C(CN1CCC(CC(=O)N2CCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917055574 PKSPTXYYQQNMAR-UHFFFAOYSA-N 446.567 2.003 10 20 IECD COCCN1C(=O)c2ccc(C(=O)Nc3cccc(N4CCCC4)c3)cc2S1(=O)=O 917697637 FNUUXVKFPIDVQH-UHFFFAOYSA-N 429.498 2.330 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC(=O)Nc3ccc(F)c(F)c3)cc2)C1 918117445 KUTIGQLDPFZBLH-OAHLLOKOSA-N 445.470 2.104 10 20 IECD Cc1ccc(CN(CC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccc3c(c2)OCCO3)s1 1319378412 XDPPLRFIRDUVDU-HNNXBMFYSA-N 436.555 2.138 10 20 IECD Cc1ccnc(O)c1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1321447805 HBAJRWLROFKUES-HUUCEWRRSA-N 431.464 2.322 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)nn1 1800716698 WGDJSNGGXFDZNM-CLLJXQQHSA-N 432.864 2.115 10 20 IECD CC1(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CCC1 1814185223 NPJVJZINCOSTIA-CRAIPNDOSA-N 446.598 2.138 10 20 IECD Cc1nc(N)sc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826969985 PZGAXCGEMFJNQM-OAHLLOKOSA-N 445.545 2.387 10 20 IECD O=C(CCc1ccco1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837181553 VLTSTRCVSKTGKO-UHFFFAOYSA-N 443.500 2.331 10 20 IECD O=C(c1ccc2c(c1)COC2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441544 HCKZNFLHHHPRLV-UHFFFAOYSA-N 444.491 2.327 10 20 IECD COc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2c1 1843747100 ZZKJXYUKBWMKBA-UHFFFAOYSA-N 434.452 2.180 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(-c3cccs3)on2)C1 1844473392 CPJUWONKAHRDGZ-UHFFFAOYSA-N 426.454 2.340 10 20 IECD CC(C)n1nccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038316 LRFDIPPDFXTIIW-FNORWQNLSA-N 426.473 2.111 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)CC2)cc1 21857106 TXQOLEUYWSIITF-IBGZPJMESA-N 441.459 2.152 10 20 IECD CN1CCC(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 729599272 DPCJMNLDUJTPBM-UHFFFAOYSA-N 441.555 2.083 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(CC(F)(F)F)c3)CC2)cc1 741071944 LHJRGWLUPHNJGN-UHFFFAOYSA-N 426.443 2.398 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)c1 744364986 JQCOFVOUGWOXRV-UHFFFAOYSA-N 429.542 2.427 10 20 IECD O=C(COC(=O)[C@H]1CCc2c[nH]nc2C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 745623484 SZHUNKLWXIYPCB-ZDUSSCGKSA-N 429.432 2.472 10 20 IECD C[C@@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749847458 CIZSUSAAJNBMAM-QGZVFWFLSA-N 435.590 2.013 10 20 IECD COCCOCc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754212685 OLMIRIDXAKCZNU-UHFFFAOYSA-N 445.491 2.285 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4cc(F)ccc4oc3=O)nc12 754596205 NTEWZYLECNDJFE-UHFFFAOYSA-N 427.344 2.214 10 20 IECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1 756411916 RAPYMVDRRKRNPD-MRXNPFEDSA-N 448.541 2.192 10 20 IECD COCc1ccccc1CNC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759878280 LFSQXNXQHVRKDR-UHFFFAOYSA-N 443.544 2.297 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)CC2)cc1F 765136227 UYPWRXPQLWXKIY-UHFFFAOYSA-N 445.516 2.181 10 20 IECD COC(=O)/C=C\c1ccc(OCCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 767513533 HBLBESYTBKRYBA-YHYXMXQVSA-N 435.454 2.186 10 20 IECD CC(C)[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768520746 ADRSVYXSPNWPLO-KIMHZCHSSA-N 434.512 2.022 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c1 769529561 GBOKACLLUIVPDL-JTQLQIEISA-N 433.258 2.464 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(CCO)Cc1cccnc1 770048374 GRFBVRSWHMPQBE-UHFFFAOYSA-N 433.511 2.284 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1)c1ccc(N(C)C)cc1 773858921 RSFGJPZAPVKYDV-HZPDHXFCSA-N 449.515 2.360 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(=O)(=O)Cc4ccccc4)CC3)cc2)CC1 775646917 QKCZWVUIBLYXOE-UHFFFAOYSA-N 428.602 2.086 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 778391269 VEJACWWUYNFDAX-YRTIDYAOSA-N 445.585 2.071 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)N3CCOCC3)CC2)cc1 784392521 IDKDARLQTAAXLF-FGZHOGPDSA-N 427.545 2.221 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(N(C)C)cc1 787736520 KPEHZZBMKCJOFP-XXBNENTESA-N 437.588 2.035 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(NC(=O)c2ccccc2)CC1 788909821 HUSPDDDERSNESB-UHFFFAOYSA-N 434.540 2.324 10 20 IECD COC[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789821553 TXGUPYRXBAQWFQ-ZHALLVOQSA-N 435.540 2.331 10 20 IECD CN(C)c1ccc([C@@H](CNS(=O)(=O)C[C@@H]2CCCO2)NC(=O)OC(C)(C)C)cc1 795248656 ITALETORSIKDHY-ZWKOTPCHSA-N 427.567 2.417 10 20 IECD C[C@@H]1C[C@H](N2CCOCC2)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796378455 QQQQQEKESKELMZ-AEFFLSMTSA-N 433.508 2.196 10 20 IECD CCCN(CCN1CCCC1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 804441388 LTDCAPXRDGWPIT-ZHACJKMWSA-N 428.577 2.234 10 20 IECD CO[C@@]1(C)CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768699 OVRICLBMEFUZEH-BTYIYWSLSA-N 425.476 2.401 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1 807769647 ICMKWBHDPPJCSN-BRWVUGGUSA-N 437.487 2.258 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1=CCN(C)CC1 807771234 TYVQVGANLBOGJJ-NVXWUHKLSA-N 436.503 2.140 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCO[C@@]4(CCOC4)C3)cc2Cl)C1 807954418 RDVRYAYYWBCONS-AOMKIAJQSA-N 435.952 2.210 10 20 IECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)nc1 808853862 JCEWKTURQORACQ-UHFFFAOYSA-N 435.572 2.197 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ncccn3)cc2F)C[C@@H](C)O1 812603522 XZSKZWQJWVGJLJ-HZPDHXFCSA-N 430.480 2.022 10 20 IECD CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 816890916 CBMXLIIITAJFFV-QEEYODRMSA-N 441.569 2.162 10 20 IECD C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 916197097 NOUBNTVXQVVCDI-INIZCTEOSA-N 432.546 2.073 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21 918309641 CUMLQBVADGWSSH-NRFANRHFSA-N 434.540 2.497 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 919810496 ZLCMIDOBTRNBSC-UHFFFAOYSA-N 441.531 2.094 10 20 IECD O=C(C[C@@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003998 RGHBCJSIQHGDHC-BTYIYWSLSA-N 438.908 2.154 10 20 IECD CC(C)n1nccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007420 RFKREDVVHITVKM-NRFANRHFSA-N 448.907 2.286 10 20 IECD COc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787087391 MCVLKICOZMQAJE-UHFFFAOYSA-N 435.440 2.353 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cccnn3)cc2)CCC1 1789726163 DNBGDPLLIGFHOB-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1C[C@]1(F)Cl 1791372600 BJTWNWXCTJNGQS-LGZKAGKASA-N 447.290 2.269 10 20 IECD COc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1795327750 NZHUFVUFRRGRLP-CLLJXQQHSA-N 432.864 2.115 10 20 IECD Cc1ccn(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933014 KRFLPBMWXZAWHO-GGPHIMKMSA-N 433.512 2.378 10 20 IECD CCc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807992918 FADUMFZRCQNBRF-JTSKRJEESA-N 447.495 2.479 10 20 IECD Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808788659 MSPKPPZDNOEQNM-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294783 QSHWOASVQKQFSZ-BONVTDFDSA-N 449.895 2.305 10 20 IECD CNC(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736446 CNOCFIVOUHTAAM-INIZCTEOSA-N 437.924 2.121 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(Cl)cn2)C1 1844444877 CKECZDFIGVQUKH-XVNBXDOJSA-N 429.860 2.382 10 20 IECD Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCN(c2ncnc3c2cnn3C)CC1 26529768 LDYMQOMDXZNBPQ-UHFFFAOYSA-N 448.556 2.205 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](CN4CCOCC4)C3)cc2F)CC1 303462539 ONTIAFBCNNUTKM-OAQYLSRUSA-N 447.599 2.221 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccccc3C(F)(F)F)cc2)CC1 726975474 BKSOLAPHQQQIPQ-UHFFFAOYSA-N 448.488 2.419 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@H]4CNC[C@@H]4C3)c2C)c1 728914015 LHTWHQMABSUQBO-RTBURBONSA-N 439.512 2.001 10 20 IECD COc1ccc(N2CCN(C(=O)COc3ccc(NC(=O)c4cnn(C)c4)cc3)CC2)cc1 731841677 LLFYNKKFEXUFKE-UHFFFAOYSA-N 449.511 2.409 10 20 IECD O=C(C1CCN(c2ccc3nncn3n2)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 731858424 LCJIBGSPEBODFZ-IBGZPJMESA-N 436.516 2.254 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(-n3cnnn3)ccc2F)cc1F 737192130 VZDNHFAITXANJH-UHFFFAOYSA-N 429.431 2.042 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)OCCOCCO 740212726 SPKVGNNCZCXNEZ-LCYFTJDESA-N 446.344 2.202 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc4ccn(C)c4c3)CC2)cc1 743880606 WUIFISNYEYIYEJ-UHFFFAOYSA-N 449.555 2.454 10 20 IECD CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 746757575 OYWUVCLUDCBHJS-RBBKRZOGSA-N 445.608 2.031 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1F 747859850 GBLVDQRAYSBESC-UHFFFAOYSA-N 435.477 2.115 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3[C@@H](O)C(F)(F)F)CC2)cc1 750634425 KDDYZBVVVAOTBT-RTBURBONSA-N 444.498 2.305 10 20 IECD COc1nc(N2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)ncc1Br 751071922 BYUFJLWPCPCOGO-UHFFFAOYSA-N 449.353 2.346 10 20 IECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c([N+](=O)[O-])n1 754791548 ITLFECYSINYTNG-STQMWFEESA-N 441.485 2.042 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(C(F)(F)F)nc1 761893484 OIRDBEAKXJEKSL-UHFFFAOYSA-N 440.397 2.456 10 20 IECD O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 766812179 HXXVKJZFYQJEEP-UHFFFAOYSA-N 433.530 2.466 10 20 IECD Cn1ccnc1[C@H](O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 772593971 UBVSPPSWRBXJTC-OAQYLSRUSA-N 445.539 2.176 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)cc1F 776041180 IOSGPZNVQMUXQQ-UHFFFAOYSA-N 443.447 2.488 10 20 IECD CCn1nc(C)c(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778254627 PBVSCPABUZLFRD-KHPPLWFESA-N 425.533 2.050 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](c4ccc(F)cc4)C3)CC2)cc1 779219105 HVYOBJWYBMHCHK-VWNXMTODSA-N 429.536 2.391 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 780984795 YLMQIWRAARSUKD-UHFFFAOYSA-N 440.905 2.215 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN3C(=O)N(CC(C)C)C[C@H]3C2)c1 782883446 JZTPNOUZIQLXSR-JOCHJYFZSA-N 444.576 2.005 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(CN3CCOCC3)cc2)cc1 785478500 FRSMASGLWNQYCW-UHFFFAOYSA-N 438.572 2.298 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)CC1 786070469 RAZQIVYJEATSMD-UHFFFAOYSA-N 432.502 2.279 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](NC(N)=O)c3cccc(C)c3)cc2)CC1 786258737 GVEQDSZPHRLJOF-JOCHJYFZSA-N 437.544 2.079 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1cccnc1N(C)C 787632320 RAPHURDSVRQAJP-UHFFFAOYSA-N 435.322 2.281 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](c2ccc(F)cc2)O1 788324873 ZBSICTFNZLUCPL-HTAPYJJXSA-N 441.503 2.267 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3CN3CCCC3)cc2F)C[C@@H](C)O1 789822938 BRPKFELTDGDQRJ-GGPKGHCWSA-N 446.567 2.142 10 20 IECD COCC1(C)CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789834537 MRZKRGYAVVEFHV-IRXDYDNUSA-N 435.540 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3COc4c(C)cccc4C3)CC2)cc1 794167465 IQYNYPOXPHIXEM-PISNEZEASA-N 435.524 2.328 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)cc1 799121814 ONODXCASJQOYIU-UHFFFAOYSA-N 428.488 2.044 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc(N2CCOCC2)cc1 803308157 BEPFPAHOPRXKKR-INZIPBBXSA-N 443.569 2.096 10 20 IECD CCN1CCO[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 805468565 HGCVJRBTPLNTOQ-QFIPXVFZSA-N 428.485 2.312 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(N(C)C)cc1 807469629 JNWGFWISIHWPSA-YDHSSHFGSA-N 438.572 2.336 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676617 HSWKIMKFOTWORI-FCEWJHQRSA-N 448.564 2.070 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cc(COC(C)(C)C)on1 807886791 GUHPILJLYLKIBH-UHFFFAOYSA-N 444.532 2.101 10 20 IECD NC(=O)c1ccc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917707619 QPOUUKUXOVDBHM-UHFFFAOYSA-N 448.476 2.078 10 20 IECD CNC(=O)Cn1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 918634704 QMOSQBHZKHKNSC-RIYZIHGNSA-N 449.583 2.311 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]3OCCC[C@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1340897163 FBWLZOYZPMLYMM-HTAPYJJXSA-N 431.558 2.425 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cocn1)C2)c1cc(O)c(O)c(Cl)c1 1781121133 FJLUFNKFOXHLRM-OXQOHEQNSA-N 435.864 2.181 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)Cn4cccn4)CCO3)C2)cc1 1781754219 UNFSWZGVORRQAO-VWLOTQADSA-N 447.539 2.434 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccco1)C2 1783220230 VAVWGTFNTNUWOM-WZMUZEJKSA-N 442.468 2.237 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)sc2C1)c1cc(O)nc(O)c1 1824654091 PQCUQFGFYPGZHZ-SRDTZFQFSA-N 430.511 2.050 10 20 IECD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NCc2ccccc2O)CC1 727602639 USFREDNAWXNARY-UHFFFAOYSA-N 432.565 2.469 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(CC(C)(C)O)CC3)c2C)cc1 728926252 GQHSFOIXIUESHV-UHFFFAOYSA-N 427.545 2.452 10 20 IECD CC(=O)[C@@H]1CC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)=NN1c1ccccc1 733532628 BHMGGUXSAMTJET-QFIPXVFZSA-N 436.512 2.478 10 20 IECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 737131630 SCTVXKWUGLMMGI-UHFFFAOYSA-N 426.542 2.477 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCN([C@H]2CCC[C@@H]2O)CC1 745903152 DLEWEEGFHHSVOV-UXPWSPDFSA-N 438.519 2.497 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C)CC2)cc1 747071478 OZDSBJWTYSFYCC-QGZVFWFLSA-N 449.548 2.390 10 20 IECD CNS(=O)(=O)c1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 750874185 GBNLVNSBQCWJQU-HXUWFJFHSA-N 431.558 2.482 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(NC(C)=O)ccc3OC)CC2)cc1F 754211677 JXJQLZSBDCTERU-UHFFFAOYSA-N 444.463 2.089 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])cc1F 755093683 VXCPUTLXWBEZCB-CQSZACIVSA-N 435.477 2.389 10 20 IECD Cc1oc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1S(N)(=O)=O 755672373 PYWLVKBNMRDLMD-LBPRGKRZSA-N 429.445 2.236 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cncc(Br)c1 757161033 QNGCYDUMZHCVBT-UHFFFAOYSA-N 433.306 2.278 10 20 IECD CCC1CCC2(CC1)NC(=O)N(C[C@@H](O)CN1CCN(c3ccc(OC)cc3)CC1)C2=O 758196372 CIUXCTNOJXGZES-WLBKGHODSA-N 444.576 2.069 10 20 IECD COC(=O)c1cc(F)c(C)c(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758233088 UINKXLKOHSESEM-LJQANCHMSA-N 432.492 2.491 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 759369106 GXEKXDVCIKETDT-QGZVFWFLSA-N 431.558 2.241 10 20 IECD COc1ccc(C=O)c(OCC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 760083190 CVFPRSVMEABGQM-UHFFFAOYSA-N 444.484 2.261 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c1 760660086 PSPRPWCBWKOKAC-CTNGQTDRSA-N 436.505 2.407 10 20 IECD COC(=O)CCn1nc(C)c(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 761219357 OIDDRDLFBBZURB-UHFFFAOYSA-N 446.548 2.411 10 20 IECD C[C@H]1OCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@@H]1C 765690189 ODLHIMYLJJVBQK-IAGOWNOFSA-N 428.512 2.261 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(C4CC4)nn3-c3ncccn3)ccc21 768118341 WVPLSIDLJACWCW-UHFFFAOYSA-N 431.500 2.177 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1 768171562 BGJKLXMXIZFQKD-UHFFFAOYSA-N 432.484 2.379 10 20 IECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 769710583 CFXXIISMUZZZEQ-AEFFLSMTSA-N 428.512 2.309 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778313198 QAUUGSVPCFQLRV-BEOVPSDWSA-N 447.601 2.096 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nnc(C(C)(C)C)s3)CC2)cc1 778325292 RYMTWMJXLWNFNL-KTKRTIGZSA-N 443.573 2.365 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 784467734 WICQFWGFOXQTLP-RBUKOAKNSA-N 428.533 2.428 10 20 IECD O=C(NCCSCc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785395075 HQHMHHBXALBGJP-UHFFFAOYSA-N 445.560 2.453 10 20 IECD Cc1cccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789801369 RXGLKAVIELCEEH-OAQYLSRUSA-N 426.492 2.346 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](N4CCCCC4)C3)cc2F)C[C@@H](C)O1 789824198 GWGXQFFTFJLQLD-QWFCFKBJSA-N 446.567 2.142 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC[C@@H](C)C1 789844241 FDSAJUVQNCXBPX-AEFFLSMTSA-N 435.540 2.067 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@@H](c2ccccc2)C1 789855143 OUCNWSBPFXTOAB-OAQYLSRUSA-N 425.554 2.456 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C2(S(C)(=O)=O)CCC2)NC(=O)OC(C)(C)C)cc1 793576324 ZVXWQACHUVJKOX-KRWDZBQOSA-N 439.578 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccc3OC)OC)CC2)cc1 794141391 QBHFLOOGBDWCOH-SEYXRHQNSA-N 439.512 2.499 10 20 IECD CNC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC)CC1 802378739 IVAXAXWDBQGZDM-UHFFFAOYSA-N 437.548 2.460 10 20 IECD COCCO[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677304 LZIXCVIFPKBJBW-FGZHOGPDSA-N 447.576 2.008 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803689637 VNKXQTIHNZMWED-UHFFFAOYSA-N 440.519 2.182 10 20 IECD CCS[C@H]1CCC[C@@H](NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 803747652 SKQDIVBGTUKDKX-NQIIRXRSSA-N 448.633 2.114 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4ccc(C)cc4)CC3)CC2)cc1 804316684 HWGGBAGLOVOCFT-UHFFFAOYSA-N 436.556 2.437 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(OCCN(C)C)CC3)cc2)CC1 805024664 TVMVPDPUFXMPIT-UHFFFAOYSA-N 430.593 2.108 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)C[C@H]1C 807097121 LSBDLNHDMZAUAC-SJORKVTESA-N 432.565 2.439 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1F 807385194 DTLOHSDSRZVXSP-UHFFFAOYSA-N 443.200 2.474 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H]([C@@H]2CCOC2)C1 807769649 ICMKWBHDPPJCSN-GVDBMIGSSA-N 437.487 2.258 10 20 IECD CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCN(C2CC2)C1 807769660 UXXVZWLAJKLYCZ-CRAIPNDOSA-N 436.503 2.068 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)C1 808037025 HYUZKLBXAZAAHV-IEBWSBKVSA-N 432.565 2.474 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4cccc(Cl)c4)C3=O)ccc21 808590286 MRVOCSDVFOBQNZ-LJQANCHMSA-N 440.931 2.260 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc([N+](=O)[O-])cnc1O 917380570 FNKOSIZNFBZGSU-UHFFFAOYSA-N 426.351 2.481 10 20 IECD O=C(Nc1cccc(N2CCNC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295992 HMFYZQJKNBFUFH-LJQANCHMSA-N 438.484 2.068 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 1116109354 SWVJCFPUFXTZCF-UHFFFAOYSA-N 430.530 2.402 10 20 IECD O=C(NC1CC1)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1319033285 OPHCHGVIMIWNPL-ZDUSSCGKSA-N 449.554 2.385 10 20 IECD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)cc1 1780770517 SBXWTQHLDOAUMB-RUZDIDTESA-N 446.507 2.231 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCO2)c1cc(O)nc(O)c1 1796555230 YUICRMZUVCOUNP-BTTYYORXSA-N 429.498 2.445 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2cccnc12)c1cc(O)c(O)c(Cl)c1 1798022564 VQYWPJWHJFRISD-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnn2c1OCCC2 1800718410 OZUFCNNASFXTTL-BTTYYORXSA-N 446.891 2.296 10 20 IECD CCc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722323 XRDOTRIMEZACBJ-GFCCVEGCSA-N 439.497 2.446 10 20 IECD O=C(c1cccnc1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898546 OYKQYXTVWDRMMP-QGZVFWFLSA-N 446.598 2.175 10 20 IECD CC1=CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1 1835433278 BJXPQUGWILDUKX-QGZVFWFLSA-N 442.560 2.424 10 20 IECD CC(C)(CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)OC(C)(C)C 1841371490 JMIDCNQXCMDAGY-UHFFFAOYSA-N 448.520 2.003 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccc3c2OCC3)C1 1843632515 XWUAEDQNXTVIKN-SOFGYWHQSA-N 436.464 2.269 10 20 IECD Cc1nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)sc1C 1844622509 RVSHNEGGRUHXPA-FNORWQNLSA-N 429.498 2.407 10 20 IECD COc1ncc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cc1F 1845500689 BECFSTHPLKHVKV-UHFFFAOYSA-N 435.839 2.425 10 20 IECD COc1ccc(N2CCN(CCCNC(=S)Nc3ccc(C(N)=O)cc3)CC2)cc1 726447052 PXYQGONTHIYDFZ-UHFFFAOYSA-N 427.574 2.293 10 20 IECD COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2ccc(C)c(O)c2O)cc(C(=O)OC)c1 727005295 NBRDPRHLAQNZRZ-NSHDSACASA-N 431.397 2.163 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@H](NC(N)=O)c3cccs3)cc2F)CC1 730235390 VHCRSFAPJRKDLF-KRWDZBQOSA-N 433.553 2.445 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(=O)N(C4CCC(C)CC4)C3)CC2)cc1 731342967 IGALXYMIKUYDFL-SNCIUUNGSA-N 442.604 2.361 10 20 IECD Cc1nc2n(n1)C[C@@H](N[C@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 732918423 MEPGWOVIBOATGI-CJNGLKHVSA-N 429.480 2.294 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1OC 737207907 DJJVSHGGCNFGTF-UHFFFAOYSA-N 448.545 2.086 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 740491892 OWRGPLVECGZHHU-LJQANCHMSA-N 443.475 2.085 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](CN2CCOCC2)C1 741811018 XCBSGYCLYBOFCP-ROUUACIJSA-N 447.535 2.443 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 746364420 QHOIOGNQMGEHMC-UHFFFAOYSA-N 436.541 2.135 10 20 IECD C[C@H](NC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F)c1ccc(N2CCOCC2)cc1 752288615 TULWRXCFBMTZDB-LBPRGKRZSA-N 441.912 2.454 10 20 IECD COc1cc(N2CCN(C(=O)CCc3c(C)nc(C)nc3O)CC2)cc(OC)c1OC 759242313 WZJCOAWFICQENL-UHFFFAOYSA-N 430.505 2.106 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC(C)C)c3C)cc2F)CC1 766573367 JIWLPTWZJUMZNW-UHFFFAOYSA-N 444.555 2.383 10 20 IECD COc1ccc(CCC(=O)N2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768443251 BZWLDRZDOPADNT-QFIPXVFZSA-N 426.513 2.494 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 769157653 XZBBIITVJYLISC-PKTZIBPZSA-N 430.593 2.072 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)O[C@H]1CCNC1=O 769977837 GCWWPPBBGLJWNT-WBOGTDJTSA-N 441.328 2.082 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccnc1Br 770279629 BJWZIQNANRQXBA-UHFFFAOYSA-N 439.335 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3CC(=O)c3cccs3)CC2)cc1 771301902 KEXZTOHLFPAABG-IBGZPJMESA-N 443.569 2.379 10 20 IECD CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NCc3ccccc3O)cc2C1 774195636 CKYKEJNNBCRTRA-UHFFFAOYSA-N 426.473 2.335 10 20 IECD O=C(COc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1)Nc1ccccc1 774363267 SCKYEVCXAIDBFN-UHFFFAOYSA-N 449.463 2.413 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]1OC 776226396 FWZGACAJYXTQFD-LXZKKBNFSA-N 426.516 2.177 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765556 AMPQWIKUFCRDBR-OAHLLOKOSA-N 448.907 2.188 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@H]3c3cc(OC)ccc3OC)nc12 788197933 VPDQLKUMUMKKJN-GOEBONIOSA-N 441.440 2.476 10 20 IECD CC[C@H]1CN(C)c2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311996 AEJVGWNLMOOJME-NRFANRHFSA-N 436.556 2.397 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](Oc4ccncc4)C3)CC2)cc1 788926345 PQXDXMWBRCGQPR-JOCHJYFZSA-N 425.533 2.075 10 20 IECD CN(C[C@@H]1CCCOC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951217 ULBLVCSGGFRDRO-HNNXBMFYSA-N 443.466 2.043 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2F)ccc1O 793426370 CRIVWAJLFUEQBX-UHFFFAOYSA-N 444.384 2.139 10 20 IECD CC(C)CC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793717229 DQTWDUZGBMBZMV-TZIWHRDSSA-N 428.577 2.432 10 20 IECD Cc1ccc(F)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793720331 OCXFWLIOOODRBI-SFHVURJKSA-N 440.519 2.111 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 803134193 GKFCXHSYWIBRLA-OAQYLSRUSA-N 438.528 2.145 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCCCSc2nccs2)C1 806282050 GHYPHGQXTGREDO-UONOGXRCSA-N 428.580 2.115 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807292807 ZGKRTCAQPUCHCG-IBGZPJMESA-N 441.553 2.048 10 20 IECD CCN(CC)[C@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771225 TXMONZRJSICIIK-AEFFLSMTSA-N 438.519 2.316 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)C3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 812016559 JWFOMIDRDUPORK-UHFFFAOYSA-N 447.580 2.078 10 20 IECD COc1ccc(N2CCN(CCNC(=N)N3CCN(c4ccc(F)cc4)CC3)CC2)cc1 849067657 SZOBMEWJQDRQSD-UHFFFAOYSA-N 440.567 2.303 10 20 IECD CN1CCN(C(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)CC1 864049515 FFLONASAQWKDGS-UVTDQMKNSA-N 440.388 2.424 10 20 IECD O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294621 IJSPOFSTWJICAU-OAQYLSRUSA-N 439.512 2.375 10 20 IECD C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340809 VOTRUYFZVVXHNI-KRWDZBQOSA-N 439.537 2.053 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccc3s1)C2)c1cc(O)nc(O)c1 1796138852 XIHUYRYWPSHCRW-KSPBDQMDSA-N 445.522 2.286 10 20 IECD COc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932656 OAJFEJMYUSXCPK-VBUUOAMHSA-N 447.495 2.135 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2[nH]ncc2c1 1798001809 VPYSSQUTWJWFDB-KYXSFPASSA-N 449.467 2.040 10 20 IECD CN(C)c1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)nc1 1807736160 LZODYMXGPZVRKD-UHFFFAOYSA-N 439.516 2.112 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@@H]1CCCSC1 1814136330 GYMJHZYOSITWCB-YRNRMSPPSA-N 442.541 2.351 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(F)CCC2)CC1 1832900486 VBEGCRSHQQDBSL-HNNXBMFYSA-N 441.594 2.359 10 20 IECD CC(C)(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1)NC(=O)OC(C)(C)C 1847581274 QBZSUKNQWFIJFH-GJZGRUSLSA-N 448.520 2.002 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 15571788 BQXITBTULSNYHD-UHFFFAOYSA-N 444.601 2.181 10 20 IECD C[C@H]1CN(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 726258210 VWPFZIXAPYZMSA-HNNXBMFYSA-N 430.471 2.062 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)ccc3F)cc2F)C[C@H](C)O1 733369985 YFPJOPNCZGGTFD-STQMWFEESA-N 439.484 2.156 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)cc2F)CC1 734213466 BMMVDZBKGKXKDS-OALUTQOASA-N 433.572 2.414 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 735196110 UKYHPEULBKAGLB-UHFFFAOYSA-N 429.542 2.177 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](c1ccccc1)N1CCOCC1 749131861 NJMGFYFJBHYDHA-YKSBVNFPSA-N 443.613 2.473 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1=O 754462714 SHHBQABIXVWBFF-UHFFFAOYSA-N 428.489 2.211 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1 755204504 XTXMMNBGIHEXDU-UHFFFAOYSA-N 444.557 2.110 10 20 IECD COc1ccc([C@H](CCO)NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764369652 QBUMMXRLYIZJQE-QHCPKHFHSA-N 442.560 2.249 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 769649910 BZCHRKYRNJYFFC-HNNXBMFYSA-N 439.921 2.170 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@](C)(C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 774841160 SUQBUICPGGLMAW-WBPRFABPSA-N 448.539 2.412 10 20 IECD COc1cc(CNCc2cccc(Br)c2O)cc(OC)c1OCC(N)=O 775151038 DRLRJDKDCAFLGB-UHFFFAOYSA-N 425.279 2.326 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 776819448 APUCAQILXOHMPM-RZUBCFFCSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCN3C(=O)OC(C)(C)C)CC2)cc1 778402163 LBXRPDGLVDAYQH-KHPPLWFESA-N 444.532 2.284 10 20 IECD CC[C@@H]1C(=O)N(CC)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 779340044 RIHSZBFYAOYKSF-OAHLLOKOSA-N 437.543 2.337 10 20 IECD O=C(CC(=O)NCC(F)(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 779656751 BNRSXLFGFVNLKK-UHFFFAOYSA-N 427.345 2.227 10 20 IECD O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)OCC(=O)c1ccc(O)c(O)c1 782187299 XSYNZQOMUWZEEN-UHFFFAOYSA-N 447.509 2.461 10 20 IECD Cc1cc(C(=O)COC(=O)C(C)(C)S(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 785991422 FKRZRZXVIRJNDQ-UHFFFAOYSA-N 435.498 2.414 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 788311332 UOMMXGJLFOHLCP-LJQANCHMSA-N 443.931 2.473 10 20 IECD CCCCCn1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)n1 789801823 VKRFSUJDWTYTDE-UHFFFAOYSA-N 445.539 2.290 10 20 IECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854714 CXCVGCANYOELCQ-FQEVSTJZSA-N 427.574 2.262 10 20 IECD COC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CCC1 792344208 IKUGRKXKCIMVMQ-ULQDDVLXSA-N 435.540 2.472 10 20 IECD C[C@H](OC(=O)COCc1ccnn1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792486634 BGJOQTBOPQADLF-AWEZNQCLSA-N 447.447 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc([C@H]4CCCOC4)[nH]n3)CC2)cc1 792537446 FJSNBUPYNQWBKD-JJEJIETFSA-N 439.516 2.156 10 20 IECD CC1(C)[C@@H](O)CCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794598725 SFDXGSXUQCWUCB-KRWDZBQOSA-N 435.458 2.087 10 20 IECD COC(=O)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 797299067 IPNHAVCRFZHESO-GFCCVEGCSA-N 443.319 2.478 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 797620138 ADKYSRMAEWDQTJ-HNNXBMFYSA-N 439.516 2.304 10 20 IECD C[S@](=O)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 798104011 QFTTYOZRWHEWMY-SANMLTNESA-N 428.557 2.286 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](Cn2ccccc2=O)c2ccccc2)c1 800688026 SUYBICLEAQDQLB-SFHVURJKSA-N 427.482 2.097 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCN3CCOCC3)cc2Cl)C1 800721264 YZKDDJUGUHIXGP-GOSISDBHSA-N 439.000 2.412 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803308767 JRFOOFNANVJORP-QZTJIDSGSA-N 441.528 2.293 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(CCCc4ccccc4)C3=O)ccc21 803685463 AVCOEYBWNHXBEG-QFIPXVFZSA-N 448.567 2.035 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCOc4c(OC)cccc43)CC2)cc1 804318243 DUZMKDGWWOWYBM-HXUWFJFHSA-N 439.512 2.429 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC3CCN(C(=O)OC)CC3)cc2F)CC1 805832903 MZENQHJGRQINMQ-UHFFFAOYSA-N 435.544 2.245 10 20 IECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)cc1 812984136 ABNGZBADJOLPKN-UHFFFAOYSA-N 449.555 2.363 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(C)cc(OC)c3O)CC2)cc1 915799677 JFTSDSUWHKCCCQ-UHFFFAOYSA-N 448.541 2.392 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 916485911 MBNNYBHSJISIOC-GOSISDBHSA-N 433.530 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H](C)c3ccc(S(C)(=O)=O)cc3)nc12 917096283 TYJVNDMFUCURDX-ZDUSSCGKSA-N 432.502 2.208 10 20 IECD CCC[C@H](C)N1C[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 917521014 KZCSYRHPQGEOBI-PMACEKPBSA-N 430.593 2.361 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)cc1 917916498 ILTNNTDTNZHURJ-UHFFFAOYSA-N 431.558 2.484 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C(N)=O 917916785 BZHHVSWCFUZKLK-GASCZTMLSA-N 435.521 2.325 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccccc3Cn3cncn3)cc2)C1 918050661 VBZHPQCKAOTREO-IBGZPJMESA-N 433.516 2.350 10 20 IECD C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1)n1cncn1 918305166 GHTCGMPQSUULBJ-MRXNPFEDSA-N 449.515 2.141 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)cccc2Br)cc1 1322497623 OKFJOXIQVZCTLU-UHFFFAOYSA-N 438.300 2.265 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)CC2)cc1 1344657114 RJCZAZPXBSPXEP-UHFFFAOYSA-N 433.486 2.359 10 20 IECD CC[S@@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427307 WUACNPPDQFMPPN-SSEXGKCCSA-N 431.514 2.399 10 20 IECD Cc1nc[nH]c1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1788776243 IQACUSAYRKGXOG-UHFFFAOYSA-N 443.554 2.326 10 20 IECD CCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1790844942 UGDUGQYQOKHKIH-XASOIFFZSA-N 432.517 2.233 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)C(F)F 1806438763 JDNARMXSJAXVCX-XSCIRMLOSA-N 433.411 2.183 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998206 JMDYXFPGVLJHMX-HTAPYJJXSA-N 436.468 2.433 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccn3nccc3c2)[nH]n1)c1cc(O)nc(O)c1 1817846315 QRBZORGFXHAMLE-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)CC3CCCC3)CC2)CC1)c1cc(O)nc(O)c1 1834988355 ZXBRZNQXTGDVSM-UHFFFAOYSA-N 430.549 2.258 10 20 IECD O=C(c1ccc(O)cc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038290 MRFODFZFBUHCFD-XVNBXDOJSA-N 428.416 2.179 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C2Cc3ccccc3C2)C1 1847130090 MLTPWGOQQMBXAQ-VQHVLOKHSA-N 434.492 2.435 10 20 IECD C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)cc1)C2=O 108807073 CHSLXCRWEMJTNK-BXKMTCNYSA-N 442.560 2.276 10 20 IECD Cc1cc(C(=O)COC(=O)CCCS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 731258899 IFQAJUCOOBWRNJ-UHFFFAOYSA-N 435.498 2.416 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H](O)C1CCOCC1 736653655 SDNOQYVHLVRKQY-GOSISDBHSA-N 431.455 2.129 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc4[nH]ccc34)CC2)cc1 737084708 ZVQYKGAZDOVPLO-UHFFFAOYSA-N 435.528 2.444 10 20 IECD COc1ccc(N(CC(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)C(C)C)cc1F 744394061 YGKVLXRYKDNQNM-ZWKOTPCHSA-N 442.553 2.244 10 20 IECD CCN(C)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 746054015 KVECIJRKFCOZQO-UHFFFAOYSA-N 428.492 2.312 10 20 IECD Cc1nnc2n1C[C@@H](C(=O)OCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 750671320 BAWLNEGLYYEXLJ-AWEZNQCLSA-N 444.447 2.106 10 20 IECD CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N(CC)Cc2cc(Br)ccc2O)C1 751465537 HRTCLVPXUNOAMM-CYBMUJFWSA-N 449.367 2.497 10 20 IECD CC(=O)N1CCN(C(=O)[C@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C(C)C)CC1 751930228 GVTMJZPHPXHELJ-HXUWFJFHSA-N 444.557 2.188 10 20 IECD COC(=O)c1ccc(Br)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 757653934 DSZLQGWBWGONND-UHFFFAOYSA-N 430.232 2.440 10 20 IECD NC(=O)C1CCN(c2ncccc2CNC(=O)NCCCSc2nccs2)CC1 759578476 DIUURPYLKXUFII-UHFFFAOYSA-N 434.591 2.221 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 760211294 DNDBUVIDBLDCGY-UHFFFAOYSA-N 436.541 2.384 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1 761057772 LJZONVVYKWGFJI-CQSZACIVSA-N 439.468 2.256 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@H]4CSCCS4)n3)CC2)cc1 771067969 PXSAPMQPYWPKGW-KRWDZBQOSA-N 434.587 2.361 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@](C)(O)c3cc(C)oc3C)CC2)cc1 778296891 DSCGBWOCFQUBAX-GTCGAKFVSA-N 441.528 2.134 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 781267873 ASMMJNSCSOYLKQ-UHFFFAOYSA-N 448.520 2.045 10 20 IECD O=C1NC2(CCN(C(=O)c3ccc4c(c3[N+](=O)[O-])C(=O)c3ccccc3C4=O)CC2)CO1 784415845 HTEVJTMERPMLKP-UHFFFAOYSA-N 435.392 2.085 10 20 IECD CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1F 785294818 NSYNQHKJNPIPEJ-LBPRGKRZSA-N 442.451 2.157 10 20 IECD COC(=O)CN(CCN(Cc1ccccc1)S(C)(=O)=O)Cc1cc(Cl)ccc1O 792250946 YFQLMZNDDPNCSP-UHFFFAOYSA-N 440.949 2.482 10 20 IECD CCOC(=O)C1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 793673199 GDMUKEZZKUJUJP-KVZIAJEVSA-N 432.517 2.138 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c(O)c1 797389811 ZLYOVDWFSUUEHH-UHFFFAOYSA-N 428.424 2.029 10 20 IECD C[C@@H](NC(=O)C(=O)N1CC[C@]2(C1)OCc1ccccc12)c1ccc(N2CCOCC2)cc1 803299865 BMCQEIKUSVWEIM-IQGLISFBSA-N 435.524 2.358 10 20 IECD C[C@H](O)C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 803311323 UFNLVYNBGFEUIV-JQVVWYNYSA-N 439.556 2.371 10 20 IECD COC(=O)c1cnoc1COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 803484061 PWEHNHSAGMCJJH-UHFFFAOYSA-N 438.439 2.386 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 806867455 SUQWVSYTYWTXJY-CYBMUJFWSA-N 439.438 2.400 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cc2n(n1)CCCC2 806955888 CRYKJFDMPVKIJH-UHFFFAOYSA-N 436.560 2.006 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807513809 UVFLHCZWHRSJCE-UHFFFAOYSA-N 446.312 2.204 10 20 IECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2 807514589 YQSYUQAKZZSXRS-PCCBWWKXSA-N 444.576 2.166 10 20 IECD COc1cc(N2CCN(CN3C(=O)C4(CCC4)[C@@H]3[C@H]3CCCO3)CC2)cc(OC)c1OC 811763991 MPDLRSQTMJVXDR-GCJKJVERSA-N 445.560 2.352 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(OC)c1C 815397988 PVCXISDZMKILMW-UHFFFAOYSA-N 441.528 2.476 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nc(-c4ccccc4)no3)CC2)cc1 914523949 TZDLLUBANZBWHO-HKBQPEDESA-N 440.525 2.343 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 916196959 STIDLRYCUDDXPH-NHCUHLMSSA-N 447.624 2.006 10 20 IECD CCCNC(=O)CN1CCC(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 916518691 GTZLVMLWVGIOHO-FQEVSTJZSA-N 432.565 2.073 10 20 IECD Cn1cc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)cn1 917727673 BQYAJYHZQCOKRI-UHFFFAOYSA-N 428.442 2.300 10 20 IECD COCCOc1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 918208240 NFOSIXLOMZZXRF-UHFFFAOYSA-N 432.496 2.206 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(-n2cccn2)c(F)c1 918284579 JYFRSNBGFPLBLP-UHFFFAOYSA-N 441.438 2.242 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)/C=C/C3CCCC3)C2)C1 1781283174 ZPVSQBNHTTWNKT-YCPLPMEKSA-N 442.512 2.393 10 20 IECD C[C@H]1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1788241846 DXEOJCNPLFETLX-CHMWUEAZSA-N 444.528 2.233 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1797258128 VWLREXMFLRZDQR-BVGZRJROSA-N 443.544 2.303 10 20 IECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807989274 AAHGBIPQXROJII-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cncnc3)C2)CC1 1808515307 QDXKSRLQRALZMC-HWKANZROSA-N 438.484 2.152 10 20 IECD Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817844195 SQTCRJTYEDVNIL-ZDUSSCGKSA-N 443.439 2.017 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1CCC(O)CC1 1822546680 MWDCHRCVBWUYPN-LDZOIKDWSA-N 429.477 2.073 10 20 IECD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CCC1 1823497191 SJTCZAUNVHMPFJ-CYBMUJFWSA-N 435.575 2.452 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)C1 1841396940 GHRCNEHDWMZCFB-LSDHHAIUSA-N 429.423 2.392 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846643239 HTYLMRCVAAIDMP-VFADXPBXSA-N 426.469 2.492 10 20 IECD CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847051255 RWGHCCFVZOSLJN-LJQANCHMSA-N 445.610 2.490 10 20 IECD CCOc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OCC 727176422 KNCKJRBEWQOACI-RVDMUPIBSA-N 430.573 2.234 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N(C)C1CC1 729599718 KMWZNBZZTJDSQP-QGZVFWFLSA-N 441.555 2.224 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)c1 734072847 QHGFUHOSNFAELD-UHFFFAOYSA-N 443.525 2.153 10 20 IECD COC(=O)CCCOc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 734178338 WCDKNUTWLQAROE-UHFFFAOYSA-N 436.486 2.026 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)c3ccccc3)cc2F)C[C@@H](C)O1 740946637 YXZHACHICMFRQB-DMPWYTOCSA-N 430.476 2.332 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)o1 751391068 GKENKMIRFSWURF-CYBMUJFWSA-N 443.472 2.496 10 20 IECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc4c(c3)CCCN4C)ccc2O1 751981212 UUKCLEAJHGDUBH-NRFANRHFSA-N 430.526 2.414 10 20 IECD C[C@]1(CO)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760093994 CEAPTJXRZZHLPN-LJQANCHMSA-N 435.458 2.088 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 762634940 DHYYPGLOCQBJMS-YVGXBJCXSA-N 430.526 2.417 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H]2CCCC[C@H]2N1 769025654 WUTYWKFSRGGMEX-QZTJIDSGSA-N 440.466 2.495 10 20 IECD O=C(COc1ccccc1)NCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771055320 BNDAPVHTGZTUCR-SFHVURJKSA-N 431.920 2.321 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1)c1ccc(N(C)C)cc1 773856021 HZHGMMODTOLCCU-HNNXBMFYSA-N 444.557 2.351 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCN(C)c3ccccc3)CC2)cc1 778260570 IGZFCRJNVOHRMH-BUHFOSPRSA-N 436.556 2.495 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)C[C@@H](O)c3ccco3)CC2)cc1 778326351 NZVMMCQYGUUIIE-KICTWUTESA-N 427.501 2.121 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(OC)c(F)c3C)CC2)cc1 782983643 TVGNKMGPURHBMJ-UHFFFAOYSA-N 437.537 2.252 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(CCOC)nn1C 785193368 XZCGNELTDKZFLM-UHFFFAOYSA-N 439.310 2.064 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](Oc4ncccc4F)C3)CC2)cc1 785837680 GIZBCDWWVPFLTA-IRLDBZIGSA-N 444.551 2.256 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)cc1 786446292 XPQJKBHSDZWYOS-UHFFFAOYSA-N 442.511 2.451 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nccnc3NC(=O)C(C)(C)C)cc2)CC1 787320424 UDBNDKRQNAZQIZ-UHFFFAOYSA-N 438.532 2.060 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)CC1 787325328 DWUVTEMITBGQQG-UHFFFAOYSA-N 449.599 2.184 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2F)ccc1O 790406757 GRWPHGWMUOJMOF-UHFFFAOYSA-N 428.385 2.259 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(F)c(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 803299111 YVMNVOYJYSDCGN-QGZVFWFLSA-N 442.535 2.218 10 20 IECD C[C@@H](NC(=O)C(=O)NCCOc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 803300561 JDLJXCSXOGDQRK-OAHLLOKOSA-N 433.455 2.174 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1)c1ccc(N2CCOCC2)cc1 803311846 ZDNCCUAPPOPBLH-KRWDZBQOSA-N 425.529 2.244 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(C[C@@H]4CCOC4)CC3)cc2)CC1 805019040 BAVBYIQODDBABE-NRFANRHFSA-N 442.604 2.156 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCCCSc3nccs3)C2)nc1 806280274 MFOOTTZFUKRXSU-OAHLLOKOSA-N 447.586 2.322 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cc1C(N)=O 914790737 VDFIJJIXPKCJFI-UHFFFAOYSA-N 433.467 2.447 10 20 IECD Cc1cc(NC(=O)CN2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)no1 916588150 XDJTXUHXJMBJQB-UHFFFAOYSA-N 426.521 2.049 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C(=O)c2ccoc2)CC1 918201485 BTEOORBJDFQFKH-UHFFFAOYSA-N 444.507 2.484 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC3CCN(CCN(C)C)CC3)cc2F)C[C@@H](C)O1 918205211 JKWFZQAXRAYINN-HDICACEKSA-N 435.588 2.265 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(Cc2ccncc2)CC1 918219892 QCNNLSYIEHVRBG-UHFFFAOYSA-N 427.524 2.209 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 919663261 BHXMOGDRTLIPHQ-UHFFFAOYSA-N 438.528 2.178 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243765 KLJWFRJYPSAISW-YEWWUXTCSA-N 447.919 2.305 10 20 IECD CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1819886906 HHBJTVJISWPMON-OAHLLOKOSA-N 426.433 2.386 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)c2cc[nH]n2)CC1 1824673896 NLVUXBJYSMWVDA-FZMUQLTDSA-N 440.500 2.473 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424263 VMXDGDVZCAOZKG-OALUTQOASA-N 430.549 2.210 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428158 KFHSYVSSCFUEBC-YJBOKZPZSA-N 446.548 2.031 10 20 IECD Cc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847051577 VVPHNYYIPOTIRR-UHFFFAOYSA-N 437.974 2.326 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H](C)NC(=O)C3CCCCC3)CC2)cc1 727531162 LZRKOMRPCQYOQJ-SFHVURJKSA-N 445.560 2.362 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c(C)n1-c1ccc2c(c1)CCC2 730657958 JRLAYXVCMRJSGX-UHFFFAOYSA-N 445.479 2.394 10 20 IECD COC(=O)CN(CC(=O)NC(=O)N[C@H]1CCCC[C@@H]1C)Cc1cc(Cl)ccc1O 731845748 FFDLAJQQTDTIPS-BBRMVZONSA-N 425.913 2.425 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)cc1 749024165 DETNOPNFDLMLJM-UHFFFAOYSA-N 440.569 2.125 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751240481 NKOVJAIXNVFMRG-UHFFFAOYSA-N 445.585 2.052 10 20 IECD C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)NC(=O)NCC(F)(F)F 751930941 LLQFBWYFPSXWSM-SECBINFHSA-N 430.408 2.250 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ncn(C2CCCCC2)n1 755195498 ZEGOKDGUEHLUFH-UHFFFAOYSA-N 430.484 2.014 10 20 IECD Cc1cc(C(=O)COC(=O)c2cncc(Cl)n2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 758658624 IITZCFMSBZFVSZ-UHFFFAOYSA-N 448.888 2.225 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(COC(=O)/C=C\c1ccc(O)c(O)c1)n2CC 759590246 VWWWVNQHRMRHHI-CLFYSBASSA-N 428.445 2.286 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](N2CCCC2=O)C1 761114757 OUHUSGDQKGRQNF-JKSUJKDBSA-N 431.492 2.486 10 20 IECD COc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1cccc2nonc12 765076747 HXXUAIPZSMTYGT-UHFFFAOYSA-N 437.377 2.326 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4ccccn4)CC3)cc2F)CC1 771763077 BFWXRIXHHXZDEK-UHFFFAOYSA-N 440.567 2.390 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1nc2ccccc2s1 774979953 FXQFZYRIZUZHNZ-UHFFFAOYSA-N 442.516 2.329 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COC4(CCCCC4)O3)cc2)C1 775758273 BLIZWTLXLRJCSO-ICSRJNTNSA-N 430.549 2.263 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](C)O[C@H](C(F)(F)F)C3)CC2)cc1 778294228 KGSQFMAWZOWDPE-QOLZPOHTSA-N 441.450 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(c4nc5ccccc5[nH]4)C3)CC2)cc1 778315333 ACGTUPQGNLQTTG-KHPPLWFESA-N 445.523 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1F 779529203 RMZBCKVLQODKBU-OALUTQOASA-N 431.489 2.187 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780409158 RXVHQEYNWBFMOP-UHFFFAOYSA-N 432.502 2.334 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H]1CC(=O)N(C2CC2)C1 780820319 IKWWHMAPFFYMNO-CQSZACIVSA-N 440.466 2.352 10 20 IECD COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438708 GIMKPVSDVSYGPJ-QGZVFWFLSA-N 430.936 2.426 10 20 IECD CN(Cc1nc2c(s1)CCCC2)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800858 QYWNOZUJIPBPLQ-UHFFFAOYSA-N 446.548 2.272 10 20 IECD Cc1csc([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789842476 CZNNLIJALBNNIR-ZDUSSCGKSA-N 434.537 2.088 10 20 IECD C[C@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)(N(C)C)C1 789862457 TWFCESNHYFAKFJ-MBSDFSHPSA-N 432.634 2.483 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCSC1 789951249 UWQTVJQUSZXQRP-OAHLLOKOSA-N 431.480 2.122 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCSC[C@H]2c2cnn(C)c2)c1 790469305 BQCXAOAEILHATF-NRFANRHFSA-N 430.574 2.451 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccccc1OCC(=O)N1CCOCC1 797633210 XAHTYAVYZJNGKX-OAHLLOKOSA-N 429.473 2.088 10 20 IECD CC(C)(C)OC(=O)NC[C@]1(C)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 801452036 WXEBLNMKIJHWTJ-IBGZPJMESA-N 427.523 2.141 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 804318512 MMWWBGXDOAUCJR-HSZRJFAPSA-N 436.556 2.296 10 20 IECD CC[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 805771842 BIDIGIIIXANYSH-GOEBONIOSA-N 440.521 2.298 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@](C)(O)C2CCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 812668636 HDRVBMDRUGMUEK-NRFANRHFSA-N 434.514 2.019 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](CO)(c4ccccc4)C3)cc2)C1 813044277 WCTGIVDDLKKDFU-NBGIEHNGSA-N 436.556 2.234 10 20 IECD CCN1CCC(N2CCC(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 816891129 IZMMXYPWTSMCPL-UHFFFAOYSA-N 432.584 2.475 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 916232395 JQOPDZXTPOPWDD-HNNXBMFYSA-N 439.559 2.253 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccn(-c2ccc(F)cc2)n1 1255148057 GDOAECPJANPURL-SFHVURJKSA-N 427.432 2.256 10 20 IECD O=C(COC(=O)C1(O)Cc2ccccc2C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1318658169 LUFOUHOWLQBJMV-UHFFFAOYSA-N 441.439 2.474 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243773 KYLOENOMLMOQEG-AXHNFQJDSA-N 446.887 2.364 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191565 KQTJDKAQGOAOIU-JKJSLYJUSA-N 446.598 2.304 10 20 IECD Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817768769 YAXNXROVQWOHIQ-GFCCVEGCSA-N 425.470 2.192 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442178 DWDWVPYFNMEFTG-KRWDZBQOSA-N 434.496 2.455 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1cnc2ccccc2c1O 107919857 YQWFIUQDSNBEKO-UHFFFAOYSA-N 434.496 2.165 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2)cc1 114998397 PKHNMVGWDZQHPD-UHFFFAOYSA-N 439.516 2.074 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2OCc2ccncc2)SC1=S 727175879 CAARTPPLTJPZCV-ATVHPVEESA-N 449.579 2.411 10 20 IECD CC[C@@H](C)N(C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727225477 AMHYKCHNMCTBTN-GOSISDBHSA-N 443.571 2.472 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)c(C)c3)CC2)cc1 728754472 UYLWJGDEXXHDIV-UHFFFAOYSA-N 428.508 2.410 10 20 IECD Cc1cc(C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1-c1ccc(Cl)cc1 735823813 SLQCZFDEQCRUEQ-IBGZPJMESA-N 444.963 2.410 10 20 IECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 742045806 JDMPUNAWPDVVNS-UHFFFAOYSA-N 429.542 2.079 10 20 IECD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800490 SMQJUUHVQSCIOD-KSMAZPFSSA-N 445.466 2.180 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 758004475 UENAPWJNHKRCIQ-HUUCEWRRSA-N 435.521 2.325 10 20 IECD COc1cc(N2CCN(C(=O)NCc3nccn3C(F)F)CC2)cc(OC)c1OC 759285325 YEHIEDKWQOQGSF-UHFFFAOYSA-N 425.436 2.336 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1ccccc1S(=O)(=O)C(F)F 759579597 MZZBACHLEYEKCQ-VURMDHGXSA-N 427.381 2.289 10 20 IECD COc1cc(N2CCN(C(=O)NCCCOC[C@H]3CCCO3)CC2)cc(OC)c1OC 760103475 GZPBEOHGAMPVSP-GOSISDBHSA-N 437.537 2.130 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](NC(=O)NC2CC2)C1 760905219 FISXRYFDGPHBFC-GDBMZVCRSA-N 446.507 2.325 10 20 IECD C[C@]1(c2ccc(CN3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc2)NC(=O)NC1=O 761223031 NHTZLLVWCRIYIS-OAQYLSRUSA-N 442.859 2.065 10 20 IECD Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 764577381 PAYVEZFNEURPJE-UHFFFAOYSA-N 426.496 2.253 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c3cccc(F)c23)cc1C(=O)O 769871304 JODOOBSVHYAMLR-UHFFFAOYSA-N 427.435 2.178 10 20 IECD COc1ccccc1OCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 774816148 OFXFHQGVMJMWPZ-GOSISDBHSA-N 428.485 2.104 10 20 IECD COC(=O)[C@H]1C[C@H](C)CCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 775807744 VLOXMUFVFIVOKG-JLTOFOAXSA-N 447.557 2.198 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCn3cnc4ccccc43)CC2)cc1 778253637 RDIGSRVGXDONMZ-ZHACJKMWSA-N 433.512 2.066 10 20 IECD COCCn1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cn1 782429191 NRCBIHSWYYWSEN-UHFFFAOYSA-N 425.489 2.356 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 785490234 XSLYILBHRUDRJE-HNNXBMFYSA-N 434.514 2.358 10 20 IECD COc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1OC 787021346 YAVZBOWNTCJABG-SFHVURJKSA-N 428.485 2.233 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(CCCN2CCCC2)CC1 788311759 ZFQWYJWADLGSDP-UHFFFAOYSA-N 442.604 2.254 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccn(-c2ccccc2)n1 789844153 DMXHSNRODPJEAI-UHFFFAOYSA-N 435.553 2.358 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Br)ccc2C)ccc1O 790404777 HOUJSBPUVITHKJ-UHFFFAOYSA-N 435.321 2.172 10 20 IECD NC(=O)[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(Br)c1 792839983 CCSJWYKUEGSKAC-GOSISDBHSA-N 447.333 2.312 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)Cc2ccccc21 793722894 LSSADTSATZAUHU-FQEVSTJZSA-N 448.567 2.325 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Oc4ccncc4C)CC3)CC2)cc1 809995775 WJEQTNPSVKVLED-JOCHJYFZSA-N 440.588 2.425 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN(c4ccccc4)C3=O)CC2)cc1 814642660 JGVJTROYPQLHAY-HSZRJFAPSA-N 436.556 2.377 10 20 IECD Cc1cc(C(=O)CN2CCC3(CC2)OCCCO3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815153634 FZJWNMPRBFIRNB-UHFFFAOYSA-N 447.557 2.153 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(Oc3cncc(Cl)c3)CC2)c1 816683436 GCWXYHARVFUTLT-UHFFFAOYSA-N 425.894 2.496 10 20 IECD O=C(COC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1)c1ccc(O)c(O)c1 916590783 OMHMEAXWNWEEOA-UHFFFAOYSA-N 431.422 2.209 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CC)CC(=O)Nc3c(F)cccc3F)nc12 917002732 UFFODQWGKSYSEN-UHFFFAOYSA-N 433.415 2.350 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 918284424 GKVMPBQAJLDHJO-UHFFFAOYSA-N 428.464 2.184 10 20 IECD O=C(Cc1c(F)ccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598996 UTURUCNQGLBFMW-CLLJXQQHSA-N 435.402 2.405 10 20 IECD O=C(CCc1ccccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283965 ROBICVGGGDTFCJ-IYKZFTADSA-N 437.496 2.483 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H](CNC(=O)C2(F)CC2)[C@H]1c1cccnc1 1812462281 HUPGIZVZQUNLNP-QQLGTAFNSA-N 441.459 2.420 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc(Cl)nc1 1814324110 FZQWYPSREVWKEI-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1C 1816724763 GUNFOMZNPDIRTQ-ZDUSSCGKSA-N 427.486 2.136 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccn2cncc12 1819178524 WRLUYRQFVYTHPD-MRXNPFEDSA-N 447.455 2.483 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H]3CCC(=O)NC3)C2)cc1 1841114563 ZWXAWTUXXUVHNJ-FQEVSTJZSA-N 434.540 2.437 10 20 IECD Cc1cncc(CCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1842036883 GSOKBONHIOUWDQ-UHFFFAOYSA-N 445.523 2.319 10 20 IECD CN(C)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842286418 ZLKCJCCTJUIHLA-UHFFFAOYSA-N 430.892 2.343 10 20 IECD CO[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccc1 1842788514 PKOZNPKCOONMOC-QFIPXVFZSA-N 446.507 2.370 10 20 IECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccc(O)cc1 1843442740 ZQVFBZCXWHRQEL-QGZVFWFLSA-N 446.507 2.492 10 20 IECD O=C(c1ccc(N2CC=C(c3c[nH]c4ncccc34)CC2)nc1)N1CCS(=O)(=O)CC1 468730011 UDWHHFVFSWBOQS-UHFFFAOYSA-N 437.525 2.122 10 20 IECD Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 729523138 JYDGKVAUZAJSEJ-UHFFFAOYSA-N 427.480 2.011 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCC1(O)CCCC1 729600872 XKVOZLBSOBHTBY-UHFFFAOYSA-N 428.512 2.047 10 20 IECD COC(=O)CN(CC(=O)Nc1cccc(S(C)(=O)=O)c1)Cc1cc(Cl)ccc1O 731844474 BWPRXRIBELXWJS-UHFFFAOYSA-N 440.905 2.063 10 20 IECD COc1ccc(OC)c(CN(CCO)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 732452941 ONXYRSAHFOOKLK-UHFFFAOYSA-N 429.517 2.245 10 20 IECD CCc1nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1-c1ccccc1 735431240 DMZORDPIOQTBGI-GOSISDBHSA-N 432.528 2.461 10 20 IECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520174 XJHFAUFNVDZAJT-DFBJGRDBSA-N 449.507 2.293 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)CC1 747017498 NSRHKRIFLGJACB-UHFFFAOYSA-N 435.572 2.466 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cc1F 748980312 KFHOVROIAHOALF-UHFFFAOYSA-N 430.871 2.440 10 20 IECD CCOCCO[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 750261786 ISNMPXWINOGHGN-BJLQDIEVSA-N 437.556 2.183 10 20 IECD CCCc1cnc(NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 756047014 BFRLMHJSZGCUDJ-UHFFFAOYSA-N 445.589 2.371 10 20 IECD O=C(N[C@H]1CC[C@H](CO)CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 757911124 ZQRVLTFFZZYMPE-HDJSIYSDSA-N 449.485 2.382 10 20 IECD COc1cc(N2CCN(C(=O)c3csc(S(C)(=O)=O)c3)CC2)cc(OC)c1OC 759238698 ORRLPHXSHSTUSS-UHFFFAOYSA-N 440.543 2.140 10 20 IECD CS(=O)(=O)N1CCN(c2ccc(NCc3cc(Br)ccc3O)cn2)CC1 772953277 KAYNTANRMVDFHR-UHFFFAOYSA-N 441.351 2.243 10 20 IECD CCOC1CC(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)(N2CCOCC2)C1 775154343 ZTQXVCVPBXBTQP-MFMCRYCZSA-N 447.576 2.353 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3nccn3C(F)F)CC2)cc1 778228746 KYCQEOMEHAWYFF-BQYQJAHWSA-N 433.459 2.150 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CN3CCC[C@H](C)C3)CC2)cc1 778248516 UVLWASADWMDJSJ-RKXFTREYSA-N 428.577 2.137 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 782783760 NZVXVHZRYWTYBI-UHFFFAOYSA-N 437.470 2.177 10 20 IECD O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N(CCO)CCN1CCOCC1 783469792 MRGAGSGINBNROC-UHFFFAOYSA-N 425.489 2.194 10 20 IECD NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(Br)cc2)c([N+](=O)[O-])c1 783715001 NUKULIWRLSVHNS-UHFFFAOYSA-N 446.308 2.318 10 20 IECD C[C@@H](CN1CCOCC1)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413353 PHKAOWBRRMENLA-ZDUSSCGKSA-N 426.516 2.132 10 20 IECD C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785896853 GTAWNUXAIHWSKG-INIZCTEOSA-N 443.519 2.246 10 20 IECD CN(C)c1ccc(CNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)cc1 788546352 PORVOFDZSNXSFQ-FQEVSTJZSA-N 442.535 2.409 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@@H](Nc2ccccc2)C1 789799118 IZVLAFFMRWOLPD-HXUWFJFHSA-N 440.519 2.382 10 20 IECD CSCCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949395 IAUJRZMOSWHQMM-UHFFFAOYSA-N 433.496 2.370 10 20 IECD COC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H]1CCCO1 790281208 PAFFHFMTBIAHBN-GDBMZVCRSA-N 426.516 2.178 10 20 IECD COc1ccc(CNS(=O)(=O)c2cc(Cl)cc(C(=O)N(C)C)c2OC)c(O)c1 790334618 PGPIBNVTLRRULK-UHFFFAOYSA-N 428.894 2.243 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 793055194 VULOKBBVIHUCSB-VIFPVBQESA-N 438.234 2.454 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H](SC)C3)cc2F)CC1 805007102 NJHPVIMWVMWAMY-GOSISDBHSA-N 436.597 2.328 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CN(Cc2ccccc2)CCO1 807469293 GNGQSDJXHDJQDY-WMZHIEFXSA-N 438.572 2.117 10 20 IECD C[C@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 808276776 CYKZPFCPEMKUDI-UTKZUKDTSA-N 429.517 2.185 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)cc1 808814842 HIWJHDLWIZRDCZ-QGZVFWFLSA-N 448.445 2.309 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4snnc4C4CC4)n3)CC2)cc1 810306136 BIKMHBDPHHRMLA-UHFFFAOYSA-N 426.502 2.365 10 20 IECD CCOCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)no1 812032937 NCBPIIGXLAKKNS-HNNXBMFYSA-N 434.516 2.448 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(S(=O)(=O)NC2CC2)c1 916673655 ZKNMRPREQRQTGD-UHFFFAOYSA-N 448.520 2.425 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1C 917364852 PJTCVSZZHMAHPK-LJQANCHMSA-N 432.542 2.495 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1C 917758004 GBXDQUZCJWGESR-UHFFFAOYSA-N 429.476 2.474 10 20 IECD O=C1CCCN1c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917918573 QDSPFDJJECBYLU-UHFFFAOYSA-N 433.505 2.268 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 918286821 KMKVQCMGAKVPEF-GJZGRUSLSA-N 442.491 2.054 10 20 IECD NS(=O)(=O)c1ccc(C(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)cc1 918848764 UTCXCRLNRYDUJV-UHFFFAOYSA-N 449.440 2.149 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc([N+](=O)[O-])[nH]1 919700973 JKZWHMPXZMZCAS-UHFFFAOYSA-N 425.424 2.109 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)CC2)cc1 1253441735 GQUVRQLWHPMGQQ-ZJOUEHCJSA-N 432.590 2.460 10 20 IECD CC(C)n1nccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007423 RFKREDVVHITVKM-OAQYLSRUSA-N 448.907 2.286 10 20 IECD Cc1cc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)no1 1782007621 VKBCYLMWURKYAS-GMKGHPLGSA-N 447.875 2.205 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cc[nH]n3)cc2)CCC1 1786485249 IGQXPEFUPXABED-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccn1)C1=NN(c2ccccc2)C(=O)C1 1796318733 OBRXQNZXJSQCGY-FNLKRUPLSA-N 431.496 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)n1 1798757121 WPMLPSHKEORVNH-SYLDHANKSA-N 427.432 2.303 10 20 IECD COC(=O)C12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)c(O)c(Cl)c3)C4)(C1)C2 1801877973 KZEBFFQCFIMZEN-ABHVRBQOSA-N 448.903 2.346 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ncc(Cl)cn1 1804283731 NFQUYFACFUXCEF-BPQKRJORSA-N 444.875 2.212 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1F)CC2)c1cc(O)nc(O)c1 1816729632 WNXIUBMRMFUBOC-SNVBAGLBSA-N 444.444 2.334 10 20 IECD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820992277 BGSVIHQMVOVTJC-INIZCTEOSA-N 439.476 2.104 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824690393 RCRMINKBUKBFKK-SFHVURJKSA-N 441.532 2.390 10 20 IECD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827424243 VFBYECIXKLUVSZ-IBGZPJMESA-N 441.532 2.011 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2snnc2C2CC2)C1 1843579627 PBSNSXYKQDOWKP-FNORWQNLSA-N 442.497 2.063 10 20 IECD CN(c1ccc(CNC(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1)C1CCCCC1 737158704 OANQEXRHNJZPHV-UHFFFAOYSA-N 444.557 2.358 10 20 IECD CN1CCN(C(=O)c2ccc(CNC(=O)NCc3ccc(N4CC=CC4)cc3)cc2)CC1 740907962 RKTPLKPLKKFMCQ-UHFFFAOYSA-N 433.556 2.450 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)CC2)cc1 743287444 IUJLRFYQGQTNQP-MRXNPFEDSA-N 439.516 2.358 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)C[C@H](O)c1ccccc1 754569797 LZBKPGFUXAQFMU-GCJKJVERSA-N 431.508 2.071 10 20 IECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NC(=O)Nc1ccc2c(c1)OCCO2 759597466 SFGFQDWPIGOTAJ-MIBUCLJRSA-N 428.397 2.162 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)n1cccn1 761982424 LEYIMUPMMXMBTQ-MAUKXSAKSA-N 433.940 2.042 10 20 IECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 764260426 LVHICKCHCCQMOO-UONOGXRCSA-N 449.529 2.294 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc([N+](=O)[O-])s4)CC3)cc2)CC1 775656062 NZVLNQBRDOQZNN-UHFFFAOYSA-N 429.546 2.366 10 20 IECD CS[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H]1N(C)C 775997479 BEJWQQDUAKAEAF-VAKZPMALSA-N 438.613 2.033 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccc(F)cc4C3=O)cc2F)C[C@@H](C)O1 776284638 APIBXNGTQNCPIK-ZIAGYGMSSA-N 443.450 2.491 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](CCO)c3ccccc3)CC2)cc1 778321786 VRVFNBIEZXBIRR-AXUYNXDZSA-N 437.540 2.182 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 778626841 LADPKCAWBUNFMR-UHFFFAOYSA-N 440.493 2.207 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccnc(OCC(F)(F)F)c3)ccc21 787278279 UNJUUSHRFZTBPU-UHFFFAOYSA-N 436.434 2.338 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OC[C@@H]1CCCS(=O)(=O)C1)c2[N+](=O)[O-] 791495278 VAXYIWGBIXNVHA-LBPRGKRZSA-N 443.433 2.352 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)[C@@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 794783594 AAQBPYASWJOFDA-LJQANCHMSA-N 447.557 2.029 10 20 IECD COC(=O)c1cc(Br)cc(S(=O)(=O)NCc2ccc(OC)cc2O)c1 795358370 NELFDUJXCPVOLZ-UHFFFAOYSA-N 430.276 2.428 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](C(C)C)N(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 803498222 RBKCLTVAHIOUPA-FQEVSTJZSA-N 435.546 2.054 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3c3cn(C)nc3C)CC2)cc1 804317399 BTKJBWQHFMZADN-OAQYLSRUSA-N 425.533 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3c3nc(C)no3)CC2)cc1 804857684 HXGMRTRUHJQRTQ-CTDFXDFQSA-N 439.516 2.345 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 806288724 UVKOEOOAPARDJI-GGAORHGYSA-N 437.540 2.376 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccnn1C 809793472 FLLYQVMWIFIISM-RTBURBONSA-N 428.533 2.189 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3COc4c(F)cc(F)cc4C3)CC2)cc1 812017167 YYYWVTYOLDAWES-GOSISDBHSA-N 446.498 2.398 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H]1CCS(=O)(=O)C1 918220498 KFFUKWZOFCLBBQ-YQQAZPJKSA-N 427.542 2.158 10 20 IECD NC(=O)c1csc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 919761605 MEMZGGRIWYOQJG-UHFFFAOYSA-N 440.504 2.033 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 919815974 WDWUQDKCEORMLY-INIZCTEOSA-N 433.486 2.360 10 20 IECD Cc1cc(C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 920290331 IWYQOCCCRQIFOZ-INIZCTEOSA-N 437.949 2.123 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)c2C)cc1 925670008 FJOCHCKFTMZHRP-IRXDYDNUSA-N 427.501 2.372 10 20 IECD CCOc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 1116418222 SYBNFBQTDGTSSY-IBGZPJMESA-N 440.544 2.173 10 20 IECD COC(=O)c1cncc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)c1 1116838707 DQJSROWXUYQGHF-UHFFFAOYSA-N 446.510 2.429 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CNS(=O)(=O)c1ccccc1 1117638557 RSPORUPLTQELQZ-UHFFFAOYSA-N 427.320 2.482 10 20 IECD CN1CCN(c2ccc(CNc3ncn(CC(=O)NCc4ccccc4)n3)cc2F)CC1 1320561727 IFTZIOWLOMAPJB-UHFFFAOYSA-N 437.523 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccc3)[C@H](C)CO)CC2)cc1 1321853629 WJPAKCXUHYQDRM-GHYICZDASA-N 437.540 2.310 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)C3(F)CCCCC3)C2)C1 1778212774 LMBXZEWYMUEMHJ-YHCZKZFASA-N 448.491 2.319 10 20 IECD O=C(CC1(O)CCC1)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1792032059 XGRLDZUJLRRJJI-UHFFFAOYSA-N 447.582 2.286 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807999785 WHABBLDCZAZUBM-QOKNQOGYSA-N 428.514 2.103 10 20 IECD Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1813508287 DTCUDJBGPSGWCJ-ZHRRBRCNSA-N 436.468 2.352 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1 1814162232 HOZPJANXSYCKOC-HMHLKJFASA-N 433.411 2.183 10 20 IECD Nc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cs1 1826964098 JPBMIUMPTYWWNA-OAHLLOKOSA-N 431.518 2.079 10 20 IECD CCN1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827430521 ZOLGRYXIEXWCCF-HXUWFJFHSA-N 444.576 2.458 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)COC2CCCCC2)C1 1841230772 SUGKUHBZNPRVIP-CSKARUKUSA-N 430.501 2.369 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2ccc(F)nc2)C1 1842009101 OXDNZHREBHVCOT-WEVVVXLNSA-N 441.459 2.187 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cccc(F)c2Cl)C1 1845371035 UYUJHJUCLDFAEK-UHFFFAOYSA-N 441.937 2.156 10 20 IECD O=C(c1ccc2n[nH]cc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039074 QEUGYBNXSBXESW-QPJJXVBHSA-N 434.452 2.210 10 20 IECD O=C(NCc1ccccc1O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 109676449 GWIBGAUBSBHQRB-UHFFFAOYSA-N 446.525 2.271 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(CS(N)(=O)=O)c2)cc1 726533533 BOZUFUUQOQVVIB-NRFANRHFSA-N 431.558 2.363 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H]1CCCC[C@H]1O 728750188 BZSKFHPNNBAPEI-UYAOXDASSA-N 428.512 2.045 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)cc1 728839937 YERLPBXRLXYGLO-IBGZPJMESA-N 426.439 2.364 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCNC(=O)c3ccccc3F)cc2F)CC1 730121592 UYBALTNBZLSMCK-UHFFFAOYSA-N 445.514 2.336 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2F)CC1 730391445 NGNNLGHCDRBHCZ-UHFFFAOYSA-N 429.452 2.131 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c1 732894368 LBDGNXDOAAZFJW-NSHDSACASA-N 432.864 2.400 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734701845 KYJNPKLLLVPNMI-UHFFFAOYSA-N 446.573 2.394 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1C(=O)N(C)C 741095330 KQIDUDORRNJCCV-QGZVFWFLSA-N 438.528 2.349 10 20 IECD O=[N+]([O-])c1ncccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 742280854 WRTSVBMOEAVXJO-UHFFFAOYSA-N 446.407 2.324 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCOC1 743555945 DLYBJXVSQNMWSH-AEFFLSMTSA-N 428.512 2.167 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCC1CCN(S(C)(=O)=O)CC1 745788682 UWGBWXAOJLGUCR-UHFFFAOYSA-N 448.383 2.358 10 20 IECD CCc1cccc2c1N(C(=O)C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CC2 746990436 OCGWZEJERSIPLP-FQEVSTJZSA-N 434.540 2.156 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(C(N)=O)s3)cc2F)C[C@@H](C)O1 748958828 OPPVVAQSODNVHV-BETUJISGSA-N 449.504 2.073 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)OC(C)(C)C)C[C@H]3C)nc12 749490618 UZUSWNWIDZLYSB-KGLIPLIRSA-N 433.509 2.489 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c[nH]1 751361237 RFYOLNDJEVSJTL-CQSZACIVSA-N 427.910 2.103 10 20 IECD COc1cc(F)ccc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759410803 VZLRCMPZOVZEQA-UHFFFAOYSA-N 447.463 2.147 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c(C)n1-c1ccc(Br)cc1 764515946 VMUVCJGWLRJXEL-INIZCTEOSA-N 431.290 2.233 10 20 IECD CCOc1ccc(O)c(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1 769209984 KLZMBMFJOGVLRI-UHFFFAOYSA-N 448.541 2.459 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NCc2ccc(O)c(O)c2)cc1 778925880 PONGKCDMHIRHLR-GOSISDBHSA-N 432.498 2.160 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 787751195 KONBMFJLASLOOL-HSZRJFAPSA-N 436.556 2.093 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@@H](C2CCCCC2)C1 789798333 FSOYQVSNRMPCFO-OAQYLSRUSA-N 433.524 2.086 10 20 IECD O=C(c1cccc(O)c1O)N1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1 790474281 SXFQCKXZUPXZPN-UHFFFAOYSA-N 430.404 2.263 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)cc2F)C[C@H](C)O1 792955654 IGBSLKWKSSLCSI-GJZGRUSLSA-N 441.507 2.437 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2c1=O 792968175 ZYLKDVNAFBPVGI-UHFFFAOYSA-N 448.523 2.002 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)cc1)C1CCCCC1 803677257 KMEPTRVIPYWQTE-HXUWFJFHSA-N 435.590 2.107 10 20 IECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCSc2nccs2)C1 804083418 PSZPPLNQXYETSX-HNNXBMFYSA-N 434.587 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cnc(C)s3)cc2F)CC1 805007373 JLYILFGGVWJTJS-UHFFFAOYSA-N 433.553 2.007 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807675067 UHNWINAUIMIGCS-AVRDEDQJSA-N 436.556 2.280 10 20 IECD COc1ccc(CN2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cc1F 807678279 WATUIYDMXVHVHT-KRWDZBQOSA-N 442.535 2.422 10 20 IECD CN(OCc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854219 AEVLWFUSPODKCN-UHFFFAOYSA-N 436.556 2.425 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 918062893 CENBCZQNDDMLDJ-UHFFFAOYSA-N 438.575 2.087 10 20 IECD Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 918246036 KDUSOPWMWQTPCV-UHFFFAOYSA-N 446.573 2.345 10 20 IECD COCCOc1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920195664 YXHRDBDCOXEYER-UHFFFAOYSA-N 427.501 2.112 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C)c1-n1c(C)ccc1C 1320147346 HCNQWNJFLJCXDB-KRWDZBQOSA-N 426.473 2.143 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 1321366125 GVCXIPDCVNHTON-BBRMVZONSA-N 448.422 2.020 10 20 IECD CC1(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)COC1 1805033910 FJPFYWPVHSXIHD-GQCTYLIASA-N 430.501 2.084 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cncc(F)c1 1805844577 FXQNZJVTPCPMQD-JLTOFOAXSA-N 437.431 2.055 10 20 IECD CCc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807991003 MIGQMCKAIZUXRM-AOMKIAJQSA-N 447.495 2.479 10 20 IECD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccccn1 1807999821 WNANBONJIHZWNC-GIMINZRKSA-N 447.495 2.406 10 20 IECD O=C(COc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423713 DDWBXZQVTCYBIL-LJQANCHMSA-N 440.500 2.200 10 20 IECD CCO/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828201102 XBKUUWLXWSQONP-HFTNPTAHSA-N 445.497 2.436 10 20 IECD Cc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1838031504 JEBPVXLEVRLWFH-UHFFFAOYSA-N 446.529 2.184 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726625828 QACIJKRFSXLTMH-UHFFFAOYSA-N 439.484 2.475 10 20 IECD COc1cccc(O)c1CNCCc1ccc(OCCN2CCN(C(C)=O)CC2)cc1 728063348 LCEYFTVVPMBWDR-UHFFFAOYSA-N 427.545 2.276 10 20 IECD CC(C)(C)NS(=O)(=O)CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743591852 IQJULCWTTCSZCG-CQSZACIVSA-N 448.536 2.274 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)c1 743906859 RSLMLQRWNSJDEX-GFCCVEGCSA-N 429.429 2.182 10 20 IECD COc1ccc(N2CCN(CCN[C@@H](C)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 746049337 PNSGPKJBDHRPLC-IBGZPJMESA-N 446.617 2.418 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC3CCC4(CC3)OCCO4)cs2)cc1 751938400 ZVEQIYURIKQDPJ-UHFFFAOYSA-N 431.514 2.275 10 20 IECD O=C(Nc1cnn(CC(F)(F)F)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 762415258 AZSGDJVZJLWUSD-HNNXBMFYSA-N 426.395 2.297 10 20 IECD Fc1cc(CNC(=S)NCc2ccon2)ccc1N1CCN(c2ncccn2)CC1 764452992 CBJXWFJBSSHGEE-UHFFFAOYSA-N 427.509 2.095 10 20 IECD C[C@@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)S(=O)(=O)C1CCOCC1 765383347 BSJLDQXTXMCIBZ-AWEZNQCLSA-N 446.516 2.355 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(OCC)ccc3O)CC2)cc1 768160451 OBKJLACECPLLOI-UHFFFAOYSA-N 448.541 2.474 10 20 IECD O=C(CCCS(=O)(=O)N1CCCC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771053143 LSWPHOUTMYDDMV-SFHVURJKSA-N 443.997 2.332 10 20 IECD Cc1c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc(Br)cc1S(N)(=O)=O 773747752 HJKGKODSWKSRQK-VIFPVBQESA-N 443.319 2.177 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773859614 WRYMZKMUHPSPEO-LLVKDONJSA-N 425.457 2.250 10 20 IECD CN(C)C(=O)C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 775218543 SRAKRQSXVLLKKF-OAQYLSRUSA-N 442.535 2.088 10 20 IECD O=C(NC[C@@H]1COC2(CCOCC2)O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776944676 DPUYMQOLFXGOPI-MAUKXSAKSA-N 441.475 2.478 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 783302169 ASZPTJDPTBCECB-UHFFFAOYSA-N 444.463 2.438 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc(OC)c1OC 785483203 NTJRGTSAPSIMPQ-UHFFFAOYSA-N 425.485 2.021 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cc(OC)ccc3OC)CC2)cc1 786685270 VLBVMIPUWJIFRF-UHFFFAOYSA-N 441.528 2.156 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCO[C@@H]3CCCC[C@@H]3C)cc2F)CC1 787990690 SNEJQMXCUQEIEG-PGRDOPGGSA-N 448.583 2.295 10 20 IECD Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 788931871 JXVWOSYALVHIPI-QFIPXVFZSA-N 434.540 2.129 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2Br)cc1 797431274 KXHGOKGCLKADKX-UHFFFAOYSA-N 438.300 2.265 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688079 UWHQUMIIZBHOAH-APWZRJJASA-N 444.576 2.447 10 20 IECD CC[C@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1c(C)nn(C)c1C 807770472 PPNVZUXDNBKCAN-FQEVSTJZSA-N 427.549 2.352 10 20 IECD COCCOCc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 812545245 LXPBMWXKLRUMKC-UHFFFAOYSA-N 425.529 2.448 10 20 IECD C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccc(S(N)(=O)=O)c1 916197512 VVYYOCYBUQTMNV-QAPCUYQASA-N 433.530 2.491 10 20 IECD COCC(=O)NC1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 917120066 UEBGUTONGJGHMD-HNNXBMFYSA-N 449.507 2.016 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(OC[C@@H]2CCCO2)c1 918340230 NFSXSJNSSGYKEK-QFIPXVFZSA-N 444.553 2.409 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3F)cc2)C1 918462556 CHWCVWFPRLXCGR-CQSZACIVSA-N 432.883 2.436 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccc3nc(N4CCOCC4)sc3c2)C(=O)NC1=S 920979401 KZZNEWYJNAOZOS-GXDHUFHOSA-N 445.570 2.328 10 20 IECD CC(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781119384 JJJIGTKWKHYACV-DYESRHJHSA-N 440.924 2.304 10 20 IECD O=C(CCOc1ccc(F)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600795 DXLDKJNJJQETME-BJWYYQGGSA-N 429.448 2.353 10 20 IECD CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1C 1798920301 MKUQBWWOWGXEOY-GGPHIMKMSA-N 448.527 2.256 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccnn12 1800899631 AHUKDNHUOFJUHS-ZBTRPWJCSA-N 448.479 2.416 10 20 IECD Cn1cc(C(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)cn1 1808351708 ZKOYTLWSXAPZLE-UHFFFAOYSA-N 448.527 2.058 10 20 IECD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccn1 1813504598 PNVZXNIDYTZGSX-LBUQITIBSA-N 447.495 2.406 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1820772525 IYQAVRDXXKFXCY-MJCKAROISA-N 435.575 2.308 10 20 IECD CN(C)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823475388 SIFOPXYRQOJYMC-DYLHUKMJSA-N 443.504 2.184 10 20 IECD O=C(Cn1nccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740083 HQBDJPUZTOSVDU-KRWDZBQOSA-N 447.923 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCOC2)CC1 1832383845 MGAVUUSUDUDBCU-BJAZZSIWSA-N 444.528 2.473 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@H](CCS(C)(=O)=O)C3=O)c2C)cc1C 16544304 KUJZEOTYEVFLED-IBGZPJMESA-N 445.541 2.249 10 20 IECD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1ccc(N2CCOCC2)cc1 108805586 HTKCXIWOMAWRAU-UHFFFAOYSA-N 440.456 2.436 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)N3CCOc4cc(N(C)C)ccc43)cn2)C[C@H](C)O1 543883273 FEEHVUVHCHAGPL-HOTGVXAUSA-N 442.520 2.016 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C 728758372 HHGQGLNVIUARTB-MRXNPFEDSA-N 425.485 2.434 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)cc2F)CC1 730391512 ONCOBSDCEHOFED-UHFFFAOYSA-N 443.479 2.439 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)CC1 747480933 IIRKJUAYFXJHPY-NRFANRHFSA-N 437.606 2.322 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1 747482335 YYBQCNBEIIMAEG-HXUWFJFHSA-N 439.512 2.419 10 20 IECD COc1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1N1CCNC1=O 747717797 YFMOAXFJKPLKFI-UHFFFAOYSA-N 440.500 2.106 10 20 IECD CCNS(=O)(=O)c1ccc2c(c1)N(CC(=O)N(C)Cc1ccc(N(C)C)cc1)CC2 749351057 GAOMOXUWOBTEPC-UHFFFAOYSA-N 430.574 2.072 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 751318613 MZHGYDJHQCMLSR-AWEZNQCLSA-N 442.559 2.471 10 20 IECD CS(=O)(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 760745501 XPTDPQQZZYVFGA-UHFFFAOYSA-N 449.495 2.261 10 20 IECD C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765981498 VJMCORPAPYUEGG-XXBNENTESA-N 428.602 2.317 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4c(cc3F)NC(=O)CC4)CC2)cc1 768111527 KBOHXHHPWMLDOO-UHFFFAOYSA-N 441.459 2.225 10 20 IECD CN(C)C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 769862345 UVLVRMYPCVERHE-CQSZACIVSA-N 448.501 2.125 10 20 IECD COc1cccc(C2(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCOCC2)c1F 773829359 BQPNQDSIVBYVKJ-UHFFFAOYSA-N 438.477 2.347 10 20 IECD C[C@H](NC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 775710332 WNUIQNOYXLSLQA-MGPUTAFESA-N 437.500 2.156 10 20 IECD C[C@@H](NCC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 775832359 ZQCQVGOJNNCTDM-GOSISDBHSA-N 441.551 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-n4nccn4)cc3)CC2)cc1 778232952 KICRXXUCMAGJKH-ZHACJKMWSA-N 432.484 2.119 10 20 IECD Cn1ccc(COC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 785398031 MPZKCBXOOYUYFM-UHFFFAOYSA-N 432.414 2.192 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C(C)C)N3CCOCC3)cc2)CC1 786458679 NJGQCFIWQXDNNZ-QFIPXVFZSA-N 430.593 2.012 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCc2cccc(C(N)=O)c2)cc1 787857897 UFFUOMJMLOJWIB-UHFFFAOYSA-N 434.496 2.290 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 787993323 RRCMHHNFNCSWIB-UHFFFAOYSA-N 441.528 2.076 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C)cc2Br)ccc1O 790407814 RVZWKFBOICPQPA-UHFFFAOYSA-N 435.321 2.172 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc(S(=O)(=O)CC)cc3)nc12 792946942 FZPVIYQIPBQCGK-CYBMUJFWSA-N 432.502 2.256 10 20 IECD CC1CCC(C)(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793726308 SVZSALQSXSHYOV-ZIYFGUEUSA-N 428.577 2.337 10 20 IECD CCOC(=O)[C@H](CCOC)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 798774633 QPNLJEMMEAQJGZ-INIZCTEOSA-N 440.408 2.068 10 20 IECD C[C@@H](NC(=O)C(=O)NCCN1CCCc2ccccc21)c1ccc(N2CCOCC2)cc1 803304138 DFVRIXMFDNQCLP-LJQANCHMSA-N 436.556 2.269 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3c(C)cc(C)nc3OC)CC2)cc1 804033588 DCUFQNNKZOHYSY-UHFFFAOYSA-N 426.517 2.117 10 20 IECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@H]1C[C@H]2CC[C@H]1C2 804315962 WIXPNHCEPIREGZ-SPEDKVCISA-N 429.561 2.444 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C[C@H]2CCOC2)CC1 807102646 SMLHCWHFDYZNPV-HXUWFJFHSA-N 430.593 2.107 10 20 IECD C[C@@H](OC(=O)[C@@H]1CCN(C)C(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 912703362 HRAPPYSWINFXTA-ZIAGYGMSSA-N 434.448 2.201 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(C(=O)O)s2)cc1OC 917758230 MFJWJJAHLCSMTI-UHFFFAOYSA-N 434.517 2.326 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccc(F)cc3)cc2)C1 918118116 VYJOKIGAMDXZRD-PMACEKPBSA-N 442.535 2.178 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(-n2cccn2)cc1 918442251 CRSVJZDBZFNWJN-UHFFFAOYSA-N 433.512 2.336 10 20 IECD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cccc1[N+](=O)[O-] 920636855 OESXSSSACOMPTO-NSHDSACASA-N 437.430 2.164 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccc2)c1OC 1321366304 JGNYVNWGQIXMEP-KRWDZBQOSA-N 425.441 2.196 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccc(F)c1 1798867229 BKDCNKVWJBREHB-ZSBFGKGUSA-N 434.851 2.407 10 20 IECD C[C@H](CN)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807017911 MUUZTJYVRRCOLK-UVBSCNOISA-N 432.908 2.061 10 20 IECD C[C@@H](Nc1nccs1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551375 ITKNXPWSQFWGIR-CQSZACIVSA-N 445.545 2.295 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCc2ccc(F)nc2)=NN1c1ccccc1 1848172616 NQYGLPDDRQMNTQ-PMACEKPBSA-N 449.486 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCN(C(=O)OCC(C)C)CC3)CC2)cc1 110188752 WCPOGSGDODVMFK-UHFFFAOYSA-N 432.565 2.144 10 20 IECD O=C(Cn1ccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)n1)N1CCOCC1 737009732 WXXGJZJRZDSAGJ-UHFFFAOYSA-N 439.472 2.275 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccn(Cc2ccccc2)n1 738907053 UGGHLEBZYJVDOY-UHFFFAOYSA-N 439.541 2.488 10 20 IECD O=C1c2ccccc2C(=O)N1CCN1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 741802642 ZEGJFZHZTXKVBS-UHFFFAOYSA-N 425.510 2.130 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3c(C)noc3C3CC3)CC2)cc1 767968289 MFFWJJPFSCASCZ-UHFFFAOYSA-N 441.532 2.136 10 20 IECD COc1ccc2c(c1)OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 768049703 WCUJZZKNJYXVRK-OALUTQOASA-N 438.528 2.200 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3CCCN(CC(C)C)C3)CC2)cc1 773000691 YVFSASNYFYZNCL-NRFANRHFSA-N 431.625 2.484 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(C)cc(C)n3)CC2)cc(OC)c1OC 773509255 LNCCETNKQJZDDE-UHFFFAOYSA-N 428.489 2.012 10 20 IECD COc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nc1I 773766519 OGHAJJMTTGPRKT-SECBINFHSA-N 428.226 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccn(-c4ccncc4)n3)CC2)cc1 778277893 QZPJKNFRVLMFFF-SREVYHEPSA-N 432.484 2.119 10 20 IECD CC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 778372796 HPGQGSRFOYBGCB-TZZQJPOUSA-N 431.533 2.137 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CCO)C3CCCCC3)CC2)cc1 778376615 DAKLJFINTQBEKS-SSSWZJSRSA-N 429.561 2.348 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)CC2)cc(OC)c1OC 781019235 FTQMXHSPSWTDCV-MRXNPFEDSA-N 435.521 2.370 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(COC3CCOCC3)cc2)cc1 785442326 JULHMIZOXFODRR-UHFFFAOYSA-N 425.529 2.381 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CC3CN(C(=O)OC(C)(C)C)C3)cc2)CC1 787320473 VUUZYBMAHYDKPU-UHFFFAOYSA-N 430.549 2.228 10 20 IECD CCCCCn1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(C)n1 788313386 SCENICLXVCJGGZ-UHFFFAOYSA-N 427.549 2.151 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)CN3CCCCC3)cc2F)C[C@H](C)O1 789828281 WUQWRKBCOOBHKS-QYZOEREBSA-N 448.583 2.294 10 20 IECD Cc1cnccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789955489 PGYGRPIYGIUJHD-UHFFFAOYSA-N 436.434 2.178 10 20 IECD Cc1nn(C)c(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Br 790469875 CPBRPLHAEVSOQT-UHFFFAOYSA-N 427.368 2.016 10 20 IECD COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 792934040 KDCIZSBHMDINDW-WMZHIEFXSA-N 439.556 2.354 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)cc1 799122375 GYDNZNBSQIRLPC-UHFFFAOYSA-N 442.515 2.434 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1)c1ccc(N2CCOCC2)cc1 803296826 IAAXUSWXGFZVHJ-GOSISDBHSA-N 433.512 2.203 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1ccc(F)cc1 803304187 FBVRNJQZNLUPPK-IAGOWNOFSA-N 429.492 2.423 10 20 IECD CN(C)[C@H]1CCC[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451075 YBQJTBUJHOSBCO-AEFFLSMTSA-N 438.519 2.362 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661990 QICAHBJCMMGHNK-RHSMWYFYSA-N 436.528 2.270 10 20 IECD O=C(NCCn1cc(Br)cn1)NCc1ccc(N2CCOCC2)c(F)c1 804969235 ODBXCECEAWHGKP-UHFFFAOYSA-N 426.290 2.121 10 20 IECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)O2 806701875 NVGJFMGHZMGOAO-RWQLFJTDSA-N 446.544 2.338 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CC(F)(F)Br)CC2)cc1 813765940 ORLJRYDKVIJPQE-FPLPWBNLSA-N 446.292 2.346 10 20 IECD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915699684 LRYKVSWVPDXHEC-QFIPXVFZSA-N 438.507 2.400 10 20 IECD COc1ccccc1N1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971426 XUSWAXBNOHVXSY-KRWDZBQOSA-N 441.503 2.465 10 20 IECD CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920195000 LZHPWPZFNIMIGH-QGZVFWFLSA-N 438.528 2.306 10 20 IECD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920964480 IJDFOSSAZQCYER-SPDQCEQOSA-N 426.428 2.208 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1cc(O)nc(O)c1 1800350092 ROYLISVIMDNNAO-CLLJXQQHSA-N 430.392 2.106 10 20 IECD Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808788655 MSPKPPZDNOEQNM-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccncc1F 1808883647 JVCCNRNZISQJPL-VLIAUNLRSA-N 437.431 2.055 10 20 IECD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1824312911 NOLMDXVTGCHRAE-MAUKXSAKSA-N 427.505 2.184 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc3ncccc3[nH]2)C1 1845587145 VAYHMBCXTVMKMB-UHFFFAOYSA-N 442.479 2.173 10 20 IECD COCC(=O)Nc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726726737 VVVZSXDYMQXLTR-UHFFFAOYSA-N 440.500 2.004 10 20 IECD CCS(=O)(=O)NCCOC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 731704628 XMBLVNWWPGOSOJ-ACCUITESSA-N 448.613 2.212 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)n3cccn3)c2)c1 734073057 BLPXEOJRFGEONF-CQSZACIVSA-N 437.456 2.052 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)cc2F)C[C@@H](C)O1 737107631 NJNIQNQJSHGXLF-ZHANGXNJSA-N 447.532 2.432 10 20 IECD COC(=O)c1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)sc(C)c1C 743888183 ZDZVKNYZLZRLBG-UHFFFAOYSA-N 449.504 2.382 10 20 IECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 746132844 ANTUJZVWKOJCQD-MRXNPFEDSA-N 434.472 2.119 10 20 IECD Cc1c(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1[N+](=O)[O-] 748471665 OLPJQTQPGDRHIC-UHFFFAOYSA-N 445.447 2.281 10 20 IECD CCOC(=O)CN(CC(N)=O)C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 749585557 CVSAUPFBBCSCFP-UHFFFAOYSA-N 436.306 2.347 10 20 IECD COC(=O)Cc1sc(NS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)nc1-c1ccccc1 751588632 NOXMSKPRJHLLMC-CQSZACIVSA-N 448.526 2.484 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CC2)cc1F 753730173 GDTOYXADHXEOJY-INIZCTEOSA-N 435.521 2.158 10 20 IECD COC(=O)c1ccc(CNC(=O)[C@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753861522 RIPWYRBUVXEXLU-INIZCTEOSA-N 429.492 2.448 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754212551 KXBZHVKOAQCQJT-UHFFFAOYSA-N 443.475 2.227 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@@H](C)C[C@H](C)C4)C3=O)CC2)cc1 756864650 VPBLBSLKBWAORA-IRXDYDNUSA-N 428.533 2.091 10 20 IECD COc1cc(N2CCN([C@H]3CC(=O)N(c4ccc(F)cc4)C3=O)CC2)cc(OC)c1OC 758821475 SCHZEDOPAGTULG-SFHVURJKSA-N 443.475 2.306 10 20 IECD O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NCc1cccc(Br)c1O 765729599 PWYPGOFGVQYYQS-UHFFFAOYSA-N 434.250 2.167 10 20 IECD Cc1cn2cc(NC(=O)C(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)ccc2n1 774353573 ARPWMPISMDRSFZ-UHFFFAOYSA-N 446.555 2.430 10 20 IECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 779337114 XBVNYZABPFIKHZ-WMZOPIPTSA-N 447.580 2.491 10 20 IECD O=C(COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(O)c(O)c1 782564878 KZBRKXMIOVVDIW-CQSZACIVSA-N 437.445 2.064 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)Cc3ccccc3C)CC2)cc1 786229526 ZLHICOCXQPBNHT-QFIPXVFZSA-N 440.588 2.419 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 786655133 DRNIAGCKQNQTJF-GHTZIAJQSA-N 428.577 2.256 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(CCCO)[C@@H]1CCc2ccccc21 788312249 FHNGUUZDBIHLLS-HSZRJFAPSA-N 437.540 2.038 10 20 IECD O=C(COC(=O)[C@@H]1CC(=O)c2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 789305244 OXXSWWUPZXSOMR-GOSISDBHSA-N 426.444 2.192 10 20 IECD CO[C@@H]1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949546 JQWDDMRKECUZAL-MAUKXSAKSA-N 443.466 2.090 10 20 IECD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 792123253 HKYQBZRRLCSQCP-JOCHJYFZSA-N 435.471 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@](CO)(c4ccccc4)C3)CC2)cc1 794734771 NYBZPFMSKNGLSW-GIPLCNRYSA-N 449.551 2.063 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1cnn(Cc2nnc3n2CCCC3)c1 794801217 HMLCDHCZKKBHHB-UHFFFAOYSA-N 441.879 2.187 10 20 IECD CCn1ncc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C(F)(F)F 799237855 NCZIVEUMBLINKF-UHFFFAOYSA-N 445.467 2.478 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCCN(c2ccccc2)C1=O 807290005 BCLPRBZVXVDLAK-JOCHJYFZSA-N 432.524 2.333 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccncc1OCC(F)(F)F 807292756 XUQAPXNLTHEWQG-UHFFFAOYSA-N 434.418 2.332 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768134 CWWDKPPWKOLUJU-AAEUAGOBSA-N 439.488 2.410 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC2(CCC2)C1 807771909 YZSSTIAGAZSCEY-INIZCTEOSA-N 437.487 2.402 10 20 IECD CCOC(=O)C1(Cc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CCC1 809464609 IVOHQMRZIJRUSF-UHFFFAOYSA-N 442.516 2.245 10 20 IECD Cc1cc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2)n[nH]1 809679214 AYVHIAQKAZIJKZ-UHFFFAOYSA-N 438.576 2.452 10 20 IECD Cc1cc(NC(=O)[C@H](C)SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 917707668 UHDUURKQBVHZJG-AWEZNQCLSA-N 436.509 2.335 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2NC1=O 918032653 GCBCINPVFARUQO-HOCLYGCPSA-N 437.500 2.429 10 20 IECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 918081033 WPSUFPCQUBFAOW-KRWDZBQOSA-N 448.317 2.360 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 918221128 OBCRKRRCJRRGRW-GGPKGHCWSA-N 434.556 2.446 10 20 IECD COc1c(C)ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 918465467 NTTBEMBSFGWDRI-GOSISDBHSA-N 438.528 2.269 10 20 IECD CCOC(=O)c1c(CC(C)C)csc1N/C=C1\C(=O)NC(=S)N(CCOC)C1=O 920978560 JGQZQPPWVYZLRC-UKTHLTGXSA-N 439.559 2.309 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 1319033316 QBXSOLQFWPKKLD-UHFFFAOYSA-N 432.470 2.009 10 20 IECD Cn1ccnc1C[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 1319781115 HWTXDBRUHVEBLR-WOJBJXKFSA-N 438.576 2.286 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc([S@@](C)=O)cc3)CC2)cc1 1337366970 YJCLDAIAQIFKBM-DZWLFIIDSA-N 427.526 2.276 10 20 IECD CC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C3=NN(c4ccccc4)C(=O)C3)C2)CC1 1778126048 DOCQFIRJXDXTGA-NTKDMRAZSA-N 438.528 2.093 10 20 IECD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)n[nH]1 1792314975 PTQJPSBFWFNKRJ-UHFFFAOYSA-N 443.554 2.326 10 20 IECD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(C)n1C 1798392843 VPHHTDMAKALHIZ-CCWDJLKJSA-N 447.919 2.224 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cc3c1CCC3)C2)c1cc(O)c(O)c(Cl)c1 1799769099 MEPFHUFSFNFIBO-ZSBFGKGUSA-N 445.903 2.085 10 20 IECD CNCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708564 HEBMXQZPZPCCBD-NSHDSACASA-N 438.937 2.433 10 20 IECD CO[C@@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1ccccc1 1847038782 BMIMKAQGJNIIIH-XBFAEUMISA-N 438.480 2.408 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(OCCN3CCCC3)CC2)n(C)c2ccccc12 569701453 XPHXCLKRRHKHJZ-UHFFFAOYSA-N 426.561 2.206 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2 728756181 DTYXHLKEJOAULG-UHFFFAOYSA-N 436.512 2.395 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3C)CC2)cc1 734075369 YNHBKYHSBJUJDL-UHFFFAOYSA-N 445.541 2.131 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(C)cc3OC)CC2)cc1 737080867 GGBFATUVNXELOP-UHFFFAOYSA-N 440.544 2.279 10 20 IECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NCc1ccc(N2CCOCC2)c(F)c1 742342030 MUFUKSUYVVUOAB-IMFGXOCKSA-N 436.553 2.004 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 746315926 LNRRLQBNEUULMO-GOSISDBHSA-N 442.482 2.248 10 20 IECD COC(=O)c1ccsc1N1CC[C@@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)C1=O 746779383 HYGRGUQPLPTXBW-IAQYHMDHSA-N 433.486 2.415 10 20 IECD C[C@@H](CCN(C)C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748363242 LHBFJJBKOGKCLN-ZDUSSCGKSA-N 436.490 2.171 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CC12CCOCC2 748844401 ROZYBRPTJMHYEC-GOSISDBHSA-N 425.508 2.375 10 20 IECD COC(=O)c1nscc1S(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 751014195 PVWWQWNWBFINRP-RYUDHWBXSA-N 443.522 2.161 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 752722722 RGPRDQVAPVGENG-KRWDZBQOSA-N 443.475 2.379 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756505483 CYXHCKNZHVBYGB-KRWDZBQOSA-N 434.514 2.427 10 20 IECD O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 766813501 MPWPIGCDSJESBT-UHFFFAOYSA-N 437.493 2.357 10 20 IECD C[C@H](NC(=O)N(CCO)CCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 768273774 BMCFHPPUZPMVHB-KRWDZBQOSA-N 436.553 2.113 10 20 IECD O=C(CNS(=O)(=O)c1cccs1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915147 JXQRWRVGRRMTBN-HNNXBMFYSA-N 443.978 2.166 10 20 IECD COC(=O)CC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 769122582 QPKUHSUFEBGAIK-GJZGRUSLSA-N 438.496 2.188 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(CS(C)(=O)=O)cc3)c2)CC1 769849664 YSRNYJNCOMOCAS-UHFFFAOYSA-N 437.587 2.174 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771059492 SBYYLINWACQVQE-KRWDZBQOSA-N 437.949 2.016 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCNC(=O)c4ccccc43)cc2F)C[C@@H](C)O1 773611963 ULSAPKUPNFHBAK-IAGOWNOFSA-N 440.519 2.306 10 20 IECD CCOC(=O)c1c(C)oc2nc(CN(C)c3ccc(OCC(=O)OC)cc3)nc(N)c12 781917695 RRUWQHNGLQUPOW-UHFFFAOYSA-N 428.445 2.478 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 784356266 YKSHKBLGKVOBMW-RTWAWAEBSA-N 429.586 2.297 10 20 IECD O=C(COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1ccc[nH]1 785399458 RSLHEPWLEDXPOG-UHFFFAOYSA-N 445.409 2.469 10 20 IECD Cc1ccc([N+](=O)[O-])c(=O)n1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 788048477 SIEBFYVNFCYISZ-GJZGRUSLSA-N 432.452 2.134 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)CCO4)cc2F)C[C@H](C)O1 788345716 ZIUYTARLLGCVDC-HOTGVXAUSA-N 441.503 2.307 10 20 IECD CN(CCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 789800260 MVMBDWUQFNYSSS-UHFFFAOYSA-N 442.535 2.311 10 20 IECD O=C(N[C@H]1CCN2CCCC[C@@H]12)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790271687 ADYZUDIRCGVUNL-MNEFBYGVSA-N 436.503 2.116 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccccc1N1CCCC1 793723297 HFWUWDOPFAEQJX-UHFFFAOYSA-N 436.556 2.398 10 20 IECD CCc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 793735519 XYDYVJMXZJRPRP-NRFANRHFSA-N 436.556 2.226 10 20 IECD CC(C)n1cnnc1CN(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 795626370 TUXJGVLDFOGSBQ-IAGOWNOFSA-N 432.544 2.360 10 20 IECD Cc1cc(C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1-c1cccc(Br)c1 798271274 ZURLRUBDXSANOJ-UHFFFAOYSA-N 445.321 2.494 10 20 IECD COC(=O)C(=O)CCCOC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 803225569 LDXJJMMOCYCWFG-UHFFFAOYSA-N 425.349 2.049 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H]3[C@H]3CNC(=O)C3)cc2)CC1 805024394 DUFRZIRAWUXQGY-TZIWHRDSSA-N 426.561 2.056 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385908 UJEJDHCDMLKMPR-LLVKDONJSA-N 437.294 2.037 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(C[C@@H]1CCOC1)C1CC1 807771894 YPXZMGIUVYUPGT-JKSUJKDBSA-N 437.487 2.401 10 20 IECD CCOC(=O)c1sc(CNC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)nc1C 808824866 DYFVNUQZAHHXLH-UHFFFAOYSA-N 432.546 2.359 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCNC4=O)cc2F)C[C@@H](C)O1 809982147 JSTQESPJEOTXIU-HZPDHXFCSA-N 441.503 2.420 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc([N+](=O)[O-])c(N(C)C)cc3F)nc12 814482585 ZVHWASYQDYHTHI-UHFFFAOYSA-N 447.379 2.082 10 20 IECD CNC(=O)c1ccc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 915328550 GLPMSECBPMXWBG-UHFFFAOYSA-N 425.533 2.389 10 20 IECD O=C(CNS(=O)(=O)c1c(F)cccc1F)N(Cc1ccccc1O)C[C@H]1CCCO1 917364828 NXWZWZHICCPJJB-OAHLLOKOSA-N 440.468 2.157 10 20 IECD CC1CCC2(CC1)NC(=O)N(NC(=O)CN(Cc1ccc(N(C)C)cc1)C(C)C)C2=O 917416918 CTUFCAUMVFUAOU-UHFFFAOYSA-N 429.565 2.495 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc(OC)c1OC 917833474 OQBOCXGHWHDTDB-INIZCTEOSA-N 427.501 2.344 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 920253990 DLKAAVYZZBIPBU-BYUVYSIJSA-N 448.567 2.415 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C2CN(C)C2)CCO3)cc1 1781755746 SAQMIQQLJJAABG-VWLOTQADSA-N 436.556 2.099 10 20 IECD Cc1nscc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005143 VKDIRSLDHQZFSQ-IBGZPJMESA-N 437.905 2.273 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2 1785509136 SJNCPGPVINFZID-HTXHHYGKSA-N 448.472 2.161 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ncccc1F 1796934987 ZGQJJZMUOVEFKW-ACHSLPGTSA-N 435.459 2.265 10 20 IECD Cn1cc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1797203635 BFGRNKDCIQZMOP-VBUUOAMHSA-N 437.475 2.209 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2SC=C[C@H]21 1801327182 KUDCAIUGHWJNAO-ATPXADIUSA-N 428.510 2.330 10 20 IECD Cc1cccnc1C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1806275632 UUKUMLBXVRTWHB-UHFFFAOYSA-N 446.598 2.095 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469895 RAQKHBKXNJLOGK-PGVBMLAISA-N 449.486 2.238 10 20 IECD CC(C)(F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498357 PYGNFPCNULMGMP-LLVKDONJSA-N 427.527 2.010 10 20 IECD C/C=C/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499530 LAWVNYBVAQKPBI-MBYWZOSGSA-N 433.559 2.394 10 20 IECD O=C(C1CCC(O)CC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428751 HNCRFWRARTWDPQ-NKELODKYSA-N 431.533 2.277 10 20 IECD O=C(C1=CCCS1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836897966 UQDWKEFOAOSQMQ-UHFFFAOYSA-N 433.530 2.126 10 20 IECD O=C(C1Cc2ccccc2C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037708 OCLNJZUUWLXODD-VQHVLOKHSA-N 434.492 2.435 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 22692595 RABHWPOSLDENQE-HXUWFJFHSA-N 431.558 2.482 10 20 IECD O=C(NC1CC1)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 195649076 HUNYDFVPEJXDKD-SFHVURJKSA-N 440.466 2.495 10 20 IECD NC(=O)Cc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726725571 ASRKCAPSXVSSDJ-UHFFFAOYSA-N 446.454 2.040 10 20 IECD CN1CCN([C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2)CC1 729523961 ZYVJTADIPVFRKN-DEOSSOPVSA-N 440.563 2.392 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc21 734490451 GVJPBYIQMHHCPM-UHFFFAOYSA-N 429.542 2.253 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 735188738 JUZVCSSQKHRAKA-UHFFFAOYSA-N 436.490 2.201 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3nc(-c4ccco4)oc3C)nc12 750189620 GKVSVUVQBPWYGQ-UHFFFAOYSA-N 426.385 2.454 10 20 IECD O=C1OCCN1c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751238193 YIDYTYFQRYVYFU-UHFFFAOYSA-N 445.541 2.330 10 20 IECD CC1(C)Cc2cc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)ccc2O1 753363260 KOBNQGUVPDZZDK-UHFFFAOYSA-N 440.499 2.271 10 20 IECD CCCCN(C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 756335188 GCZZPINQDUSZAG-WOJBJXKFSA-N 438.590 2.189 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N(C1CCCCC1)[C@H]1CCS(=O)(=O)C1 759588100 IEMHHINJDKZWTC-LKUPDRCFSA-N 437.514 2.003 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1S(C)(=O)=O 765928327 XTUDNRXXUPMRCO-UHFFFAOYSA-N 441.303 2.122 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)NC(=O)OC(C)(C)C)cc1 767048926 HGBZHZIWKXEXJV-HNNXBMFYSA-N 432.481 2.390 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 770761980 RZJMZCVBZMRJTE-INIZCTEOSA-N 430.455 2.406 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1-n1nnnc1C1CC1 773860219 WVPUKQXOCDLEEW-AWEZNQCLSA-N 449.515 2.430 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccc(C[C@H]4NC(=O)NC4=O)cc3)CC2)cc1 775701720 HXJJTQZMRYYJMS-HXUWFJFHSA-N 437.500 2.190 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1 782780434 JWXUKZKINAOFKI-UHFFFAOYSA-N 428.537 2.250 10 20 IECD COC(=O)Cn1ccc(N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 783569893 AGEHYWJZDSQQNK-CYBMUJFWSA-N 432.436 2.271 10 20 IECD O=C(Cn1ccnc1[C@H](O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)c(F)c1 786759394 ULSBICPKJGGIPH-JOCHJYFZSA-N 442.466 2.396 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCNc1nccc(C(F)(F)F)n1 786981316 QIMDUUQJGHSBMC-UHFFFAOYSA-N 425.411 2.168 10 20 IECD CCOC(=O)[C@@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 787364135 NSEVYRMSCREGCI-IXDOHACOSA-N 435.540 2.472 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1 788913790 ZIQFTCWSTVYGPK-UHFFFAOYSA-N 438.503 2.027 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)cc2F)C[C@@H](C)O1 789824561 IYEVOERECABEAC-HWIQRTGZSA-N 447.551 2.375 10 20 IECD C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832561 AKEHDTDMLZXGJO-KSFYIVLOSA-N 440.519 2.408 10 20 IECD COc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860186 JFQKCXANWJANJO-UHFFFAOYSA-N 443.569 2.450 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCC[C@@H](N2CCCC2)C1 789864166 MOTNDSNHRNLSDF-OAQYLSRUSA-N 430.618 2.333 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1Br 795141863 YMYPVOYFLQJGFT-UWVGGRQHSA-N 433.259 2.165 10 20 IECD CC(C)(O)CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1 803448173 KBYKAMMIBXGHJJ-UHFFFAOYSA-N 425.476 2.135 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(F)c(F)c3)cc2F)CC1 803555105 NSLMCIRBITXVNE-UHFFFAOYSA-N 448.489 2.221 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 803747391 QWCCAMKXKMXMOS-HSALFYBXSA-N 428.577 2.018 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3scnc3C)cc2F)CC1 805010137 VFYBZBBDXCXVRR-UHFFFAOYSA-N 433.553 2.007 10 20 IECD COc1cccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 805477573 LISXJHHDRKUSSE-FQEVSTJZSA-N 434.540 2.473 10 20 IECD CN(Cc1ccccc1)C1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 806494131 LNWUEJZCCQPCAW-OAQYLSRUSA-N 435.572 2.414 10 20 IECD Cc1ccc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2=O)cc1 806494668 UEHHKTCPSNKOOC-FQEVSTJZSA-N 449.555 2.255 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3ccc(-n4ccnn4)cc3)CC2)cc1 809613265 PUQAGBNTMVZEOO-GOSISDBHSA-N 448.527 2.192 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC(C)(C)c3cc(C(=O)OC)on3)cc2F)CC1 812032609 JCPYJAQKXXGZCT-UHFFFAOYSA-N 447.511 2.477 10 20 IECD CSc1nc2nc(C)c(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(C)n2n1 917710054 ZUJGNTSGOTYXOC-UHFFFAOYSA-N 444.536 2.298 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)cc2)C1 917833025 KNRJZJZUWAYUQI-RTWAWAEBSA-N 434.540 2.053 10 20 IECD O=C(Nc1nncs1)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918223756 KXPFZJNIGFJYGM-UHFFFAOYSA-N 448.524 2.074 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CN3CCCCCC3=O)cc2F)C[C@H](C)O1 918813919 DHXWTTHHNLASFF-IRXDYDNUSA-N 449.523 2.001 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](CO)C3CCCCC3)CC2)cc1 1117735366 XRIHZPBXEQTJRW-DUQGCJEPSA-N 429.561 2.205 10 20 IECD O=C(CSc1nc2ccccc2[nH]1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1334459195 QIEQCUSJYAPNBS-UHFFFAOYSA-N 430.555 2.206 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(CC)n(-c2ccccc2F)n1 1338289415 XERWQUGCTAKCPL-HNNXBMFYSA-N 442.447 2.284 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1778341609 ZZCPZEUEVJJYMD-VUMVONDWSA-N 438.528 2.045 10 20 IECD CCC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786297017 NRQXXIUESAORQH-ZDUSSCGKSA-N 426.473 2.155 10 20 IECD Cc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cs1 1805962342 XLEANOMHSXGUHA-AUUYWEPGSA-N 439.497 2.286 10 20 IECD Cc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816725182 MBDYMKFCIBLDDA-JTQLQIEISA-N 431.499 2.254 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccc(F)s1 1833894916 UCGVSGHRPXFVEC-UHFFFAOYSA-N 448.520 2.192 10 20 IECD COc1ccc(N2CCCN(c3ccc(S(C)(=O)=O)cc3S(C)(=O)=O)CC2)cc1 108244891 YDNCWMONIBWONR-UHFFFAOYSA-N 438.571 2.219 10 20 IECD O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 117630244 IEYBXQSPYFVSFE-DHDCSXOGSA-N 447.532 2.259 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)n(C)c2ccccc12 671058457 PUBVNHQTOGSGJQ-LJQANCHMSA-N 447.583 2.430 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726725397 BVBVFIQXBJBSEY-UHFFFAOYSA-N 444.919 2.432 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1C(N)=O 729055774 APGDTGLWAKFINW-GASCZTMLSA-N 442.491 2.102 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2F)CC1 730194987 VCRRWPHHMVYBMX-YTQUADARSA-N 444.551 2.148 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 731405553 HJIASEQWGFWLMY-UHFFFAOYSA-N 439.541 2.238 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CNC2CCN(S(=O)(=O)C3CCOCC3)CC2)c1O 736361247 QFGIQEFXZDKNNS-UHFFFAOYSA-N 433.914 2.017 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1 737184848 YITICHOZCLAHIY-NSHDSACASA-N 431.401 2.286 10 20 IECD CN(c1ccc(CNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1)C1CCCCC1 742416218 OLWVWUMHGJTWQS-WIYYLYMNSA-N 447.601 2.107 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(OC)n1 743381931 KUFUXBDOKJETSN-ZIAGYGMSSA-N 446.479 2.106 10 20 IECD NC(=O)CCSc1ccccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743954680 DCXMEKRLLQUVKS-UHFFFAOYSA-N 427.526 2.493 10 20 IECD C[C@@H]1CCCN1CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 746111160 ZLPKWPXPWMOSLM-OMJMQIJPSA-N 433.555 2.217 10 20 IECD CC(C)(CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)S(C)(=O)=O 748961976 TTXOAWIUENVJIU-UHFFFAOYSA-N 437.484 2.164 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 749502599 ZFZKTGSOUANATK-QGZVFWFLSA-N 432.542 2.434 10 20 IECD CC[C@H]1CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](CC)CN1C(C)=O 752911210 ZWZGONSJNLOMLA-LEWJYISDSA-N 445.608 2.248 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4sc5c(c4c3=O)CCC5)CC2)cc1 758195210 SWMFBYZVFGYXLO-QGZVFWFLSA-N 440.569 2.138 10 20 IECD COC(=O)[C@@H](Cc1ccc(Cl)cc1)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 759498740 JEKMPJNCZZEXFJ-MRXNPFEDSA-N 427.862 2.358 10 20 IECD COc1cc(N2CCN([C@H](C)C(=O)NC(=O)NC3CCCCC3)CC2)cc(OC)c1OC 759887185 UPEVRNMSOSHWMF-MRXNPFEDSA-N 448.564 2.381 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)cc(OC)c1OC 760127575 PVCQQVDCHOYWJC-UHFFFAOYSA-N 429.521 2.205 10 20 IECD O=C(Nc1cnn(CC(F)(F)F)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 762415259 AZSGDJVZJLWUSD-OAHLLOKOSA-N 426.395 2.297 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOC2(CCOCC2)C1 768383039 GFLXSMJSBFAQML-UHFFFAOYSA-N 438.527 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4ccc(F)cc4[nH]3)CC2)cc1 778298290 PIRLCAMORNZTGL-CMDGGOBGSA-N 437.475 2.232 10 20 IECD Cc1ccc(C(=O)NC[C@@H](O)COc2ccc(I)cc2)c(O)c1O 780970657 ZDJWHZRISDUMFS-GFCCVEGCSA-N 443.237 2.181 10 20 IECD CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)ccc21 785294028 JYOLBFVTIHRFAF-AWEZNQCLSA-N 439.468 2.302 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1SCCc2ccccc21 788312109 CUGBQNUVNCYCMS-NRFANRHFSA-N 425.554 2.286 10 20 IECD CC(C)(C)OC(=O)NC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 788936106 HDASDWKCEOJROY-LJQANCHMSA-N 430.549 2.323 10 20 IECD Cc1ccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789837235 XFKZWAGAAKGNJZ-KRWDZBQOSA-N 443.519 2.295 10 20 IECD Cc1cnc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 789949099 FKMQJVLBVZDRCM-UHFFFAOYSA-N 442.463 2.240 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC([C@H]2CCOC2)C1 792051712 OBTHLSHXRCQPDL-SFHVURJKSA-N 440.523 2.120 10 20 IECD COc1ccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(O)c1 794378981 LHEJVMJVRICKNH-GOSISDBHSA-N 449.485 2.169 10 20 IECD CC(C)CN1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803451523 OBRPCOWBHNLEGQ-UHFFFAOYSA-N 438.519 2.173 10 20 IECD CC1(C)[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]2CCO[C@H]21 803451552 OSYVRNYGMWFVDI-RCCFBDPRSA-N 437.487 2.303 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)CC2)cc1 804318602 OUOHQAMHYGQWDX-MRXNPFEDSA-N 448.564 2.200 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCCc1csc(N2CCCC2)n1 806282359 WAZQCRAIXYTSJZ-UHFFFAOYSA-N 425.605 2.157 10 20 IECD O=C(NC[C@H]1COC2(CCOCC2)O1)C(=O)N(Cc1ccccc1O)C1CCCCC1 806718613 WZEAAOFFHOEVOR-IBGZPJMESA-N 432.517 2.092 10 20 IECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292046 SXXXYJDGKQSGGR-LJQANCHMSA-N 433.556 2.416 10 20 IECD CN(CC(=O)NCc1ccc(N2CCCC2=O)cc1)Cc1ccc(N2CCOCC2)cc1 917020467 OSTXKEBCCBLNNZ-UHFFFAOYSA-N 436.556 2.398 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 918007809 ZVLXRYFDLYTFAA-UHFFFAOYSA-N 438.594 2.121 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 918463530 KGNJCJBDLNLCIP-MRXNPFEDSA-N 442.491 2.181 10 20 IECD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2=O 919969941 JTARIWUAFWXPHL-MZNJEOGPSA-N 442.560 2.012 10 20 IECD Cc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1781723482 PHGZMENQJZSALB-OAQYLSRUSA-N 431.876 2.212 10 20 IECD CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1796749109 MGGXNYNBQFXUOD-IYWMVGAKSA-N 430.549 2.363 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccccc1O 1805197390 RFWPLNDVGVMUFF-BTYIYWSLSA-N 434.452 2.227 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2nccc2c1 1819209183 NHAKXRJAMKAXCX-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(c1cc(Cl)ncn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428304 NUMWSHLOCHAESO-MRXNPFEDSA-N 445.907 2.483 10 20 IECD CC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199179 OWKNGDYQVRMQAH-FAFAAHBOSA-N 445.497 2.255 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832883438 ZEKSZBICVYJZLJ-QGZVFWFLSA-N 447.532 2.315 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccc3c[nH]nc23)C1 1843270409 SHSBUBMPHIFKAA-UHFFFAOYSA-N 442.479 2.173 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(O)c(F)c2)C1 1845351976 IDGYMOVFJFNYLS-QPJJXVBHSA-N 428.416 2.179 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1 727359598 VEFOMWRPAYMBFE-UHFFFAOYSA-N 441.557 2.477 10 20 IECD CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 730121196 JTRIAGBJBDXGRU-ZWKOTPCHSA-N 445.564 2.197 10 20 IECD C[C@@H](OC(=O)CCCS(C)(=O)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 731257373 BZXNDZUONPAYTB-CYBMUJFWSA-N 443.477 2.157 10 20 IECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1N1CCOC1=O 743888793 FDSPINRTROWKHW-UHFFFAOYSA-N 426.473 2.315 10 20 IECD O=C(NCCNS(=O)(=O)c1cccs1)N(Cc1ccccc1O)C[C@H]1CCCO1 747438469 WIVLENYWBFSCHZ-MRXNPFEDSA-N 439.559 2.123 10 20 IECD COc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1N1CCOC1=O 749730396 OKWMWYXQKGUKTO-UHFFFAOYSA-N 436.515 2.345 10 20 IECD Cn1cc(N2CCN(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)CC2=O)cn1 750638574 QTNMDAVMIFAMCG-UHFFFAOYSA-N 448.474 2.049 10 20 IECD CN(C)c1ccc(CNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1F 750733684 NVZNMWHGBTZTOR-UHFFFAOYSA-N 437.522 2.418 10 20 IECD COC(=O)[C@@H]1COCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 752346961 MKRHLCGYJCDHQQ-LFGHMXSPSA-N 440.568 2.130 10 20 IECD C[C@H](c1ccccc1)[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759563714 VDFUJQYMQIRSTE-OSPHWJPCSA-N 444.503 2.376 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 760540310 MTMPGAANSTWIKD-UHFFFAOYSA-N 438.571 2.390 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cc(Cl)ccc3O)CC2)c1 768212548 LHMSIXJDNDUQKP-UHFFFAOYSA-N 430.935 2.400 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)c1 772627756 XKLCGEBLUQAUQO-GFCCVEGCSA-N 427.548 2.418 10 20 IECD CC(C)Oc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 773291033 FHILZGWIXWOJRM-UHFFFAOYSA-N 438.571 2.187 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)c1O 774819491 NLUFLBPIMSGMEI-UHFFFAOYSA-N 447.513 2.304 10 20 IECD CCOC(=O)C1=C(COC(=O)c2cccc(O)c2O)NC(=O)N[C@@H]1c1ccc(OC)cc1 776282762 XROXKQXBZSJEIN-GOSISDBHSA-N 442.424 2.135 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(NC(C)=O)cc3)CC2)cc1 778225413 XPQVCJRYXJNIOL-QXMHVHEDSA-N 436.512 2.175 10 20 IECD Cn1cc([C@@H](CO)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 778401654 DKAPGLUIKRYRBF-QVTJDRNWSA-N 436.584 2.313 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccccc3-c3ccno3)c2)CC1 782253278 YQYZXPLGCWTOAS-UHFFFAOYSA-N 433.511 2.377 10 20 IECD Cc1cc(C(=O)NCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 782592675 LANCXPGEGZEUJM-MRXNPFEDSA-N 426.473 2.347 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)cc1 785428032 JGBYWPVMPPXZJR-OAQYLSRUSA-N 444.963 2.212 10 20 IECD Cc1nc(Cn2nnc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c2C)no1 787268935 AOIYSDXPTGXQAT-IBGZPJMESA-N 439.520 2.214 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCN(C4CCCC4)CC3)cc2F)C[C@H](C)O1 789823404 DNKUZLBCLWROHO-ROUUACIJSA-N 446.567 2.142 10 20 IECD CC[C@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 792210617 OOCDLHYVSDTTCR-MAUKXSAKSA-N 440.548 2.119 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1F 804852499 JDFKYKIJKCVEAJ-SFHVURJKSA-N 444.482 2.349 10 20 IECD COc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 807099464 WNPQUXGCZBTBJJ-UHFFFAOYSA-N 426.561 2.276 10 20 IECD CO[C@H](C)c1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 809331698 JLYWAWUSDVTILK-RHSMWYFYSA-N 433.530 2.380 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ncn(C(C)(C)C)n3)cc2F)C[C@H](C)O1 812694130 SBZXIMKFXXWRSV-GJZGRUSLSA-N 447.511 2.259 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)CC2)cc1 917821377 CZQXPJWRKIIVIQ-XMMPIXPASA-N 436.512 2.201 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1 918307301 RZMWHQIAXQMLPP-UHFFFAOYSA-N 433.512 2.345 10 20 IECD Cc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1-c1ccc(O)nn1 918632942 FMHMXHBRFPREGP-OKILXGFUSA-N 440.479 2.359 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 1318142098 YDROPIJOZQYBLN-ZIFCJYIRSA-N 446.567 2.046 10 20 IECD COc1cnc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)cn1 1788426793 SMQWNFQVICPJKI-UHFFFAOYSA-N 435.440 2.353 10 20 IECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(C(F)(F)F)o1 1796854323 LSGJPGFVDDUPLY-ZSBIGDGJSA-N 440.378 2.374 10 20 IECD Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cc(O)n1 1810543818 OILAYRRBSTVWFF-UHFFFAOYSA-N 426.473 2.060 10 20 IECD O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C1CC1 1824125375 DRHWIYGZCVUPLR-KOEDOTQGSA-N 442.512 2.415 10 20 IECD O=C([C@H]1CC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902062 IRTKZEBBQJAOJA-KGLIPLIRSA-N 445.557 2.122 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccccc3F)CC2)CC1)c1cc(O)nc(O)c1 1834988663 ASZQLTXWOCEQFG-UHFFFAOYSA-N 442.491 2.131 10 20 IECD Cc1ccncc1CCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441355 MEUPXNQTHOEBRR-UHFFFAOYSA-N 445.523 2.319 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O 431149207 JZHWCVUTTLXFPB-UHFFFAOYSA-N 443.525 2.358 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 732984095 SBEQDGUQLUTRTF-LJQANCHMSA-N 430.593 2.218 10 20 IECD CCc1nc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccccc1 735467368 VESCEYUXWCSACZ-UHFFFAOYSA-N 434.544 2.390 10 20 IECD CC(C)Cn1c(N)c(C(=O)CN(C)Cc2ccc(N3CCCCC3)cc2)c(=O)n(C)c1=O 741711405 LJLDQGZVDSFPKE-UHFFFAOYSA-N 441.576 2.090 10 20 IECD COc1ccc(N2CCCN([C@@H]3CC(=O)N(Cc4ccc(C(=O)O)cc4)C3=O)CC2)cc1 742266548 LKUPKQYNTUUUAG-OAQYLSRUSA-N 437.496 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3csc([C@@H](C)OC)n3)CC2)cc1 747850472 DAEFZJHWTPOYQI-MHTXLSKPSA-N 437.587 2.457 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc1 748460141 KJQFYVCDZHMNQP-UHFFFAOYSA-N 438.576 2.466 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](C2OCCO2)C1 751060223 HNGCDWOGJYKYFK-ZDUSSCGKSA-N 438.527 2.480 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccco3)C[C@H]3CCCO3)CC2)cc1 754019766 WOJAKEOFLHMHNB-ZJSXRUAMSA-N 429.561 2.452 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCC([C@@]4(C)NC(=O)NC4=O)CC3)cc2)CC1 754376610 VNWHHCBSUFRVHJ-HSZRJFAPSA-N 427.549 2.443 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(OC)c(OC)c(OC)c3)CC2)cc1 758229405 GENPOMBIBHGAEA-GOSISDBHSA-N 432.517 2.283 10 20 IECD COc1cc(N2CCN(C(=O)CCc3nc(CSC)no3)CC2)cc(OC)c1OC 759241530 YGXICTXGWKYHKU-UHFFFAOYSA-N 436.534 2.240 10 20 IECD O=C(O)[C@@H]1CC(=O)N(c2ccc(S(=O)(=O)NCCCSc3nccs3)cc2)C1 761297179 OSLHPDVBUVDTFA-GFCCVEGCSA-N 441.556 2.041 10 20 IECD Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1S(N)(=O)=O 761984128 XAXHEPIHRXPSIU-KRWDZBQOSA-N 437.949 2.396 10 20 IECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2cccc(Br)c2O)cn1 765930171 JIPOXVRZCDMPLH-UHFFFAOYSA-N 430.262 2.205 10 20 IECD Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)cc1 768443982 KKVDHRXVBFZYDY-HRAATJIYSA-N 432.542 2.317 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1ccc(F)c(F)c1 769616169 MSYIPCQMNZTLRL-UHFFFAOYSA-N 426.803 2.255 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCSC[C@@H]3c3nccs3)CC2)cc1 770710911 NLKPJHRZNQJJND-UYAOXDASSA-N 434.631 2.425 10 20 IECD CCNC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 772905163 VOSOROFYDORUCI-UHFFFAOYSA-N 428.508 2.449 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCO[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776422330 YTNVBBHCYSYOPM-ZBFHGGJFSA-N 434.514 2.283 10 20 IECD O=C(c1ccccc1)c1ccc(O)c(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)c1O 788388140 PPJHZZJIAGFJQB-QGZVFWFLSA-N 430.526 2.329 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 788966519 VMWUATHRCIPYHA-XQBPLPMBSA-N 430.593 2.249 10 20 IECD COC[C@@H](Cc1ccccc1)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 789456206 OHODQZJWBGDWQL-OAQYLSRUSA-N 429.536 2.468 10 20 IECD Cc1csc([C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C2CC2)n1 789843022 HDYAJHHAORMGJZ-LJQANCHMSA-N 446.548 2.435 10 20 IECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)CC2 789860679 MYJFGBYKIOTQOP-IBGZPJMESA-N 441.601 2.307 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CS[C@@H]1CCS(=O)(=O)C1 791247316 DUMALFAUDIFSID-QGZVFWFLSA-N 442.603 2.295 10 20 IECD NC(=O)c1cc(Br)cc(S(=O)(=O)NCCCSc2nccs2)c1 799771322 CUNAKXPBNJXMSA-UHFFFAOYSA-N 436.378 2.465 10 20 IECD C[C@H](Sc1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(N)=O 800854010 IIAUHWRZNYAYNB-RDJZCZTQSA-N 440.569 2.284 10 20 IECD CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCN(C2CC2)C1 803448478 RXKDBAFSVXRPNR-GOSISDBHSA-N 436.503 2.068 10 20 IECD COc1ccc(OC(F)F)c(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803663934 AZFXNYJUSFKCBU-UHFFFAOYSA-N 425.407 2.434 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687078 TWFNYNMCOWLKFY-FXAWDEMLSA-N 428.577 2.229 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)CC2)cc1 804317571 IACFZWPTQJRKSI-NJDAHSKKSA-N 427.545 2.244 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)Oc3ccccc3F)CC2)cc1 807636112 XKUHXZCNJDPYPB-QGZVFWFLSA-N 429.492 2.457 10 20 IECD CS(=O)(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(Cl)cc(Cl)c1O 808090296 XWSUCKCNVNJVEY-UHFFFAOYSA-N 425.315 2.362 10 20 IECD Cc1cnc(S(C)(=O)=O)nc1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 813398963 GPHCWNKWLWPBKL-UHFFFAOYSA-N 430.452 2.459 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 918010787 UVXPHYCYHZNWQA-UHFFFAOYSA-N 446.573 2.367 10 20 IECD CCNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918122065 KAHOUPMQUSGBCQ-FQEVSTJZSA-N 437.544 2.137 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H](O)c1ccco1 919784259 NIBVTJPFWRKFGH-IBGZPJMESA-N 440.479 2.068 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)c1 919810945 YQXQJGPWWGBOMP-INIZCTEOSA-N 448.501 2.317 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@](CC)(c2ccccc2)C1=O)c1ccc(OC)c(OC)c1 921062519 ZVSXICVAACKKBB-HSZRJFAPSA-N 440.500 2.419 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 921304804 XDWCFMHBRKIGMA-DYXWJJEUSA-N 432.590 2.207 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OC)c(Br)n1 1255149285 UFDLUNJSEOPHAL-LBPRGKRZSA-N 439.262 2.168 10 20 IECD CC1=CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CC1 1777848000 GVPRTZPNGOCGQB-PRCFCKQXSA-N 429.517 2.367 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnc(O)[nH]2)CCO3)cc1 1781753005 FDIQZGFMHMZWPP-DEOSSOPVSA-N 449.511 2.280 10 20 IECD CC1=CC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785505420 HLPWXOLMQYSPSO-QEAUFWJJSA-N 442.512 2.393 10 20 IECD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1832235947 JUBIYMUWKFRAAO-MAUKXSAKSA-N 427.505 2.184 10 20 IECD CSCC(C)(C)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1841642561 HGUBHDUUZWSPIC-UHFFFAOYSA-N 428.558 2.372 10 20 IECD CC(C)[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S)c1ccccc1 1847615444 GTBZMTBLCSQUNF-ZWOKBUDYSA-N 445.610 2.488 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 437012073 YOEKIGOJPMGDFW-GOSISDBHSA-N 445.541 2.249 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC(n4cnc(C(N)=O)c4N)CC3)ccc21 549712847 HJLZTVGOICALPD-UHFFFAOYSA-N 438.532 2.259 10 20 IECD Cc1ccc(C(=O)NCCC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c(O)c1 726207524 OIHMBDGBDNYTEH-UHFFFAOYSA-N 427.501 2.088 10 20 IECD Cn1nccc1S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 727353864 ZJVVUJIEOQRDOJ-UHFFFAOYSA-N 428.442 2.300 10 20 IECD COC(=O)[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 728539803 QRJFBLGAQWGQPM-LFGHMXSPSA-N 440.568 2.130 10 20 IECD COC(=O)COc1cccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 734532744 YCUCQNIUWDEELG-UHFFFAOYSA-N 427.501 2.417 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@H]3CCC[C@H]3O)CC2)c([N+](=O)[O-])c1Br 742254941 KNUPIEXLJHCSRX-GXFFZTMASA-N 445.270 2.310 10 20 IECD COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227031 ALSOORLPCMUDLJ-UHFFFAOYSA-N 436.505 2.193 10 20 IECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 753457007 KSPLEYZFJPDNJL-ROTAYESASA-N 445.589 2.396 10 20 IECD Cc1nc([C@H]2CCCN(CC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C2)n[nH]1 760960122 NCAFWGCFNDTCQC-FCEWJHQRSA-N 444.555 2.362 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 764707807 JWHPFXYNIRTEJL-QGZVFWFLSA-N 431.505 2.475 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCSC[C@H]3c3nccs3)CC2)cc1 770710909 NLKPJHRZNQJJND-QUCCMNQESA-N 434.631 2.425 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc5c(nc4O)CCC5)n3)CC2)cc1 771069433 VEVIDAAZBWTJLX-UHFFFAOYSA-N 435.484 2.226 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 772996189 CETHYTINJQKBRN-KDOFPFPSSA-N 433.578 2.371 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(Cl)n1 774146496 PIFQLPUVPBWXDQ-UHFFFAOYSA-N 432.908 2.207 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccccc1-n1cc(Br)cn1 774364196 SXORWSBQYUXMAZ-UHFFFAOYSA-N 445.273 2.343 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCCN2CCCCC2)cc1 774364402 ZNGQPSPTWRAKTF-UHFFFAOYSA-N 427.501 2.260 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1F 782911152 QWJWTOUPEHXBKK-UHFFFAOYSA-N 428.507 2.178 10 20 IECD Cc1nn(C(C)(C)C)c(=O)n1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 783911867 RIKMNTUVUVDMIY-HUUCEWRRSA-N 433.528 2.177 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CSCCN2Cc2ccccc2)cc1 785438214 ANXUDBOPVZZGRH-NRFANRHFSA-N 426.586 2.103 10 20 IECD Cc1ccc(O[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 788412593 KICMAOJFNZZMKP-LJQANCHMSA-N 425.529 2.374 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](O)Cc4ccccc43)cc2F)C[C@@H](C)O1 789352028 CYTZTDOQKOHBFZ-HLIPFELVSA-N 427.520 2.479 10 20 IECD CCc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789833769 JUXUKKSQUUQPNO-UHFFFAOYSA-N 427.520 2.324 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1C[C@H]2CC[C@H]1C2 789835052 NSZQZWJNXOXGHN-ZJBJCVSYSA-N 447.551 2.067 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CN3CCc4ccccc4C3=O)CC2)cc1 789874754 IHLFVDSUPLZAKH-UHFFFAOYSA-N 436.556 2.022 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)cc1 791021803 RGHQEGAGBAMWHC-ZHACJKMWSA-N 438.484 2.433 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC[C@@H]3N3CCOCC3)cc2)CC1 805025414 PACGTKXVRROPED-PKTZIBPZSA-N 442.604 2.299 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cn(C)nc3-c3ccccc3)CC2)cc1 806773954 GUDSXXWHWHSNKZ-UHFFFAOYSA-N 447.539 2.451 10 20 IECD CSCC[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856136 NYJJWIYUKBMRRB-GOSISDBHSA-N 432.634 2.435 10 20 IECD CCc1c(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1C 919174236 GLUXOCQCYOQAOE-HUUCEWRRSA-N 432.496 2.208 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n(C)c1 920880455 ALCRDWBCNVMUGG-KRWDZBQOSA-N 448.589 2.383 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccc(N4CCNC4=O)c3)cc2F)CC1 1318303973 YACBMSJZZRYYFC-UHFFFAOYSA-N 425.508 2.427 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2cccn2)c(F)c1 1328430509 HCMHYOHDGFXICY-UHFFFAOYSA-N 428.489 2.176 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1 1814165209 CQUDTPJTMGOMJV-LCGKOWBWSA-N 441.459 2.420 10 20 IECD CC[C@H](NC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815315925 HPQYUQBEBAQMMO-JQWIXIFHSA-N 438.937 2.432 10 20 IECD O=C(CN1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425863 BJPLAQVTEFEOSL-IBGZPJMESA-N 430.549 2.212 10 20 IECD O=C(c1ccnc2c1OCO2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501709 SXRSVOATCKLPNA-UHFFFAOYSA-N 431.832 2.006 10 20 IECD O=C(CSc1ccncc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034067 ZTKIYVAZPHCYIA-HWKANZROSA-N 441.509 2.207 10 20 IECD C[C@H](OC(=O)C1(C(=O)NC2CC2)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729714024 ZGPYOKLWQJGJGE-ZDUSSCGKSA-N 446.459 2.391 10 20 IECD CCN(C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1)S(C)(=O)=O 731361461 KCOVMZMNFWYVJZ-QGZVFWFLSA-N 438.594 2.040 10 20 IECD CC1CCN(c2ccc(CNC(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)cc2)CC1 737009693 WKKHJFUWXHSXJD-UHFFFAOYSA-N 440.548 2.300 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743287270 XXPIZAXZLNGSSK-UHFFFAOYSA-N 446.573 2.433 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccccc3SCC(N)=O)CC2)cc1 743294532 NAYLEGHRCHLAAO-UHFFFAOYSA-N 443.573 2.216 10 20 IECD Cc1ccc(-n2[nH]c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2=O)cc1 746148349 WKBYYSDLIYAYHP-SFHVURJKSA-N 433.512 2.106 10 20 IECD COC(=O)N1CCC[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060014 FMIFVIQTLUSUIL-CYBMUJFWSA-N 439.515 2.215 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4cccc(F)c4F)CC3)CC2)cc1 754044821 ZQZZHEZOYSWKOG-HXUWFJFHSA-N 446.542 2.279 10 20 IECD CC(=O)N1CCCC[C@H]1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756244583 QAMIUTCPEKMEIJ-FQEVSTJZSA-N 434.448 2.345 10 20 IECD COc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(OC)c1 756755703 FABKKJFNLCZVKM-UHFFFAOYSA-N 437.500 2.270 10 20 IECD COc1cc(N2CCN(Cn3nc(-c4ccc(F)cc4)oc3=O)CC2)cc(OC)c1OC 758962824 CALYXEQVOAQFDJ-UHFFFAOYSA-N 444.463 2.448 10 20 IECD Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 760094276 IZEWXRWXFSTSEW-JOCHJYFZSA-N 440.519 2.478 10 20 IECD Cn1ccnc1[C@@H](O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 771962579 JELHIIJWYOZNHP-FQEVSTJZSA-N 431.512 2.051 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 775043209 ORHCPCIMKINYST-OAQYLSRUSA-N 438.597 2.247 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 776038074 CNASKCGURPHNML-UHFFFAOYSA-N 426.492 2.034 10 20 IECD COc1ccc(O)c(CNC2CCN(S(=O)(=O)c3ccc(OC)c(OC)c3)CC2)c1 776208358 ZUEFDYUBQSBJDZ-UHFFFAOYSA-N 436.530 2.361 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc([N+](=O)[O-])c2nsnc2c1 778245809 HPOHAKBXPDBHGQ-UHFFFAOYSA-N 433.471 2.087 10 20 IECD O=C(COc1cccc2cccnc12)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 780897196 NUPNSNDCOVLPSH-UHFFFAOYSA-N 425.510 2.165 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(N4CCNC4=O)ccc3F)c2)CC1 781270443 LDBCUTTUMQYGRI-UHFFFAOYSA-N 425.464 2.276 10 20 IECD COc1cccc2c1CC[C@H]2NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800840 QIGPVCWKOFKCOB-LJQANCHMSA-N 427.476 2.091 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1)c1ccc(N2CCOCC2)cc1 803303171 ISJBHAZIFCFVPC-IRFCIJBXSA-N 442.604 2.470 10 20 IECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449090 NYSBCYVMJOTRIY-ROUUACIJSA-N 425.476 2.447 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1 807096781 ISQXLPWUQIOWBZ-UHFFFAOYSA-N 440.519 2.191 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C 807246653 NQBWJBVCICPENR-PZJWPPBQSA-N 431.577 2.439 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@H]3[C@@H]3CCCO3)CC2)cc(OC)c1OC 811764086 NZNGIHCOTWTGDS-LAUBAEHRSA-N 433.549 2.208 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 815152933 AYHZFSYOKBJBCR-PCCBWWKXSA-N 425.529 2.211 10 20 IECD CCN1CCN(c2ccc(CNc3ccc(S(N)(=O)=O)c([N+](=O)[O-])c3)cc2F)CC1 864008220 SKNKVWAJRICMKU-UHFFFAOYSA-N 437.497 2.135 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C[C@H]2O 918224644 SBFQIHCSDUZIJL-LJQANCHMSA-N 445.491 2.438 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C 918439925 YESWNLHOPOZKOR-UHFFFAOYSA-N 426.542 2.163 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC(F)F)cc3)cc2)C1 918463650 MRKSYLBOPMQRBG-HNNXBMFYSA-N 446.454 2.245 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)C(C)C)cc1 1337825799 DCXIHSXDQVIFCH-KRWDZBQOSA-N 435.498 2.184 10 20 IECD O=C(O)CSCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429614 ORVOENWUNYXHAF-UHFFFAOYSA-N 431.470 2.058 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc2ccoc2c1 1790395924 YCVYPIVGLBOWNA-IEZWGBDMSA-N 437.452 2.146 10 20 IECD COC(OC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815035582 RLHWPNQGYYWZAF-ZDUSSCGKSA-N 438.868 2.399 10 20 IECD C[C@@H](Oc1cccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846628247 OQGSRGMICJFSHN-CYBMUJFWSA-N 431.876 2.431 10 20 IECD CCOc1ccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 727978778 AGLVXBQATWDHLK-UHFFFAOYSA-N 449.602 2.335 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c1 737208460 XYJUHYXLIZZCIW-UHFFFAOYSA-N 426.517 2.186 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739768955 XUQXAFRUTKZIEC-UHFFFAOYSA-N 445.541 2.061 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c[nH]1 742280640 VGEHTDNOGRHKHR-UHFFFAOYSA-N 447.435 2.135 10 20 IECD COCCN(CC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O)c1ccc(OC)c(OC)c1 746478268 QCNFVSXXSWAOFU-UHFFFAOYSA-N 427.457 2.021 10 20 IECD Cc1ccc(C(=O)NC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)s1 747900405 ZEWJXNHNTPDIJO-UHFFFAOYSA-N 437.543 2.168 10 20 IECD COc1cc(N2CCN(C(=O)C[C@H]3C(=O)Nc4ccccc43)CC2)cc(OC)c1OC 759220897 JXNFBSNJQAXTKQ-QGZVFWFLSA-N 425.485 2.487 10 20 IECD CCC(=O)N[C@H](CCSC)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760084202 LTNSBLAIRAMVCH-MRXNPFEDSA-N 439.578 2.009 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OCC)n(C)c2)cc1 760511757 IPQVHLFGAYBQSR-UHFFFAOYSA-N 429.520 2.154 10 20 IECD CCN(CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)CC1CC1 764248671 ORGHMWOMJGGWOK-VCHYOVAHSA-N 447.582 2.465 10 20 IECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 767031052 HJEGNTYEKNPVBQ-UHFFFAOYSA-N 435.571 2.126 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(CC(=O)NCc3cccc(Cl)c3)no2)c1 771606770 BHVJTZBBMQCICW-UHFFFAOYSA-N 436.877 2.326 10 20 IECD NC(=O)[C@H]1CCCN1Cc1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771901594 GMQNPLUTOWVVLU-GOSISDBHSA-N 442.903 2.464 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC2CCN(c3ccc(OC)cc3)CC2)c1 772961508 VNWDMSCTTOYDAO-INIZCTEOSA-N 446.573 2.189 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(I)cn1 773376105 RYVUJRHTOJBIQJ-UHFFFAOYSA-N 448.311 2.380 10 20 IECD C[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774538235 OISMFOZHWPBMLV-GHTZIAJQSA-N 436.556 2.142 10 20 IECD Cc1ccc2cccnc2c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 777931728 WNQHHHAEJKEWCY-UHFFFAOYSA-N 435.483 2.414 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 778235401 PZQYIZSJYHKFMR-SIKLNZKXSA-N 448.608 2.025 10 20 IECD Cc1cc(C(=O)NCCCN2CCNC(=O)C2)c(C)n1-c1ccccc1Br 778940572 YJCJDPKOLMSPLD-UHFFFAOYSA-N 433.350 2.408 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 785390014 QFRAQVPPBXCNPR-CTNGQTDRSA-N 436.556 2.315 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cc(F)ccc1N1CCC(O)CC1 785438950 IPDCGYQRMHFPSS-MRXNPFEDSA-N 442.535 2.346 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1 785648166 NYBIQRMRRGHABP-NRFANRHFSA-N 442.560 2.192 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1 788966518 VMWUATHRCIPYHA-WOIUINJBSA-N 430.593 2.249 10 20 IECD CC(C)N[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789828775 YLITVNXDSNMEQP-SCTDSRPQSA-N 434.556 2.045 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCCO1 789953888 GMWHTWFRCVXRGM-ROUUACIJSA-N 443.466 2.232 10 20 IECD CCN1C[C@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)Oc2ccccc21 803660987 LPOGJJMQONWSLF-KRWDZBQOSA-N 428.508 2.254 10 20 IECD CN(C)CCCOc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803687549 FZWLGLSFHSCFBD-UHFFFAOYSA-N 438.572 2.332 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2COC(=O)NC2CCCCC2)c1 804878269 UAWFURAQQSQIAJ-MRXNPFEDSA-N 439.534 2.427 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 807097497 OYVINCFHYRSXNB-LPHOPBHVSA-N 432.565 2.439 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccs1)N1CCN(C)CC1)c1ccc(N(C)C)cc1 807670538 GGUNYALPYLJPQI-YLJYHZDGSA-N 443.617 2.096 10 20 IECD CCNC(=O)NCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 817253776 HLQJYEMFWHNWKL-QBFSEMIESA-N 426.589 2.165 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nc4nc(C)c(C)c(C)n4n3)CC2)cc1 915671988 JWIWCZNAMFVHHD-UHFFFAOYSA-N 426.546 2.499 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)nc1)c1ccc(N2CCOCC2)cc1 920866793 JOOFVOJAMILTBO-SFHVURJKSA-N 425.533 2.315 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CCc3ccccn3)C2=O)cc1OCC(N)=O 1318154908 YNEUCJLVOBAKAX-GZTJUZNOSA-N 429.523 2.398 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=CCCC1)C2 1783220145 SHBHHEGPYZTYAQ-IDRMFCSBSA-N 442.512 2.441 10 20 IECD CC/C=C(\C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813707760 CUEUBOVXVUJZLJ-SGFSRBQDSA-N 446.598 2.304 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)C2(c3ccccc3)CCC2)C1 1846311016 ZATLLZOGHYLOFI-UHFFFAOYSA-N 443.594 2.172 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C(=O)c2c(F)cccc2F)CC1 727940663 RFDNIDVEVRADID-UHFFFAOYSA-N 444.482 2.469 10 20 IECD CSCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 737246113 UDGPSNJSMAUWHN-UHFFFAOYSA-N 447.582 2.039 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCOc3ccccc3[N+](=O)[O-])CC2)cc1 742919464 JAEHYTJQJASWBL-UHFFFAOYSA-N 428.489 2.311 10 20 IECD COc1ccc(N2CCN(C(=O)CC[S@](=O)c3ccc4c(c3)OCCO4)CC2)cc1 746094284 WDIHAETVVIUZJR-PMERELPUSA-N 430.526 2.313 10 20 IECD COCCN(CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1ccc(OC)c(OC)c1 746475791 YHFVCMBOMBZFHR-UHFFFAOYSA-N 431.445 2.234 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 749553599 JBSRDDXABJFUTA-QWFCFKBJSA-N 434.556 2.303 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN(Cc4ccccc4)CC3)CC2)cc1 753997241 ABFSDGCOWSBUHQ-RUZDIDTESA-N 438.616 2.386 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(O[C@@H]4CCOC4)cc3)CC2)cc1F 754213824 WBADOEGCLFJYBN-LJQANCHMSA-N 443.475 2.289 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(C(=O)N4CCCC4)cc3)CC2)cc1 758229658 FJQMOFNULRSMHD-JOCHJYFZSA-N 439.556 2.493 10 20 IECD C[C@@H](CC(=O)Nc1cccnc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980406 ZQNCDQYUWGKMED-HNNXBMFYSA-N 436.965 2.477 10 20 IECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771055382 CAXSKYUMCGFXOJ-HNNXBMFYSA-N 440.953 2.018 10 20 IECD CC1CCN(c2ccc(CNC(=O)NCCNS(=O)(=O)c3cccnc3)cc2)CC1 773000713 IGDBVFJOFUTDBS-UHFFFAOYSA-N 431.562 2.096 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3cccc(Cl)c3)CC2)cc1 774550920 CCKHSGVPJATUPW-UHFFFAOYSA-N 444.963 2.293 10 20 IECD O=C(CNC1(c2ccc3c(c2)OCO3)CC1)NCc1ccc(N2CCOCC2)c(F)c1 775553643 QLYZYBDXOQIISW-UHFFFAOYSA-N 427.476 2.286 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3ccc(C)cc3C)CC2)cc1 785531362 VCLPGWDCNWSEMN-UHFFFAOYSA-N 438.572 2.257 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 787637412 ZHMCXYSZKDPQMT-UHFFFAOYSA-N 447.486 2.150 10 20 IECD NC(=O)[C@H]1CCC[C@@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 787840520 LKWAEDVWYAVVHN-UONOGXRCSA-N 434.448 2.235 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(Cn4cccn4)cc3)CC2)cc1 788461024 QZQDHCTXIWRTAV-UHFFFAOYSA-N 447.539 2.295 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789854543 IVJTUGTWIFFGIK-HSZRJFAPSA-N 447.601 2.294 10 20 IECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)NCc1ccc(N3CCCC3)cc1)C2 790672103 KRBIDVYDYMNLBJ-UHFFFAOYSA-N 428.558 2.463 10 20 IECD CNC(=O)CSCC(=O)c1cc(C)n(-c2cc(C(=O)OC)cc(C(=O)OC)c2)c1C 799308526 MGVSKHKNNSXQTK-UHFFFAOYSA-N 432.498 2.329 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(Cl)c(-c4nn[nH]n4)c3)CC2)cc1 799764188 ZZVRAKZPJCDPCI-UHFFFAOYSA-N 448.936 2.430 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cnc(Cl)c(F)c3)CC2)cc1 804940430 CGKKEUSUZOVARP-UHFFFAOYSA-N 442.944 2.373 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccnc(SC)c3)cc2F)CC1 805007210 HLKJTNIJXMJAMV-UHFFFAOYSA-N 445.564 2.017 10 20 IECD O=C(NCc1ccn2ccnc2c1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806987375 QWXJTRQJLQHCAA-INIZCTEOSA-N 443.454 2.337 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccnn3C)C(C)C)CC2)cc1 809793861 QADDDJFOOARQIT-HXUWFJFHSA-N 427.549 2.023 10 20 IECD COc1ccc(N2CCCN(c3nnc(-c4ccc(-n5cnnn5)cc4)n3C)CC2)cc1 809865414 MPPQBZJCBATPFU-UHFFFAOYSA-N 431.504 2.183 10 20 IECD C[C@@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1CCc1ccccc1 812057008 JRSSXXFXMMAJJV-MRXNPFEDSA-N 429.546 2.473 10 20 IECD CN(C)C(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918214134 URSMVEILRVCXQZ-UHFFFAOYSA-N 428.508 2.488 10 20 IECD CSc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918463251 KDBMCJBYSKBCLA-INIZCTEOSA-N 426.542 2.365 10 20 IECD C[C@H]1CN(Cc2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@@H](C)O1 919812738 NOJPTYNIZYAQQQ-IYBDPMFKSA-N 447.557 2.303 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C4CN(C)C4)C3)C2)cc1 1784783593 AUIMGGUPJPSCIL-VWLOTQADSA-N 436.556 2.099 10 20 IECD C[C@@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789612825 NAHMFDZQFWNCFU-AWEZNQCLSA-N 436.472 2.168 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(C2CC2)cc1 1790251640 BCWSAGRRBFRDGN-IHPCNDPISA-N 437.496 2.277 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)[C@H]3C[C@H]3C3CC3)C2)CC1 1805363885 TYGLQRWNVSINPO-HOTGVXAUSA-N 435.615 2.124 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993349 IGBJNZBFHSDRBS-VGSWGCGISA-N 440.500 2.024 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1cc(O)nc(O)c1 1817843654 VDPSNKYETOMOSS-SNVBAGLBSA-N 431.346 2.422 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cn[nH]c2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146501 MKSHEMSGPFTITQ-GOSISDBHSA-N 446.471 2.232 10 20 IECD C[C@H](CC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291690 ZAMXJIZOSFVNNN-YGRLFVJLSA-N 449.895 2.292 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CC[C@H](O)CC2)n[nH]1 1822538891 MWDCHRCVBWUYPN-NOLJZWGESA-N 429.477 2.073 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1)C(=O)C1CC1 1823708318 RQSLIPXINIVVPL-SNVBAGLBSA-N 435.889 2.413 10 20 IECD C[C@@H](Nc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1844391791 GZUXYVCYVODFDM-CYBMUJFWSA-N 430.892 2.464 10 20 IECD CN(C)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500748 KEVIUJIWQBSRPT-UHFFFAOYSA-N 430.892 2.343 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1 729066848 QRFHFRHXHSFTLV-CQSZACIVSA-N 447.513 2.001 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)cc2F)CC1 734276140 VZYIYANGOMIYDD-NRFANRHFSA-N 447.599 2.410 10 20 IECD CC[C@@H]1COCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734660349 AAOAHVLTYZCZGX-GOSISDBHSA-N 428.512 2.263 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1 737134599 OHJHCADDDUZVDO-SFHVURJKSA-N 426.473 2.290 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)COc3ccc(F)cc3)CC2)cc1F 746978456 QVQWRLLYLWSLMS-UHFFFAOYSA-N 432.471 2.464 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1 754194431 ZGYZPXIOEDMSKM-AWEZNQCLSA-N 441.484 2.126 10 20 IECD CCCNC(=O)c1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754211588 HEFUPHHIOKLTCC-UHFFFAOYSA-N 442.491 2.261 10 20 IECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 759370128 OJMCPALRBOJJAE-QGZVFWFLSA-N 439.512 2.130 10 20 IECD C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1 764444895 XDGCHZRZHZXMJO-HUUCEWRRSA-N 431.505 2.333 10 20 IECD CNC(=O)Cn1nc(N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 767574897 AWXSMSOPKOJOPA-CQSZACIVSA-N 445.479 2.152 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)cc1 772775975 FUPBMENDOZDVDJ-UHFFFAOYSA-N 428.508 2.444 10 20 IECD COC(=O)c1cc(F)c(F)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772910028 MQWJWWWJFMAOLE-UHFFFAOYSA-N 437.418 2.455 10 20 IECD C[C@H](O)CN1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 779186427 PATWYACOTNJLEZ-AOHITCTBSA-N 439.628 2.255 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)nc12 785807461 OMLHGOZOSJBOLE-OXHZDVMGSA-N 429.351 2.011 10 20 IECD C[C@@H](NC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 787092375 BGIQCDLVQUXZKY-MRXNPFEDSA-N 440.519 2.490 10 20 IECD CCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 787193293 QRAQKJPJACNLQT-UHFFFAOYSA-N 442.535 2.299 10 20 IECD COCCOc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 787994502 NDKRFTMZAKJTCJ-SFHVURJKSA-N 441.528 2.042 10 20 IECD COc1ccc2nc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)sc2c1 788679492 XFLLZQUWLAOBEI-WQLSENKSSA-N 429.570 2.055 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3CCN(c4ccccc4)C3)CC2)cc1 788815565 OWGLIFQLKMVVDE-IBGZPJMESA-N 436.556 2.423 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(OC(F)F)c1 789743359 UQBQPYLEDOHEAK-UHFFFAOYSA-N 440.468 2.461 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 789822336 AEIOJOQUXOGEPR-QZTJIDSGSA-N 448.583 2.388 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(CCCO)Cc3ccccn3)cc2F)CC1 792993288 VJGLWPGGXPYEHT-UHFFFAOYSA-N 429.540 2.457 10 20 IECD COCCOC(=O)C1=S=c2nc(/C(Cl)=C/c3ccnn3C(C)C)nc(O)c2=C1C 794933033 DUWQYFXMMJFSHS-LCYFTJDESA-N 436.921 2.227 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3COC(=O)NC(C)C)CC2)cc1 796703663 CPCVEYJBDQUERD-FCHUYYIVSA-N 448.608 2.167 10 20 IECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803299504 LRMVLPBGNICWCB-IIBYNOLFSA-N 425.533 2.106 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3COc4c(F)cc(F)cc4C3)cc2)C1 812011256 YUGGLBTXKKDUAT-YJBOKZPZSA-N 444.482 2.469 10 20 IECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)N[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1=O 812278580 LYULLJJAGHTJPY-HSZRJFAPSA-N 445.564 2.463 10 20 IECD O=C(CN1CCC(CO)(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 814646377 GDGVJTPEEPWVKD-UHFFFAOYSA-N 441.547 2.305 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)cc1C 814994516 QJESONDUBNFVIH-UHFFFAOYSA-N 440.468 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCCCN3CCCC3)CC2)cc1 818336631 CODULTCJHRQIQY-QXMHVHEDSA-N 428.577 2.282 10 20 IECD COC(=O)c1ccc(CNC(=O)[C@@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 821958498 LUXGDTJXQIPQCU-GOSISDBHSA-N 425.529 2.447 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCCN1C(=O)CCC1=O 913360404 KAWFRKVAKFPYPM-ACCUITESSA-N 438.552 2.422 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCNS(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 917709425 ICECWLPKCPNHEV-IAGOWNOFSA-N 449.548 2.424 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cccnc1N1CCOCC1 918204579 LBLFVFZBKDCDBM-UHFFFAOYSA-N 439.560 2.126 10 20 IECD CNC(=O)[C@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)c1ccccc1 918992637 KCEOGLNSWMVTQX-QGZVFWFLSA-N 426.498 2.256 10 20 IECD Cc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)s1 1784431649 LUIIKOSYRYHFIS-KTBYTZPXSA-N 429.498 2.020 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccccc1O 1796932742 ZGZBXBPCGCNIRG-VBUUOAMHSA-N 432.480 2.437 10 20 IECD COC[C@H](C)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806154449 FMQXLEUPVGHOGO-YERXGYGTSA-N 432.517 2.330 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993924 RBRBPZUISBETES-ZHRRBRCNSA-N 436.468 2.433 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)nc1)CC2)c1cc(O)nc(O)c1 1816724967 FJBHOVUNYZNGCU-LLVKDONJSA-N 429.433 2.023 10 20 IECD O=C(Cn1cc(Cl)cn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817502036 KOVKELRLMFXCPY-AWEZNQCLSA-N 445.867 2.072 10 20 IECD C[C@H](NC=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740272 MEQKQQNMLZZWEJ-SUMWQHHRSA-N 437.924 2.119 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3[nH]ccc3n2)C1 1844045505 ZPGSTAAVMXILAD-UHFFFAOYSA-N 442.479 2.173 10 20 IECD Cc1cc2[nH]c(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)cc2s1 1845619765 LFKIQBDRVOXEKF-UHFFFAOYSA-N 448.595 2.215 10 20 IECD Cc1ncc(/C=C/C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1846679414 FYEBONCQGRZRAB-NSLJXJERSA-N 441.509 2.498 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)n(C)c2ccccc12 472804827 HJLMOBOWWDBGIN-UHFFFAOYSA-N 449.511 2.211 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)C(C)(C)O)c2C)c1 725935653 VMGQNTMZUJSIIK-UHFFFAOYSA-N 431.441 2.164 10 20 IECD COC(=O)C[C@@H]1CCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 728913714 GENHRBQUXRDKEF-SFHVURJKSA-N 447.557 2.342 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H](C(N)=O)c3ccc(Br)cc3)cc2)C1 729677001 WVXXNSVNBHTRMY-QFBILLFUSA-N 445.361 2.467 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N(C)[C@H]3CCS(=O)(=O)C3)c2C)cc1 729793504 QYNRCXCORLKFHQ-AEFFLSMTSA-N 448.541 2.294 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)cc2F)C[C@@H](C)O1 732572306 SNUIBUWFGNOIHZ-DVOMOZLQSA-N 446.445 2.402 10 20 IECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 734065448 BRXWYPIQBIGIPG-QMHKHESXSA-N 446.498 2.373 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 742800677 KPHLGASLEJWQIQ-CYBMUJFWSA-N 430.411 2.217 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 744380189 LSNLXIIIFAKDFW-UHFFFAOYSA-N 444.538 2.403 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1N1CCOC1=O 746789175 CSOQGYKPWVHHCI-UHFFFAOYSA-N 438.484 2.043 10 20 IECD CCOc1cc(/C=C2/SC(N3CCOCC3)=NC2=O)ccc1O[C@@H](C)C(=O)N(C)C 747147949 JKAPPZLKUCSUMR-RAOBZKRQSA-N 433.530 2.243 10 20 IECD COc1cccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 752568723 FCUXUZCHNUOHMB-HUUCEWRRSA-N 431.464 2.316 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(CNS(C)(=O)=O)o3)cc2F)C[C@@H](C)O1 753586458 XWYZQTKAERUHGW-ZIAGYGMSSA-N 439.509 2.012 10 20 IECD CC[C@@H]1CC[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)O1 757126786 ANILRDKNEFEFEY-UZLBHIALSA-N 434.514 2.425 10 20 IECD COc1cc(N2CCN(C(=O)[C@H](C(C)C)N3C[C@H](C)O[C@@H](C)C3)CC2)cc(OC)c1OC 760083195 CVWZJDMKNLUYHP-SPEDKVCISA-N 449.592 2.495 10 20 IECD Cc1ccc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)cc1N(C)C 762748184 QQWZSJTWBKNBFI-UHFFFAOYSA-N 443.550 2.396 10 20 IECD O=C(NCCS(=O)(=O)CC1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765969901 XYGLONAAKGMLBS-HNNXBMFYSA-N 431.505 2.381 10 20 IECD O=C(Cn1c(=O)nc(O)c2ccccc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771058970 OVWRBCVXYKYLCW-MRXNPFEDSA-N 442.903 2.242 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCC(=O)Nc1ccccc1Br 772771765 YVSPUAQJEIADIE-SOFGYWHQSA-N 449.257 2.172 10 20 IECD C[C@H]1C(=O)CC[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 781314741 WFLRRTFFCJWAMZ-DOTOQJQBSA-N 434.508 2.463 10 20 IECD CC(=O)NC1CCC(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 784541563 LHSRVXDRGALHRM-AMZMEHNNSA-N 448.583 2.435 10 20 IECD O=C(OCCCN1CCOCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407357 IKIROIDWKGOVQQ-UHFFFAOYSA-N 426.516 2.134 10 20 IECD COCCc1noc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 785412742 LXJBSJRJWCOXMC-UHFFFAOYSA-N 439.471 2.183 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC(Cc2cccnc2)CC1 789802378 XKNWSWPLHXCZSJ-UHFFFAOYSA-N 440.519 2.155 10 20 IECD COc1ccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c(O)c1 792844696 XKSIRRGQEDABRK-LJQANCHMSA-N 443.500 2.074 10 20 IECD Cc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 793735774 YTQPEMOPRXISDI-APWZRJJASA-N 440.544 2.043 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](CS(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 795088761 WHCOTYGPJMEKDF-KRWDZBQOSA-N 432.542 2.415 10 20 IECD Cc1cnc(COCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)o1 795478412 ZCFUKULLQOJILR-UHFFFAOYSA-N 440.479 2.072 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)CC2)cc1 797529932 KLAHCUBZCDAFQD-FQEVSTJZSA-N 436.556 2.329 10 20 IECD COc1c(C)cnc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 803304361 ATBQVYOHSVSDBA-SFHVURJKSA-N 440.544 2.379 10 20 IECD COC[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451541 OKSJIFGFIILULF-OAHLLOKOSA-N 425.476 2.258 10 20 IECD COCCCOc1cccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 803685366 FCOPIRSTMKBKCS-UHFFFAOYSA-N 425.529 2.417 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCOC[C@@H]3CCOC3)cc2Cl)C1 804931903 VQCKCXRLTPDDSI-FUHWJXTLSA-N 437.968 2.362 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)C2CC2)cc1 806088247 PMOVQASILKVUHN-VXKWHMMOSA-N 428.577 2.003 10 20 IECD CCOc1cccc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 807671958 VPLHQNKCCFMPJR-QGZVFWFLSA-N 425.533 2.072 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807675069 UHNWINAUIMIGCS-PGRDOPGGSA-N 436.556 2.280 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 807678257 VWGWQLRHAVDELY-HNAYVOBHSA-N 441.507 2.492 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 807828718 BYNMYSRKHKUQQB-QGZVFWFLSA-N 432.565 2.473 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 810112552 XZUZGNXWNZRXDH-SOUVJXGZSA-N 440.521 2.296 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc(C4CC4)n(C)n3)cc2F)C[C@@H](C)O1 810349423 DUKCYSILMWKHRX-ZIAGYGMSSA-N 429.496 2.305 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1C 815401603 FMVIWIJJVFXIOI-UHFFFAOYSA-N 446.415 2.383 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3nc(O)oc3c2)cc1OC 917759274 LIFAWEQTPTWCRL-UHFFFAOYSA-N 427.460 2.104 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 918443814 HIQATQNRIMPUEP-UHFFFAOYSA-N 431.514 2.164 10 20 IECD C[C@@H](NC=O)C(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1790499782 KDMVXCWNMIXCFI-MRXNPFEDSA-N 447.495 2.048 10 20 IECD Cc1cc(/C=C/C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1810385665 JELKYTYWCUBXMQ-MQGGFDMLSA-N 449.467 2.217 10 20 IECD CC(C)(C)OC(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815457522 QUFPXXMYSBTGOM-AWEZNQCLSA-N 445.476 2.254 10 20 IECD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)ccn1 1819783236 SKMVXRRMICDIRW-HNNXBMFYSA-N 438.444 2.239 10 20 IECD NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831407487 OCXMCODXYLXZPV-INIZCTEOSA-N 437.924 2.250 10 20 IECD C/C(=C\c1cccs1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847050839 JPUCRDMDCNRMEH-MDWZMJQESA-N 435.596 2.215 10 20 IECD CC1CCN(S(=O)(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)CC1 13949075 CZRCVIQTXJIYKH-UHFFFAOYSA-N 436.515 2.444 10 20 IECD Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c(O)c1O 110004307 FTSWZBWPUSHDGK-ZDUSSCGKSA-N 436.486 2.277 10 20 IECD COc1ccc(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC(F)F 725901467 NARNESMWMHEMJZ-UHFFFAOYSA-N 430.429 2.346 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCN(c2ccccc2Cl)C1=O 732293379 HRXPJEFIOAULQI-MRXNPFEDSA-N 437.905 2.295 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)c1 733047132 FVDDFOKOWJAZBF-CYBMUJFWSA-N 425.441 2.179 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@](C)(O)c3ccccc3)CC2)cc1 734064934 PCUAWTUWGBGYRH-XMMPIXPASA-N 426.561 2.414 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 734702304 VUBLHVQTLZXWMY-UHFFFAOYSA-N 446.573 2.346 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1S(=O)(=O)N(C)C 743957839 CPPIZUMGNOBCLH-UHFFFAOYSA-N 445.541 2.085 10 20 IECD CCOC(=O)COc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958439 XJJUPLJCQGUJQC-UHFFFAOYSA-N 426.469 2.468 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](CN(C)CC4CC4)C3)CC2)cc1 746414833 UXGXJHCWWUFQKH-OAQYLSRUSA-N 429.609 2.191 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 747249422 BRHOOCGOXZCMJZ-UHFFFAOYSA-N 434.514 2.391 10 20 IECD CS(=O)(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 753418895 PYKHIGBAHCGXGO-HNNXBMFYSA-N 429.502 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)CC[S@](=O)c3ccc4c(c3)OCCO4)CC2)cc1F 753739466 STRZRBGDHZMMJJ-HKBQPEDESA-N 448.516 2.452 10 20 IECD CN(C1CCCC1)C(C)(C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 754880621 YHIKNHUXIOZRKV-UHFFFAOYSA-N 435.540 2.475 10 20 IECD COc1ccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1OC 771033746 BDOXYQNBLKGURF-UHFFFAOYSA-N 448.457 2.012 10 20 IECD C[C@H](NC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 772999176 ZOOYEHQKGJZSQL-YOEHRIQHSA-N 428.455 2.437 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 774147167 SOOPNANFIMGGEN-HKBQPEDESA-N 447.532 2.027 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)c1ccccn1 775075723 QJHAEUKGQGXVRK-HSZRJFAPSA-N 430.508 2.440 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@](C)(O)c3cc(C)oc3C)CC2)cc1 778296892 DSCGBWOCFQUBAX-HBRDYDSTSA-N 441.528 2.134 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)N(C(C)=O)CC4)c2)CC1 780407839 PWTUNHIWSLCXKJ-UHFFFAOYSA-N 442.541 2.065 10 20 IECD CCO[C@@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 780417897 YTTTUPVIRRIHFQ-OFNKIYASSA-N 436.572 2.333 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 785303554 KPMFUNVYFWGONA-AWEZNQCLSA-N 425.485 2.456 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCCCC1 787687702 HSMMQARKMUNXHP-UHFFFAOYSA-N 448.583 2.174 10 20 IECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818375 JNTUEZLYUUFDQW-WSTZPKSXSA-N 448.583 2.436 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 795072463 FDZRHFHFIUXYKE-UHFFFAOYSA-N 426.441 2.067 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOc4cccc(F)c4C3)CC2)cc1 801475058 FTSDBHJOVPMWFU-KTKRTIGZSA-N 439.487 2.460 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3ncc4n3CCCC4)C2)cc1F 803663803 BBWXAENUXZCHCO-KRWDZBQOSA-N 427.524 2.447 10 20 IECD CC(=O)N1CCC(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 804711853 VEDIDERNAPTYCO-UHFFFAOYSA-N 440.544 2.249 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)c3Cl)cc2)C1 806857492 RELVLHJAUWABOI-AWEZNQCLSA-N 432.883 2.436 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 807671491 PUHWEVPZZGLQPY-BEFAXECRSA-N 426.492 2.381 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3cc(C)nn3C)C2)cc1 809870900 BRUHGRISDLVEBT-HXUWFJFHSA-N 440.592 2.318 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)c4nonc34)cc2)CC1 814390205 AVDMRUUZDSTAEM-UHFFFAOYSA-N 449.920 2.023 10 20 IECD O=C1CCc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(F)cc2N1 917917470 APGHQQYWRXKGSQ-UHFFFAOYSA-N 437.468 2.165 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(NC(C)=O)c(OC)c3)CC2)cc1 918461594 HMEFWMKNFWATMT-UHFFFAOYSA-N 440.500 2.340 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918461597 HORIVJYTCBVILD-UHFFFAOYSA-N 438.528 2.431 10 20 IECD Cc1nccn1-c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 918780877 ZQZNFEYROUPEJI-HXUWFJFHSA-N 447.543 2.277 10 20 IECD CCCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919878664 UVAHQGNYRNMWQD-UHFFFAOYSA-N 436.555 2.357 10 20 IECD O=C(NCc1ccncc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 935159159 ATFNILMDRXLHNX-UHFFFAOYSA-N 428.426 2.426 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1CCCO1 1781975561 LIKAPIJDAMLPSZ-CSODHUTKSA-N 438.908 2.058 10 20 IECD C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)c1ccccc1 1783281312 RRXBIPBSURPIJQ-QMHKHESXSA-N 425.485 2.130 10 20 IECD CC(=O)Nc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843251176 CPKIIWBDVZLCSA-UHFFFAOYSA-N 444.875 2.235 10 20 IECD O=C([C@H]1CNc2ccccc21)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038976 HDBXLBIYXYEBTK-LKUPDRCFSA-N 435.480 2.229 10 20 IECD C[C@@H](C(=O)Nc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1)n1cncn1 24576921 OYJQZMYYNDRFSF-NSHDSACASA-N 429.487 2.283 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCc3c(C)nc4ncnn4c3C)cc2F)CC1 303293511 LLNOTBXCTYLKPR-UHFFFAOYSA-N 439.539 2.271 10 20 IECD CC1(C)CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 744422012 ZLMHEEMSGZXJTM-LICLKQGHSA-N 447.582 2.465 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(F)c(NS(C)(=O)=O)c3)CC2)cc1F 753740605 UDAUFDZGWBUHPJ-UHFFFAOYSA-N 425.457 2.307 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(N4CCO[C@@H](C)C4)nc3)CC2)cc1F 753846497 FVLXUCDKVVGMFE-KRWDZBQOSA-N 443.523 2.486 10 20 IECD CCOC(=O)C(C)(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 762507142 BBCUNBVOBAFUHS-UHFFFAOYSA-N 429.496 2.148 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 768009378 BNAQBTGFXILBFR-KRWDZBQOSA-N 443.475 2.379 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)C(F)F)cc1 772773367 CEFSOXKXDLGIKB-WAPJZHGLSA-N 427.381 2.289 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)C(=O)C1 776771597 IDRIZOSBBYBUMY-INIZCTEOSA-N 433.505 2.165 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 776819449 APUCAQILXOHMPM-URVUXULASA-N 448.608 2.025 10 20 IECD CC(C)C[C@@H]1NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777616548 QHWNRQIYPQQPOI-SFHVURJKSA-N 426.496 2.409 10 20 IECD CCc1nc(CCNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 778252583 ABNWQBKQUXTEAH-CMDGGOBGSA-N 428.558 2.278 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 779222437 NFFFHFMZEUYOLI-SFTDATJTSA-N 448.608 2.119 10 20 IECD COCc1noc(CN2CCN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2)n1 780429235 ZDCITRSDCBFHKE-UHFFFAOYSA-N 442.564 2.480 10 20 IECD CCOC(=O)c1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 781430491 IAFUCXVXJDQFRH-UHFFFAOYSA-N 436.471 2.407 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(Cl)c(S(C)(=O)=O)c3)ccc21 788329504 PGFKIUKAKQHXPO-UHFFFAOYSA-N 435.933 2.381 10 20 IECD Cn1cc(-c2ccc(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)nn2)cn1 788788493 HVXLQFWIOVGWRU-UHFFFAOYSA-N 425.468 2.299 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789817812 ISIJEUOCCHWQBA-IAGOWNOFSA-N 435.540 2.067 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](OCC4CC4)C3)cc2F)C[C@@H](C)O1 789837554 ZMKVXEQJKGXIEM-QKLQHJQFSA-N 447.551 2.473 10 20 IECD CN(CCc1ccccc1F)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837568 ZVVLOHHNNZMXSN-UHFFFAOYSA-N 431.483 2.243 10 20 IECD CCN(CCCN(C)C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448521 BJTZVPILOWMUDA-UHFFFAOYSA-N 426.508 2.173 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H](CNC(=O)OC(C)(C)C)C3)ccc21 803688217 MESVARSQKRYNDB-QGZVFWFLSA-N 430.549 2.058 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CCOC)[C@H]3CC[C@@H](C)C3)cc2F)CC1 805006978 BNRNHACHRNYNQU-QUCCMNQESA-N 448.583 2.247 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807636355 YXGFNKAQNNEQHO-GOSISDBHSA-N 441.528 2.074 10 20 IECD O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 808344215 QYENRWUGVDPPEV-UNMCSNQZSA-N 441.528 2.008 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H](CNC(=O)C(F)(F)F)C1 811866391 KYRYDEVCFQSJIJ-MRXNPFEDSA-N 428.455 2.123 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1OC 917759299 MFWMRGFJQLOQIZ-UHFFFAOYSA-N 430.504 2.275 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 917916282 GNXLGGUJMKHPMS-UHFFFAOYSA-N 425.576 2.262 10 20 IECD COc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC 918000513 JOORTJQVAXGDPW-IBGZPJMESA-N 440.544 2.447 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)NC3CCCCC3)cc2)C1 918782617 UUDYJNAGWVMFPY-GOSISDBHSA-N 429.565 2.027 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 920090339 LZCIXSIXTRCEDC-PMACEKPBSA-N 430.593 2.361 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(c4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 1318570651 LZQSEUVESDRQHM-JFIYKMOQSA-N 430.528 2.251 10 20 IECD CCc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)co1 1782007159 LFDRCLDRWSFECK-FQEVSTJZSA-N 435.864 2.059 10 20 IECD C[C@@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CC=CCC1 1782720441 DNABIAIRHYEAHS-NLSFWIRASA-N 429.517 2.367 10 20 IECD CC(C)C1(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CCC1 1784864039 GOZAWBUKARWINH-NKOINVLESA-N 444.528 2.473 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncs3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242013 FZKWZKCRNDFFQP-WBIUFABUSA-N 437.905 2.115 10 20 IECD Cc1ccc(C)c(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1794065481 WFHJKGNFCMRSQQ-BCDXTJNWSA-N 425.485 2.440 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@H]31)C2)c1cc(O)nc(O)c1 1796137780 PMKWQALWNXLYTE-NLWWWPPXSA-N 443.544 2.303 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803972848 WDRMEAPCMZKYDH-ZBPHCFQXSA-N 449.486 2.238 10 20 IECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nc1 1805867232 DWMJIONHQQLCRR-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CC(C)(C)CC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806311335 FMUHGFBXRZMTDR-BEFAXECRSA-N 448.614 2.384 10 20 IECD O=C(COc1ccccc1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809177818 LOLBGUGEDBNDSN-UHFFFAOYSA-N 425.485 2.417 10 20 IECD O=C(C[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815602635 JVHYFZYBOUDDTD-HOCLYGCPSA-N 429.477 2.481 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1cc(O)nc(O)c1 1817846456 YURIDSFFIVSRNA-AWEZNQCLSA-N 426.408 2.370 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1[nH]nc2ccncc12 1817908247 DFGYIJYLDKDGML-HNNXBMFYSA-N 448.443 2.107 10 20 IECD O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827106243 CLACWVARBJZGKH-ZDUSSCGKSA-N 428.470 2.401 10 20 IECD O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251027 OXENCIYXKCPIHB-NSCUHMNNSA-N 433.386 2.441 10 20 IECD COc1cccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1F 1846931707 CRITUWFCQWPEFH-VQHVLOKHSA-N 442.443 2.482 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n(C)c2ccccc12 550513565 OSBDSPCHKIAUAG-IAGOWNOFSA-N 449.555 2.428 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3nc(CC(=O)OC)cs3)cc2F)CC1 730110249 GSCKHGSGASITCM-UHFFFAOYSA-N 435.525 2.461 10 20 IECD COC(=O)c1ccc(OCCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 731220164 XIAXFSIKCOXAGU-UHFFFAOYSA-N 431.464 2.327 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 734687263 RCDRPBSAOTWSRY-UHFFFAOYSA-N 434.537 2.416 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCS(=O)(=O)NC(C)(C)C 745588341 KHVYTWIKSMRNFM-UHFFFAOYSA-N 436.372 2.404 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 749577895 UTFPFAGSIQCDRD-FQEVSTJZSA-N 437.496 2.173 10 20 IECD O=C(NCCOC[C@@H]1CCCO1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067339 YHRBPNWRWBBFDM-AWEZNQCLSA-N 426.516 2.180 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)CC2)cc1F 752313410 NYPFTQRJTGHMMO-UHFFFAOYSA-N 445.875 2.237 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 762092798 XFFFJCLHQVXDTH-OAQYLSRUSA-N 428.577 2.486 10 20 IECD O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NCCc1ccc(O)c(O)c1 762268004 YZOJHALBZKIFLF-UHFFFAOYSA-N 428.304 2.134 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 762656022 CKCFHBSSNHXGHT-QXMHVHEDSA-N 446.511 2.334 10 20 IECD COc1cc(CNCc2ccc(N3CCN(C)CC3)cc2)ccc1OCC(=O)N(C)C 771825157 XATWOXWZVXUDFH-UHFFFAOYSA-N 426.561 2.204 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772901102 BPSDOIUKSFMBGX-UHFFFAOYSA-N 435.521 2.103 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 773740351 KJNMAKXFTOTQMI-AWEZNQCLSA-N 427.482 2.077 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCC[C@@H]1CO 781930707 SBXQAILGTHJTSQ-XMMPIXPASA-N 438.572 2.479 10 20 IECD COCCn1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 784307685 GZHDQONLKAWLPD-AWEZNQCLSA-N 447.447 2.489 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3ccc(F)c(C)c3)CC2)cc(OC)c1OC 785711563 HWBGYNDHOZXZGA-UHFFFAOYSA-N 445.491 2.125 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCC[C@H]3C(=O)N3CCCC3)cc2)CC1 787326830 ZJYLTDSHWLXNHE-DHIUTWEWSA-N 440.588 2.400 10 20 IECD C[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C[C@H](CO)O1 787480430 YDVUNMJNBDYPQT-VPHXBNOSSA-N 426.585 2.338 10 20 IECD C[C@H](NC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1)c1ccc(N2CCOCC2)cc1 787873698 OBGHFRBSFPFEND-AWEZNQCLSA-N 438.488 2.096 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Oc1ccc(F)cc1 789843829 DDKWQWYDTFTDBA-OAHLLOKOSA-N 447.482 2.126 10 20 IECD CN(Cc1cc2ccccc2o1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735103 WZVAECOGSBTAHU-LJQANCHMSA-N 448.523 2.409 10 20 IECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 793805626 IEOYFONLHUGSGK-UHFFFAOYSA-N 432.528 2.449 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1 797745191 XPMFRYUSJHQPQF-ZSEKCTLFSA-N 434.514 2.033 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)cc1F 803663849 CCFJBXNIIKSPAX-LJQANCHMSA-N 444.576 2.242 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@H]4CC[C@@H](C3)N4C(C)C)CC2)cc1 804317414 CDYXLDNVMUEWBS-RTWAWAEBSA-N 428.577 2.254 10 20 IECD CCOC(=O)N[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805025724 XGTGFSJHULNGNM-IBGZPJMESA-N 430.549 2.276 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)c1ccc(O)cc1 806550173 HRNDICGYFFXJEQ-UHFFFAOYSA-N 435.459 2.147 10 20 IECD C[C@@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290869 CWDONCVGPULLME-KRWDZBQOSA-N 425.558 2.041 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 810165455 SULANBFPZVCHJG-JOCHJYFZSA-N 441.576 2.008 10 20 IECD CS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918104133 LUASRKJTCPIHJH-UHFFFAOYSA-N 449.548 2.331 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(OC[C@H]2CCCO2)c1 918340229 NFSXSJNSSGYKEK-JOCHJYFZSA-N 444.553 2.409 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)N3CCN(c4cnccn4)CC3)c2C)cc1 925669842 GFJOXPOZPCCALF-UHFFFAOYSA-N 449.511 2.398 10 20 IECD COC[C@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314713 QBHUORQLBDJYHI-ZDUSSCGKSA-N 435.571 2.263 10 20 IECD Cc1nc2ccncc2cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1798016125 HPNJODYAWWHESJ-BJWYYQGGSA-N 433.468 2.310 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n(C)n1 1804285588 ACGXYLXBPYLHFH-FJXIAYRNSA-N 440.500 2.065 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1805454712 OXGHZDPNTYKRJV-KKSFZXQISA-N 433.468 2.225 10 20 IECD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cs1 1807990191 GFRLYKDFWRWNIP-AUUYWEPGSA-N 439.497 2.286 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550541 NOQIGXIWRKFHQU-OAHLLOKOSA-N 427.505 2.104 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C2CCCC2)[C@H]1c1cccnc1 1814185812 GLAJDROEUXVASL-APWZRJJASA-N 446.598 2.138 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2)CC1 1825826322 ASEQIGNSRYIQFT-KRWDZBQOSA-N 446.598 2.175 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cc(O)n1 1827623434 ZDOZEYSESJJKOT-SFHVURJKSA-N 440.500 2.449 10 20 IECD O=C(c1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898545 OYKQYXTVWDRMMP-KRWDZBQOSA-N 446.598 2.175 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(c4ccccc4C)C3=O)CC2)cc1 110757859 YTIDQARWCGKCMG-XMMPIXPASA-N 436.512 2.119 10 20 IECD COc1ccc(N2CCN(CCCNc3cnn(C)c(=O)c3Br)CC2)cc1 301272798 YMOGBNLIOFHHFN-UHFFFAOYSA-N 436.354 2.176 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(CC(=O)N4CCCC4)CC3)ccc21 509872356 WMJBGMWQOCAASP-UHFFFAOYSA-N 426.561 2.285 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCN([C@H]2CCC[C@@H]2O)CC1 728751907 WZACKEYPTYSVPQ-PMACEKPBSA-N 438.519 2.497 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)c2sccc2-n2c(C)ccc2C)CC1 728888755 FGQNLPSJSIULFD-GOSISDBHSA-N 432.590 2.455 10 20 IECD NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742333913 ACWKRTZBJDRFSA-CQSZACIVSA-N 425.457 2.334 10 20 IECD C[C@@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1cc(Br)ccc1O 756527200 XCXWPMOGABWOJM-CQSZACIVSA-N 434.338 2.334 10 20 IECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 756937174 UYSQSEKEAMQTJV-HOTGVXAUSA-N 446.523 2.025 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C)c3C(F)F)cc2F)C[C@H](C)O1 758965158 ITCXZAYTBIMLCO-RYUDHWBXSA-N 439.438 2.365 10 20 IECD COc1cc(N2CCN(C(=O)[C@H](C(C)C)N3C[C@@H](C)O[C@H](C)C3)CC2)cc(OC)c1OC 760083192 CVWZJDMKNLUYHP-HMFYCAOWSA-N 449.592 2.495 10 20 IECD COc1cc(N2CCN(C(=O)c3n[nH]c(C)c3Br)CC2)cc(OC)c1OC 760086863 WUXZXYGERJCKGN-UHFFFAOYSA-N 439.310 2.469 10 20 IECD O=C(CCn1nnc2ccccc2c1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915502 LKMYNFJVKLRNDM-KRWDZBQOSA-N 441.919 2.321 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@H]3CC(=O)c3cccs3)nc12 771301900 KESTUMWIPDMYRN-CQSZACIVSA-N 430.486 2.147 10 20 IECD Cc1nc2ccccc2n1CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 772274093 CHAFMJATUKVLGU-UHFFFAOYSA-N 426.542 2.286 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)O1 774776906 USLONBLPPGVTPC-QGTPRVQTSA-N 440.491 2.192 10 20 IECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1ccc([N+](=O)[O-])c(OC)c1O 774929005 BINJRANOOWOJPI-UHFFFAOYSA-N 430.461 2.317 10 20 IECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 775203984 XJGACGPXJUVDAY-MRXNPFEDSA-N 432.546 2.039 10 20 IECD CS[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H]1N(C)C 775997473 BEJWQQDUAKAEAF-LVNJIZSUSA-N 438.613 2.033 10 20 IECD O=C(CN1CC[C@](O)(c2ccc(F)cc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 777737178 MABBNUNBJLNWMR-HSZRJFAPSA-N 431.483 2.011 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)N3CCc4ccccc43)CC2)cc1 778239132 QAMIVAUCGVHYFW-SGWGQVFISA-N 448.567 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)NC(=O)CC4)CC2)cc1 778289527 NIZFLPCSZPTSIB-KHPPLWFESA-N 434.496 2.423 10 20 IECD CC(=O)N1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 785505900 PVDQHYHCFAFCMO-UHFFFAOYSA-N 426.517 2.002 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@@H](C(C)C)C3)CC2)cc1 785528179 OBUIJXBOIOTORN-HXUWFJFHSA-N 430.593 2.218 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1 787852810 UEHWLJOCTGKKOY-UHFFFAOYSA-N 437.588 2.040 10 20 IECD O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788379825 ODVBDVQAYXGNTN-OAQYLSRUSA-N 434.496 2.402 10 20 IECD CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788930261 QATLEUMFFDKZBO-LJQANCHMSA-N 428.577 2.304 10 20 IECD Cc1ccc(C2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)cn1 789813928 XPEQXDOQFWEVLR-UHFFFAOYSA-N 440.519 2.388 10 20 IECD CC(=O)N[C@@](C)(C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(S(C)(=O)=O)cc1 797742847 COLGTRISSDWAEJ-HSZRJFAPSA-N 444.553 2.342 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3c(C)cc(C)nc3OC)CC2)cc1 804034129 LNBAEVFHSXPYRQ-UHFFFAOYSA-N 426.517 2.071 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCN(c2ccccc2)C1=O 807292778 YHQAOSNZMXTPBX-QFIPXVFZSA-N 432.524 2.333 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(C(=O)NCc2ccccc2)CC1)c1ccc(N(C)C)cc1 807672921 KGGPGJAGKDWYQS-GOSISDBHSA-N 436.556 2.485 10 20 IECD CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl 808486189 JQMGXBIIJDIJJL-UHFFFAOYSA-N 435.885 2.402 10 20 IECD Cc1cc(C(=O)COC(=O)[C@](C)(O)C2CCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 812668637 HDRVBMDRUGMUEK-OAQYLSRUSA-N 434.514 2.019 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 918643713 MWJMBAUBABUHAU-UHFFFAOYSA-N 428.470 2.241 10 20 IECD COc1ccc([C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)cc1 919805379 SCZXQPLIQSRVLR-IBGZPJMESA-N 433.530 2.339 10 20 IECD CN(CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)Cc1ccc(N2CCOCC2)cc1 920206502 LHIGRMYGYTUAEE-UHFFFAOYSA-N 432.565 2.034 10 20 IECD CCN(c1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 1324528499 AFYRDUQEZHBZAO-UHFFFAOYSA-N 429.523 2.404 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc(C4CC4)nc4c3c(O)nc(=O)n4C)CC2)cc1 1336534833 STRWHFVMNNHGGV-UHFFFAOYSA-N 449.511 2.273 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C)C(=O)NCC(F)(F)F)cc2F)C[C@@H](C)O1 1337686460 UTXRQRSUMUPRDK-XQQFMLRXSA-N 434.434 2.306 10 20 IECD CCC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)n1cccc1 1796829327 AEWYUZBLGCYUHG-YYIAUSFCSA-N 448.614 2.328 10 20 IECD O=C(CC[C@@H]1CCOC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291958 ZXPGBIHFEXCGOL-VCQDCTFDSA-N 430.501 2.272 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990059 DGQQYPFQMNLSJL-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1 1814162380 RVYFWEOHGZGWOZ-QYCLIQIRSA-N 441.459 2.276 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1 1814166648 RVYFWEOHGZGWOZ-DGVMRNEOSA-N 441.459 2.276 10 20 IECD O=C(CCc1ccoc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729264 YIANRIKTCMNUBO-ZDUSSCGKSA-N 428.470 2.401 10 20 IECD O=C1Cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)c2N1 1845665653 MPOCAVSCCDKWHD-UHFFFAOYSA-N 441.871 2.377 10 20 IECD COc1ccc(N2CCN(Cn3nc(-c4ccco4)n(CCC(N)=O)c3=S)CC2)cc1 106263054 ZJIUWAXHEXZMBB-UHFFFAOYSA-N 442.545 2.338 10 20 IECD O=C(NO[C@@H]1CCCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 725898289 LVMQVTYFPFDCQX-QGZVFWFLSA-N 437.430 2.289 10 20 IECD C[C@@H](NC(=O)CSc1nnnn1CC(F)(F)F)c1ccc(N2CCOCC2)cc1 729948194 GEFQSXVACWNWKH-GFCCVEGCSA-N 430.456 2.042 10 20 IECD COc1ccc(O)c(CNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1 734018733 HJIGKZVXDOLDFK-UHFFFAOYSA-N 448.419 2.284 10 20 IECD Cc1cnn(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2F)c1 737145154 KQBKOFZUHCJIAU-UHFFFAOYSA-N 437.475 2.411 10 20 IECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCN1C 745738071 SMSMJLDPTWWFDR-IEBWSBKVSA-N 441.555 2.224 10 20 IECD Cc1nc(C)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)o1 748205042 IJHHCCRUTJGJAB-UHFFFAOYSA-N 431.470 2.386 10 20 IECD COc1cc(N2CCN(CN3C(=O)c4ccc(F)cc4C3=O)CC2)cc(OC)c1OC 758965515 QTZUJFIIRKMQOB-UHFFFAOYSA-N 429.448 2.227 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC4CC4)c3)cc2F)C[C@@H](C)O1 762413527 CXHVVSZNCHCCFS-HUUCEWRRSA-N 429.496 2.301 10 20 IECD COc1ccc(N2CCC(NC(=O)CCC(=O)Nc3ccc4nc(O)[nH]c4n3)CC2)cc1 765485203 OHTUFNWBUJGOOP-UHFFFAOYSA-N 438.488 2.176 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@]2(CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)C1 765734846 VVDWSMWNPJITIG-HXUWFJFHSA-N 439.534 2.237 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCS[C@@H]4COCC[C@@H]43)cc2F)C[C@@H](C)O1 767904472 DUXZKIVKONFRIX-WWEWDKITSA-N 437.581 2.262 10 20 IECD Cn1ccnc1-c1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 768712450 FDHFUXCWCDAOAA-OAHLLOKOSA-N 441.513 2.396 10 20 IECD CN(C)C(=O)Cc1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772908273 CPYOOVAYSGLAPD-UHFFFAOYSA-N 428.508 2.021 10 20 IECD COC(=O)NCc1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772911240 RNSUYXWPFIFAMB-UHFFFAOYSA-N 430.480 2.247 10 20 IECD COc1ccc(S(=O)(=O)Nc2cc(C)c(O)c(C)c2C)cc1[C@]1(C)NC(=O)NC1=O 775291221 GGRKTZPEJZGXKX-FQEVSTJZSA-N 433.486 2.181 10 20 IECD CS(=O)(=O)N[C@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 775652998 YXHSJRAXOMJSEB-NSHDSACASA-N 442.173 2.431 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 776855336 HHTKECMYCQLQSB-DCTVWTRXSA-N 439.528 2.059 10 20 IECD CCOc1cnc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 778534497 CRRZFNLPWPSXRO-UHFFFAOYSA-N 431.404 2.446 10 20 IECD CCOC(=O)c1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 778611483 AXAKRQXCIXEUMQ-UHFFFAOYSA-N 440.468 2.457 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12)c1ccc(N(C)C)cc1 785603924 WWBIEEXWBZRLCG-GFCCVEGCSA-N 434.422 2.308 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)NCCCSc2nccs2)N2CCOCC2)c1 787611106 DYYNVHGBQCPXAR-GOSISDBHSA-N 448.614 2.240 10 20 IECD C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789798971 GZDCZUOLBNSOQR-ROUUACIJSA-N 448.583 2.151 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccc(O)c3)cc2F)C[C@H](C)O1 789824537 IRZKXTQXQUEPKX-HOTGVXAUSA-N 429.492 2.420 10 20 IECD CC(C)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 789827386 SHCLSTVPSNHZCG-BZSOYRFXSA-N 435.540 2.375 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@H]1CCc2ccccc21 789840397 GYHURSCABMOXAC-GOSISDBHSA-N 425.504 2.249 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 793808971 CQYSCEBMPIGNRA-DVECYGJZSA-N 430.593 2.361 10 20 IECD COc1ccc(N2CCN(CCNC(=O)COc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 797616634 VPHHHANWOYDLKR-UHFFFAOYSA-N 428.489 2.229 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(S(N)(=O)=O)ccc2F)cc1 798322268 RLVOIIOHMFPTIW-KRWDZBQOSA-N 435.521 2.361 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4cccs4)CC3)CC2)cc1 804315898 UWUUYMXVYWJHSB-UHFFFAOYSA-N 428.558 2.191 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)NCCN3CCOCC3)c2C)cc1 805967122 GEBDPRWOYMTRDO-SFHVURJKSA-N 429.517 2.096 10 20 IECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807292496 RHUKAHCTCYLBNP-QGZVFWFLSA-N 430.549 2.441 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)C2CC2)cc1 807841943 MDJKOAHDRPSCKZ-IBGZPJMESA-N 426.561 2.151 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 811530075 UDXVILWTKOIRTJ-UHFFFAOYSA-N 446.312 2.252 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cnn4c3OCCC4)c2C)cc1 816206822 DHYXSWULHJRJPC-UHFFFAOYSA-N 430.486 2.200 10 20 IECD O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccc(S(=O)(=O)Nc2ccccc2)cc1 917126789 AVOPZWVJLAJMNA-UHFFFAOYSA-N 425.495 2.484 10 20 IECD Cc1cccc(-n2nnnc2SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917181051 OCLWHZRMDPRXNU-UHFFFAOYSA-N 442.520 2.355 10 20 IECD COc1ccc(C(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1[N+](=O)[O-] 917364082 CPBUSYCJZFMNMA-KRWDZBQOSA-N 443.456 2.247 10 20 IECD COCCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 917708671 MXDWYYPBYFZXHJ-UHFFFAOYSA-N 433.480 2.340 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(N(C)C)nc3)cc2F)C[C@H](C)O1 918286688 KBHXFLQDZROSSU-GJZGRUSLSA-N 429.496 2.155 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1 920255702 UJTKVBUAKNFHEP-VAWYXSNFSA-N 436.512 2.241 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 920495839 GLGRACWWCNLGNK-SFHVURJKSA-N 436.505 2.408 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc(OC)ccc3OC)CC2)cc1 921182236 CAYYROMPZJTEDU-UHFFFAOYSA-N 428.485 2.147 10 20 IECD Cc1cccc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc12 1778497510 ZSRHBSKVDBIYPS-HSZRJFAPSA-N 436.468 2.040 10 20 IECD Cc1n[nH]cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1780145210 LJJOLCFEGZQYFF-DYESRHJHSA-N 448.907 2.224 10 20 IECD CCn1nc(C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782001395 JSSUPSJAKRVMBQ-NRFANRHFSA-N 448.907 2.033 10 20 IECD CC1=CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785505418 HLPWXOLMQYSPSO-MOMHAMLUSA-N 442.512 2.393 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@H](CNC(=O)C2(F)CC2)[C@H]1c1cccnc1 1812462279 HUPGIZVZQUNLNP-KHIHDDCBSA-N 441.459 2.420 10 20 IECD O=C(CCCn1cccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813450287 XAZCRGNHXLIFEW-WZONZLPQSA-N 449.511 2.489 10 20 IECD Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1814971679 DZLMXLYABYZPDP-QGZVFWFLSA-N 436.472 2.468 10 20 IECD CC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294785 QSHWOASVQKQFSZ-ZUZCIYMTSA-N 449.895 2.305 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccn2nccc12 1821462699 CKZGUYIMPRABQJ-KRWDZBQOSA-N 447.455 2.483 10 20 IECD O=C(Cc1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425869 BMFBIPBNUOYINY-QGZVFWFLSA-N 430.530 2.425 10 20 IECD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)ccn1 1827428274 MAEIZYLUAXGLNV-SFHVURJKSA-N 440.500 2.444 10 20 IECD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)C1CC1)C2 1843331639 SHYOUKDINBZXSY-LJQANCHMSA-N 442.560 2.318 10 20 IECD COc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1OC(C)C 727177867 QAGFYIBELKEYMW-GDNBJRDFSA-N 430.573 2.233 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2C 728306766 CGWOFUWMYJRLRW-VQIMIIECSA-N 449.555 2.468 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1S(N)(=O)=O 730843057 WVHUPWNSJUZFMA-HUUCEWRRSA-N 435.521 2.325 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1nn(-c2ccc(F)cc2)ccc1=O 731746146 OGOJTMJKALTOPA-UHFFFAOYSA-N 438.459 2.253 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)cc1 739926172 ABOBZOUSTKPVCW-UHFFFAOYSA-N 447.557 2.063 10 20 IECD CC(C)CNC(=O)N1CCC[C@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 741358746 MRIFSNDTEKFWID-IBGZPJMESA-N 432.565 2.332 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cccc1N1CCOC1=O 743896794 KVAWMEAVICUILL-UHFFFAOYSA-N 438.484 2.043 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1C 745994832 QBCXLICUCJDGPV-UHFFFAOYSA-N 431.514 2.284 10 20 IECD COC(=O)C[C@H]1CSCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 746462423 DBESPXKSVKEQQA-HNNXBMFYSA-N 438.505 2.381 10 20 IECD CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 750276508 JAPSQRNYCOIFJI-XETNRHBRSA-N 436.622 2.196 10 20 IECD C[C@H](OC(=O)c1cc(C(N)=O)c[nH]1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 750418210 OLBBSDQTUIJPNS-NSHDSACASA-N 431.404 2.073 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)co1 755841133 MAPIYMOKFOCIQF-UHFFFAOYSA-N 429.445 2.188 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@@](C)(c4ccc(C)cc4)C3=O)CC2)cc1 758436169 PQXYZYYDWCVWFK-VWLOTQADSA-N 435.524 2.369 10 20 IECD CCCn1c(CO)nn(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1=S 758953214 CIQBYFNDMPWJTK-UHFFFAOYSA-N 437.566 2.122 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cn(C)nc3C(F)(F)F)CC2)cc1 773209693 BCNMUCFZEXUDRC-UHFFFAOYSA-N 425.411 2.171 10 20 IECD COc1ccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N(C)C)cc1OC 774857472 FOYWVFCSQWPHOF-UZLBHIALSA-N 442.560 2.366 10 20 IECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1 777949900 LTLQTXRFHFIWCA-UHFFFAOYSA-N 434.474 2.404 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 788966517 VMWUATHRCIPYHA-JQVVWYNYSA-N 430.593 2.249 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@]3(C)CCCO)cc2F)C[C@@H](C)O1 789823085 YRKSLTKPDNSWEM-SEPYTNNBSA-N 435.540 2.209 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCOCCc3ccccc3)CC2)cc1 793721776 ZJNWPIWSGHJQTK-UHFFFAOYSA-N 439.556 2.500 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)c3ccc(C)s3)CC2)cc1 793850909 OIKLWMRYTOTULT-QGZVFWFLSA-N 430.574 2.181 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCCOCCS(C)(=O)=O)cc2Cl)C1 799934395 XONAVZITRYLCBS-OAHLLOKOSA-N 431.986 2.437 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803661627 HXFAXWDFASANIG-HOCLYGCPSA-N 436.528 2.270 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](CCCO)c3ccccc3)CC2)cc1 804317579 IQTRBOPAQGDKJH-QFIPXVFZSA-N 425.529 2.410 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C4CCN(CC(F)F)CC4)n3)CC2)cc1 809465503 WXMZUEKREKTZRH-UHFFFAOYSA-N 449.502 2.414 10 20 IECD O=C(N[C@@H]1CC[C@@H]2SCCS[C@H]21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809520921 GXFXFKUYPOBSCO-NBMJBFSESA-N 436.599 2.396 10 20 IECD COCCN1C(=O)/C(=C(/C)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(=O)NC1=S 814336756 IWMSBPPGGJCFSO-PDGQHHTCSA-N 449.488 2.038 10 20 IECD O=C(COc1ccc(Cl)c(F)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 815065513 GAWCYOOZDZTEEZ-UHFFFAOYSA-N 426.897 2.409 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4cnn(-c5ccccc5)c4C3)CC2)cc1 815309557 NWNFLNFKVGFMHG-HSZRJFAPSA-N 433.556 2.380 10 20 IECD Nn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1cccs1 917153748 GGJKCJAYQMWJMM-UHFFFAOYSA-N 448.549 2.105 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1 917657892 GDNLMUMSAZFGDQ-UHFFFAOYSA-N 425.576 2.260 10 20 IECD CC(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 919840773 WDHNZMOXWSRDFQ-UHFFFAOYSA-N 436.555 2.356 10 20 IECD O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NCc1ccc(N2CCOCC2)cc1 919860239 QQXBZTBCAZHQRA-UHFFFAOYSA-N 449.598 2.228 10 20 IECD CCCS(=O)(=O)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920630439 BKSCVYQVJBKHTP-ZDUSSCGKSA-N 443.477 2.157 10 20 IECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920865837 OOGRFDLWOCQXCA-MRXNPFEDSA-N 447.557 2.207 10 20 IECD COc1ccc(N2CCC(Nc3ccc(S(=O)(=O)N4CCOCC4)cn3)CC2)cc1 1322333965 ONOFTPNYDCVWRG-UHFFFAOYSA-N 432.546 2.192 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sc(-c2ncccn2)nc1C 1324135270 BCYLKNFVORNKHH-ZDUSSCGKSA-N 428.470 2.224 10 20 IECD CC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1785865624 NXAXUCXVPXLWLB-KRWDZBQOSA-N 426.473 2.155 10 20 IECD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c[nH]1 1787290080 CMDOWDIFFXQDNZ-JQFCIGGWSA-N 442.516 2.026 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cnoc2C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992136 VHTQLJQFRBFCMT-MGPUTAFESA-N 449.467 2.387 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000168 XRWORCGTLWQSQY-ULYRPOKDSA-N 440.500 2.024 10 20 IECD CCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826097367 FYZMBALBZILGKD-QGZVFWFLSA-N 427.505 2.256 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1F)CC2 1828197726 HJHKAYAOSSJVFX-XHWCKBBDSA-N 433.461 2.243 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1sccc1F 1833591855 KDRQGRGUCGDATF-UHFFFAOYSA-N 448.520 2.192 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)c1 734073013 ZNYOTDDTZGWFKQ-UHFFFAOYSA-N 437.246 2.189 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(Cl)c3S(C)(=O)=O)ccc21 743900147 CNEKPWYCSNQYAE-UHFFFAOYSA-N 435.933 2.381 10 20 IECD NC(=O)NC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745905934 SPVJYYSFNWJGFZ-HUUCEWRRSA-N 425.480 2.347 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 746038181 NOAZLLFYQRVISP-UHFFFAOYSA-N 426.864 2.496 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NCc3ccccc3O)CC2=O)cc1 748354282 YGLSRINHXQLMJM-QGZVFWFLSA-N 445.541 2.092 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]([C@H]3CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750251910 CGHFIKVXJXDWAG-MSOLQXFVSA-N 431.558 2.283 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1 751403685 DPVQCFBZYOAFRA-SFHVURJKSA-N 435.546 2.417 10 20 IECD COc1ccc(N2CCN(C(=O)NCCCN3C(=O)COc4ccccc43)CC2)cc1F 753918890 OHNNSOOKZNOCQG-UHFFFAOYSA-N 442.491 2.482 10 20 IECD COC(=O)c1cccc([C@@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)OC)c1 754003621 OSMSZIKFMRPZQB-TZIWHRDSSA-N 439.512 2.179 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1Br 756096168 OAQUNAQCUNHVNV-UHFFFAOYSA-N 437.246 2.205 10 20 IECD Cc1c(CCC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1C 758603725 MSGKTIMVEXDKCE-HZPDHXFCSA-N 446.523 2.273 10 20 IECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 759027739 NODKCAZXEQJEFK-UHFFFAOYSA-N 437.418 2.329 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cc(S(C)(=O)=O)ccc3C)c2)CC1 769848904 RALOEPKCCHELJJ-UHFFFAOYSA-N 437.587 2.341 10 20 IECD O=C(COC(=O)CCc1cccc2c1OCO2)NCc1ccc(N2CCOCC2)c(F)c1 770438018 JJZYCCVHSIUWKS-UHFFFAOYSA-N 444.459 2.183 10 20 IECD CCC(=O)N1CC[C@@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 773221950 KWYGCRPXJHZGMS-CQSZACIVSA-N 434.448 2.202 10 20 IECD COc1ccccc1[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCCC1 774915800 FEGZGPGMKPYANB-OAQYLSRUSA-N 442.535 2.470 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 778232748 MEQBEFCQAWHKCQ-KTKRTIGZSA-N 446.511 2.428 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccc(F)cc4)CC3)CC2)cc1 779219212 RSRVQVDSJUNNJW-QHCPKHFHSA-N 428.552 2.139 10 20 IECD CC(C)c1nc([C@H]2COCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 780820736 KRZXPEOCVHKTQN-GOSISDBHSA-N 433.484 2.452 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(CC(=O)N(C)C)CC3)cc2F)C[C@@H](C)O1 781347558 YBALJNPLHDOQNB-QZTJIDSGSA-N 448.583 2.246 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1-n1cnnn1 781609438 UJXHBEZKGSXBJK-HUUCEWRRSA-N 440.479 2.354 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 788318499 DBRXNRMJTOZVED-WOJBJXKFSA-N 443.569 2.316 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@H](c2ccc(F)c(F)c2)C1 788318983 JTWFCKAXGUBQGH-NRFANRHFSA-N 445.466 2.018 10 20 IECD C[C@H](NC(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 788324918 ZUUOFAAMAOOGFZ-IBGZPJMESA-N 438.572 2.385 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(CCO)Cc3ccccc3)cc2F)C[C@@H](C)O1 789812752 OMFHZNKLRPTHAY-QZTJIDSGSA-N 443.519 2.077 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H](C)[C@@H](C)O1 789950291 NSBIMUGPUQYXQN-RBSFLKMASA-N 443.466 2.183 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCSC1 790502094 RWFREOUXCZNALX-QGZVFWFLSA-N 430.553 2.495 10 20 IECD COc1ccc(CNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c(O)c1 793089528 UYMPLXWCQPZKJR-GOSISDBHSA-N 445.491 2.057 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H]1C 803451112 DROSJCGOCIZSIM-ILXRZTDVSA-N 425.476 2.397 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@H]3C[C@H](O)c3cccs3)ccc21 803688884 DQRFVOWHMIPKKL-QUCCMNQESA-N 443.569 2.098 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1F 804852956 JKYNSQYCBLSUOT-DOTOQJQBSA-N 436.528 2.271 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 807099596 AIDSYCAWSCPDBJ-RBUKOAKNSA-N 431.558 2.090 10 20 IECD CC(C)N[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768717 AKLYBORLSOLOFP-DLBZAZTESA-N 438.519 2.362 10 20 IECD C[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855846 KGHZKTIMQAENOV-IBGZPJMESA-N 435.572 2.449 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H]1CCS(=O)(=O)C1 914454104 PXSKGEGTEFWBOS-OJLMPMFISA-N 444.625 2.280 10 20 IECD CC(C)CC(=O)N1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 1115858710 BFESBEFJJXAZOX-KDURUIRLSA-N 448.583 2.246 10 20 IECD CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787995704 WZKNJLCXCOEWHT-FZKQIMNGSA-N 448.614 2.354 10 20 IECD CC(C)CNC(=O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788428063 XQPAWYHGEKWKSI-UHFFFAOYSA-N 426.473 2.013 10 20 IECD CCC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1812568601 KIVRDQUEJGVQTE-SCLBCKFNSA-N 431.876 2.445 10 20 IECD CC(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874678 DNIHICFFKWNORP-FCRGVEGXSA-N 446.544 2.453 10 20 IECD O=C(C1Cc2ccccc2C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442882 AYUILLYOHPIRFS-UHFFFAOYSA-N 442.519 2.398 10 20 IECD COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)s1 1848336101 DDQXUNOSHRCGPS-PXHZSSHCSA-N 430.482 2.402 10 20 IECD COC(=O)N(C)CCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729777617 CQLRJLKUUIPSSW-UHFFFAOYSA-N 438.436 2.422 10 20 IECD O=C1NC(=O)C2(CCC(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)CC2)N1 731473813 BIRTUARDJJUDGP-UHFFFAOYSA-N 436.459 2.141 10 20 IECD CS(=O)(=O)c1cccc(C(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)c1 734475929 IOUNCJKQDGRZEW-UHFFFAOYSA-N 425.510 2.302 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc2nc(O)nc(O)c12 740741161 QBNPLYORNNEANY-CHWSQXEVSA-N 441.463 2.427 10 20 IECD CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 747515281 MVZZRRCBOGBVOG-UHFFFAOYSA-N 429.539 2.387 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](CN(CC)CC(F)(F)F)C3)nc12 747967161 LNUOBTMKQPRTFC-CYBMUJFWSA-N 429.443 2.318 10 20 IECD COc1ncc(-c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)c(N)n1 752893796 NFJFFZDGLYATDR-UHFFFAOYSA-N 446.470 2.352 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc4c(=O)n(C)c(S)nc4c3)CC2)cc1F 753742570 QYRYUXUPONPVQM-UHFFFAOYSA-N 428.489 2.332 10 20 IECD COc1ccc(N2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1F 753856516 FXILIFDZUNPREW-UHFFFAOYSA-N 444.463 2.076 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc(OC)c(F)c4)CC3)nc12 753861176 NPHOVQWKUFMCPO-UHFFFAOYSA-N 429.452 2.082 10 20 IECD CCc1ccccc1NC(=O)CN(C)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 753998400 BTVDIGMRWPGAMD-QFIPXVFZSA-N 440.588 2.311 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 754200638 QPASDRGWKHDJSI-UHFFFAOYSA-N 448.523 2.227 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 756171203 LOQCHWXZOFEDRM-AWEZNQCLSA-N 431.464 2.495 10 20 IECD COc1ccc(N2CCC(NCCNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 765401617 HCLRQTSRFNGKPT-UHFFFAOYSA-N 434.518 2.140 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2cccc(Br)c2O)cc1 765751960 BTIFZTDEDGWJML-LBPRGKRZSA-N 427.320 2.446 10 20 IECD CNC(=O)c1cccc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 768521891 KZFKRVXNKUCCTL-HZPDHXFCSA-N 429.492 2.494 10 20 IECD COc1ncnc(N(C)C)c1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 769696557 KEYYCMYKIZXHMM-UHFFFAOYSA-N 447.407 2.487 10 20 IECD CCc1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)o1 774162971 BTYJUKGUJSQIDH-UHFFFAOYSA-N 435.484 2.391 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 777828029 GKVTWEBGSYJOLY-FQEVSTJZSA-N 432.904 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](CN4CCCCC4)C3)CC2)cc1 778294583 LQYHAXITFZCLPH-LCCNJJIFSA-N 440.588 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)c3c(C)noc3C)CC2)cc1 778393110 AHXZUBLSWBZORD-ZNFPLGDCSA-N 426.517 2.425 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCOC[C@@H]1c1noc(-c2cnn(C)c2)n1 780834116 UQJLMHSJRHMHSC-GOSISDBHSA-N 425.493 2.128 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](c3ccc(F)cc3)c3nccn3C)ccc21 785599804 PNFXCZFQRWXQKY-NRFANRHFSA-N 435.503 2.464 10 20 IECD O=C(N[C@H]1CCN2CCCC[C@H]12)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790271685 ADYZUDIRCGVUNL-AYOQOUSVSA-N 436.503 2.116 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)CC2)cc1 790524057 ODMOVSPTYJANQJ-UHFFFAOYSA-N 428.489 2.472 10 20 IECD CCN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793718416 JMGABCSUDNKMSJ-GOSISDBHSA-N 442.585 2.157 10 20 IECD Cc1cc(C(=O)COC(=O)Cc2ncccc2F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795792184 LWPQAMLDIKWCKZ-UHFFFAOYSA-N 445.472 2.244 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4c(F)cccc4C3)cc2F)CC1 805006643 AACDZWPZQGNAHW-UHFFFAOYSA-N 442.510 2.308 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(N(C)C)cc1 807674780 QVRKPVWXMRIXJW-NQIIRXRSSA-N 436.556 2.280 10 20 IECD CCN(CCCN(C)C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768075 BEYTXFVJEDHUJL-INIZCTEOSA-N 426.508 2.173 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](C2CC2)O1 807771904 YTYWRHRICDZWRD-SIXWZSSISA-N 437.487 2.399 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)NC3CCN(C(C)=O)CC3)c2C)cc1 899171669 RMZNSUWBIBWMRF-UHFFFAOYSA-N 427.501 2.387 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)c3nnc4ccccn34)CC2)cc1 916196462 HVFQOPVFTGRYBJ-GOSISDBHSA-N 437.548 2.310 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC2CCN(S(C)(=O)=O)CC2)cc1 917006713 BNXNUEGQVVIDJF-UHFFFAOYSA-N 434.562 2.481 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC 918000462 GDVLRWBLDQATBI-SFHVURJKSA-N 426.517 2.405 10 20 IECD C[C@H]1CN(Cc2csc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)C[C@H](C)O1 919810436 VEZOETIMSIPTKD-RYUDHWBXSA-N 440.547 2.082 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccoc34)C[C@@H]21)c1cc(O)nc(O)c1 1787294154 FEVQIBJPRNKVNL-WBAXXEDZSA-N 437.452 2.146 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccn(-c2ccccc2)n1 1796601431 IBPUCNSJEBDBSS-VBUUOAMHSA-N 433.468 2.244 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807999792 WHABBLDCZAZUBM-URLQWDBASA-N 428.514 2.103 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146062 RGPQWXNFLFFQQP-SFHVURJKSA-N 448.483 2.174 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1820279661 MEIYDSCHHCICJC-ZDUSSCGKSA-N 448.508 2.490 10 20 IECD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846343519 LRSVQNNFEGEAKS-CABCVRRESA-N 448.903 2.324 10 20 IECD CNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CC1 725884339 KZLVIUKAMMZPQH-UHFFFAOYSA-N 433.350 2.360 10 20 IECD COc1ccc(O)c(CNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N2CCOCC2)c1 734064358 FNTUCXZRERXBKR-LJQANCHMSA-N 445.516 2.291 10 20 IECD Cc1cc(C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1-c1cccc(Cl)c1 735822833 GTCWZTCPMDJIST-LJQANCHMSA-N 444.963 2.410 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 742244647 SUZNDAUVOZDRPB-JOCHJYFZSA-N 447.539 2.453 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)CC2)cc1 742491385 LMSXHJLIFGABEK-LJQANCHMSA-N 449.559 2.238 10 20 IECD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 743628934 GTERQTBVOWPAAK-UHFFFAOYSA-N 427.383 2.272 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3CNC(=O)c3ccccc3)nc12 746678078 VUTDIZWHGORPJK-SFHVURJKSA-N 437.500 2.396 10 20 IECD CC(C)C[C@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746950678 PALYZKPFDREXPP-SFHVURJKSA-N 430.528 2.149 10 20 IECD Cc1nccn1CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748097670 SWWGUCGIWSNOFA-UHFFFAOYSA-N 445.457 2.036 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OCc4ccccc4)CC3)nc12 749530958 ISRHKFFGVSIUOJ-UHFFFAOYSA-N 439.472 2.066 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C(F)(F)C3(O)CCC3)cc2F)C[C@@H](C)O1 753417809 NTNHCNQGPKOENK-OKILXGFUSA-N 444.450 2.149 10 20 IECD CCOC[C@@H](C(=O)OC)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 754352146 PJJIYSOQEPAECN-INIZCTEOSA-N 440.408 2.020 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cn(-c4ccccc4)nn3)CC2)cc1 755217143 JBAQKRPJTSQEMI-UHFFFAOYSA-N 449.559 2.287 10 20 IECD O=C(COC(=O)C(F)(F)c1nccs1)NCc1ccc(N2CCOCC2)c(F)c1 755618596 WPDYHGGFIDJZQH-UHFFFAOYSA-N 429.420 2.070 10 20 IECD COc1cc(N2CCN([C@H](C)C(=O)Nc3c(C)nn(C)c3C)CC2)cc(OC)c1OC 759872359 IBJBTGHUZBOPBN-MRXNPFEDSA-N 431.537 2.212 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)CC2)cc(OC)c1OC 760085354 PRGPBGSKDDXALF-UHFFFAOYSA-N 444.513 2.114 10 20 IECD COc1ccc(N2CCC(NC(=O)N(CCO)CCNC(=O)OC(C)(C)C)CC2)cc1 768324802 FBZCPBPHBUSCEV-UHFFFAOYSA-N 436.553 2.193 10 20 IECD CN(C)CCn1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 769737559 INYRDIKDYBXBPS-UHFFFAOYSA-N 435.531 2.265 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 772996698 GWUBGMFFLKERDU-OAHLLOKOSA-N 432.418 2.015 10 20 IECD C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)c2)C[C@@H](C)O1 774362999 PRPVGCSAEIZHTN-HZPDHXFCSA-N 427.501 2.004 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc2c1OCCC2=O 780047267 KMDSNJXFTKMRBX-UHFFFAOYSA-N 425.510 2.460 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCC=CO1 780330062 QHTPRQMRDAQYDJ-SFHVURJKSA-N 426.496 2.434 10 20 IECD O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1ccccc1S(=O)(=O)NC1CC1 780702722 DAXWJYMTTNBNEC-UHFFFAOYSA-N 436.540 2.447 10 20 IECD CC[C@H]1CCCC[C@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785527126 ASHLBLWDMDQBDU-SIKLNZKXSA-N 430.593 2.409 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccccc1Cn1cccn1 785639610 GUDONSWAPHPKCC-UHFFFAOYSA-N 447.539 2.043 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)CN3CCCC3)cc2F)C[C@@H](C)O1 789819453 MZQQAEMTHZFMQP-HDICACEKSA-N 448.583 2.294 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Oc1cccc(F)c1 789835763 QPGMKGJHCDESSM-OAHLLOKOSA-N 447.482 2.126 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(Cl)cc(C(=O)N(C)C)c2OC)c(O)c1 793067892 MVPCGSPYOSIVHM-UHFFFAOYSA-N 435.864 2.020 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2F)cc1 793433738 WENMQZRYXBPRPI-UHFFFAOYSA-N 443.400 2.401 10 20 IECD C[C@@H]1CN(Cc2cccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CCO1 803131180 JWROXTOVJMKZCS-LJQANCHMSA-N 438.572 2.248 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 806126585 UNOLSXXKEJUETO-INIZCTEOSA-N 435.475 2.467 10 20 IECD C[C@@H]1C[C@@H](N(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1C 807770744 NVOHZBNPIWRWDG-RYRKJORJSA-N 438.519 2.314 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1 808344513 XBYWSJAXGOASEK-DHIUTWEWSA-N 442.604 2.129 10 20 IECD CCc1ccccc1NC(=O)CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917030672 JZCQELMSNSYXIK-UHFFFAOYSA-N 442.535 2.411 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncccn4)CC3)cc2F)C[C@@H](C)O1 918221696 RGBSXDVEBBPCBV-IAGOWNOFSA-N 428.512 2.261 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(N4CCCC4=O)cc3)CC2)cc1 918461874 PITYRAIPKIRACC-UHFFFAOYSA-N 436.512 2.499 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCCN(C(=O)N2CCCC2)C1 919970124 PPSJDKPYQZHYCL-NRFANRHFSA-N 428.577 2.439 10 20 IECD NC(=O)c1csc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 920602653 YMGGDIHSBMGQBW-UHFFFAOYSA-N 434.429 2.418 10 20 IECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1C[C@H](C)C[C@@H](C)C1 920636306 QRTUKXXGTGPUNG-LBTNJELSSA-N 426.535 2.450 10 20 IECD C[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F)c1ccc(N2CCOCC2)cc1 920887259 CBCCTYUHABZTEL-OAHLLOKOSA-N 435.521 2.404 10 20 IECD CC(C)CC(=O)N1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 1115858711 BFESBEFJJXAZOX-OALUTQOASA-N 448.583 2.246 10 20 IECD CNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 1116597975 SWFQWFGWYJMLCN-OAQYLSRUSA-N 445.585 2.411 10 20 IECD CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1342447054 AKWQORFCNGAAMW-HZPDHXFCSA-N 449.548 2.206 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)n[nH]2)CCO3)cc1 1781754238 VXWRCIAQNHCILS-DEOSSOPVSA-N 449.511 2.280 10 20 IECD Cc1nc(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1810870043 QIBQFQVPJSBFKE-DNVCBOLYSA-N 437.456 2.126 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnc[nH]1 1816419268 POLUSTKFBGZVFK-GOSISDBHSA-N 446.471 2.232 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)on1 1817843660 VMBYKRZELSZPOW-OAHLLOKOSA-N 426.433 2.061 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831133999 PVJHKUXETVHIAA-YOEHRIQHSA-N 449.504 2.288 10 20 IECD Cc1cccnc1CCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1841992582 SADLVBUGGDLKQO-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1cccc(CC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1842709266 ZIRRWGMFZAPVJH-UHFFFAOYSA-N 446.507 2.234 10 20 IECD CC(C)N[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)C(C)C 1843441815 DVQPMEMQVCEABT-OAQYLSRUSA-N 439.560 2.005 10 20 IECD O=C(c1sccc1Cl)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056258 WSIPCUZSGATAED-UHFFFAOYSA-N 429.976 2.079 10 20 IECD O=C(COC(=O)C1CCC1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 25458999 NXTJQIGDOBDUJU-CXUHLZMHSA-N 448.522 2.076 10 20 IECD CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 116377617 LCALYMDJESNQPC-UHFFFAOYSA-N 427.523 2.141 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 117529454 QZNGBQCYTLPVLQ-IYBDPMFKSA-N 449.548 2.336 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O)c1ccc(N2CCOCC2)cc1 726292966 IGAHZYIFSVWZFE-GFCCVEGCSA-N 438.406 2.459 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3cc(CNC(C)=O)ccc3OC)CC2)cc1 726601777 QOBXALLGZCRROE-UHFFFAOYSA-N 447.557 2.287 10 20 IECD CCCS(=O)(=O)NC1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 726716019 XRXBVISQDSBDHV-UHFFFAOYSA-N 438.594 2.167 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CC)Cc3ccc(C(=O)N(C)C)cc3)nc12 728293533 CHVSGHMLVAWARE-UHFFFAOYSA-N 425.489 2.336 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3nc(C)c(C)o3)CC2)c1 728561069 QJQGAMMJWXXUFS-UHFFFAOYSA-N 442.560 2.350 10 20 IECD Cc1nc(CN2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)oc1C 734270855 YGRRKFSSSVNHFY-UHFFFAOYSA-N 431.512 2.295 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 737110614 HADICBFDQWYIQW-MRXNPFEDSA-N 430.432 2.464 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCn2c(nnc2C(F)(F)F)C1 740470598 XNVHQPLCISJCGP-UHFFFAOYSA-N 442.417 2.123 10 20 IECD COc1ccc(C)cc1NC(=O)CNC(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 741798709 KDARTIYVEVNZEK-UHFFFAOYSA-N 431.489 2.221 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN1CCC[C@H](C(N)=O)C1 745830773 QBYBROLDENGJBV-AWEZNQCLSA-N 441.370 2.274 10 20 IECD Cc1nnc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)n1C 746366901 WOFMUPADNWBCPN-UHFFFAOYSA-N 448.527 2.224 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751137463 SBNJIBUXSUKVJQ-FQEVSTJZSA-N 432.542 2.441 10 20 IECD O=C(CN1CC(=O)N(CC(F)(F)F)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 753823473 RZSSQLJEEDYZJJ-UHFFFAOYSA-N 431.370 2.065 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1scnc1Br 757864630 AETFSWQMOOAWKM-UHFFFAOYSA-N 430.349 2.070 10 20 IECD CC[C@]1(C(C)C)NC(=O)N(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 758964674 NVUQRXCWYIPYEH-JOCHJYFZSA-N 434.537 2.149 10 20 IECD CS(=O)(=O)[C@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 764707804 JWHPFXYNIRTEJL-KRWDZBQOSA-N 431.505 2.475 10 20 IECD C[C@@H](NC(=O)NCc1cccc(Br)c1O)c1cccc(S(N)(=O)=O)c1 764756391 BHRAQVADONXNBR-SNVBAGLBSA-N 428.308 2.363 10 20 IECD C[C@H](c1nccs1)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 767015204 PKXIWEGLVPFMHJ-QGZVFWFLSA-N 447.580 2.114 10 20 IECD C[C@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCO1 770266406 REKKUNUEVWAFNP-QWHCGFSZSA-N 435.458 2.399 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3ccnc(S(N)(=O)=O)c3)c2C)c1 772424085 DALAKXIDPWTCHM-UHFFFAOYSA-N 427.482 2.485 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)N1CCSCC1 773739390 GTRZNQYABNOPOC-GFCCVEGCSA-N 442.584 2.258 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(Cl)n1 774148078 ZOYVZFSCYLRGFA-UHFFFAOYSA-N 436.871 2.099 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]3C)nc12 776607774 WUKLETIWXCLICQ-KBPBESRZSA-N 433.509 2.441 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nc4ccccc4[nH]3)CC2)cc1 778221768 QHYIUWMNQBPUDJ-ZHACJKMWSA-N 433.512 2.135 10 20 IECD Cc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CCC(CO)CC3)cc1)OCO2 781451161 ZLUDIITUKFLRHS-UHFFFAOYSA-N 425.485 2.187 10 20 IECD CC(C)(C)NS(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1F 782703008 AFLWTBLTLIPNBO-UHFFFAOYSA-N 425.434 2.353 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)cc1F 787434721 VGNPXVOLUXAFFF-UHFFFAOYSA-N 441.551 2.464 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCCNC(=O)c2cccnc2)cc1)C1CCCCC1 787624657 YYOMEKXMVNQNJW-UHFFFAOYSA-N 437.544 2.013 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(F)cc1 787638514 NKRKTXKGAXWWFN-NHCUHLMSSA-N 443.519 2.458 10 20 IECD NC(=O)[C@@H]1CCC[C@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 787840518 LKWAEDVWYAVVHN-KGLIPLIRSA-N 434.448 2.235 10 20 IECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C12CCCC2 789802482 ZBQBRTUQSVUMFS-PMACEKPBSA-N 433.524 2.133 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823174 ZFLPLZWAZBRMLG-QRVBRYPASA-N 448.583 2.436 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](OC(F)F)C3)cc2F)C[C@@H](C)O1 789824610 JVHFTQHYOLLHTM-LZWOXQAQSA-N 443.466 2.286 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3cc(C(C)(C)C)on3)cc2)CC1 790291382 RUZJPODCRDDMMA-UHFFFAOYSA-N 434.562 2.260 10 20 IECD COCc1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(C(=O)OC)c1 793879235 ANIHACOUMQKVCW-UHFFFAOYSA-N 445.491 2.324 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 793907899 DQUVHSLWZBPQDH-ZGXWSNOMSA-N 430.593 2.183 10 20 IECD CC(=O)N[C@](C)(C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797495130 QULOMBTZTMEUHA-QRQCRPRQSA-N 431.558 2.385 10 20 IECD CNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 797679724 YXOGNGMMDCVCHU-UHFFFAOYSA-N 430.480 2.417 10 20 IECD CC(C)[C@@H](CO)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806507447 MMGSFSICLPTKJL-GOSISDBHSA-N 430.528 2.006 10 20 IECD O=C(NC[C@@H]1COC2(CCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806691286 AOUQSWYQLNBANT-RBUKOAKNSA-N 432.517 2.092 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)CN(C)C 807605867 XGVPGKWSLRUGGG-JKSUJKDBSA-N 440.535 2.466 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 809660899 XINQRHPDMLCNDV-UHFFFAOYSA-N 426.473 2.135 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2cccc(Br)c2O)c1 811460075 WTMCEBMFDHQTFY-UHFFFAOYSA-N 427.320 2.366 10 20 IECD CCCc1nnc(SCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1N 813488633 ASXBOOAEMZUGJR-OAHLLOKOSA-N 438.985 2.176 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccccc3N(C)C)CC2)cc1 915744554 OYQYPCLTWKIHHR-UHFFFAOYSA-N 439.560 2.028 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 918140383 MJLXHGHUYVOMMR-HUUCEWRRSA-N 443.475 2.214 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 918221133 OBCRKRRCJRRGRW-WSTZPKSXSA-N 434.556 2.446 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1Cl 918466322 ZNLBYXIAZPTAEG-OAHLLOKOSA-N 444.919 2.305 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCCCO1 920418508 ZIQMWXWYNPLWNT-SFHVURJKSA-N 428.512 2.311 10 20 IECD C[C@@H](NC(=O)N1CCCC[C@H]1CCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 920921781 SROVIOIQGDTEAX-XLIONFOSSA-N 438.594 2.088 10 20 IECD CSc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1O 1796601543 WFIQYEFQATXCEO-BTTYYORXSA-N 429.498 2.486 10 20 IECD COCc1c[nH]c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1799200845 FKTFNZSKFUVUJA-GGPHIMKMSA-N 449.511 2.206 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ncccc1F 1811120817 CRYPHZJMYCHMLI-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1S)CC2)c1cc(O)nc(O)c1 1816720561 YIJPZWREZLDZOJ-SNVBAGLBSA-N 443.510 2.173 10 20 IECD CCc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)co1 1816724976 FNOUZHURFCZWAE-SNVBAGLBSA-N 429.458 2.039 10 20 IECD C[C@H](Cn1ccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822783505 GWEXMYDAPUZKLR-CZUORRHYSA-N 439.476 2.055 10 20 IECD COC(OC)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708109 MAQSRYKTXPPGRI-SECBINFHSA-N 441.893 2.052 10 20 IECD CO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878245 HNYIJFCHGIVXOW-DYBMROTFSA-N 432.517 2.471 10 20 IECD O=C(c1cccc2nc[nH]c12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038769 IIFSQEFYCOQFPJ-SOFGYWHQSA-N 434.452 2.210 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)Nc3ccc4c(c3)N(CC)CC4)nnc2n1 110811766 NKKVZUQMRMQYQU-UHFFFAOYSA-N 441.565 2.496 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 727612964 NYPDFYLZJYENHD-UHFFFAOYSA-N 439.484 2.422 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1 729536226 XLTOVGAPZVOHFE-MELVXUOCSA-N 437.496 2.381 10 20 IECD O=C(COC(=O)c1cc(F)cc([N+](=O)[O-])c1)NCc1ccc(N2CCOCC2)c(F)c1 731528045 SUPPXEQYXDLUGX-UHFFFAOYSA-N 435.383 2.183 10 20 IECD Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 737108874 ZWWNDHADWIYZDR-UHFFFAOYSA-N 431.512 2.239 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccccc1-n1cccn1 738897805 AYEFPABTIOHTQH-UHFFFAOYSA-N 425.514 2.429 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)c(OC)c(OC)c3)CC2)cc1 742471907 VJJWQVPTMJWONX-UHFFFAOYSA-N 449.529 2.046 10 20 IECD C[C@@H](CS(C)(=O)=O)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 744401931 BSEWTXVEBUJZHR-AWEZNQCLSA-N 440.521 2.298 10 20 IECD Cc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 746375681 AWBIKCGCOYFNSN-UHFFFAOYSA-N 439.541 2.393 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnccc3SC)cc2F)CC1 750258019 YBFGGNDJOIAPKU-UHFFFAOYSA-N 431.537 2.339 10 20 IECD CCOCCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751068950 ZPROECBLOVPDJV-UHFFFAOYSA-N 439.559 2.049 10 20 IECD CS(=O)(=O)Cc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751136906 NPUSOMWUNILDTI-GOSISDBHSA-N 439.555 2.307 10 20 IECD C[C@@]1(CCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCC(=O)N1 751513305 UEGJGNIETDLOOD-DEOSSOPVSA-N 434.448 2.393 10 20 IECD CC(C)(C)NC(=O)CN1CCN(C(=O)CN(Cc2ccco2)Cc2ccccc2O)CC1 756328145 ZMMJRPYKJMFHMC-UHFFFAOYSA-N 442.560 2.046 10 20 IECD CCN(Cc1ccccc1)S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 765170364 NRVXKQUHMBPZHL-FQEVSTJZSA-N 430.574 2.245 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl 769280213 HWUWOKMELNZDEA-KRWDZBQOSA-N 438.933 2.237 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 769649915 BZCHRKYRNJYFFC-OAHLLOKOSA-N 439.921 2.170 10 20 IECD CCC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 771202977 VDUVICWETTWHAG-SFHVURJKSA-N 436.512 2.236 10 20 IECD O=C(COc1ccccc1O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 772687038 PBDCQGMTBJPPPB-UHFFFAOYSA-N 437.475 2.343 10 20 IECD C[C@H](C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)N1CCOc2cc(N(C)C)ccc21 774753786 ONHGEMVZTWYUIB-OAHLLOKOSA-N 432.546 2.229 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCc2nnc(O)cc2C1 775775667 AERZPCTXQLERTK-CYBMUJFWSA-N 428.448 2.343 10 20 IECD COCCO[C@@H]1COCC[C@H]1NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776942851 NWPNAKNTCAUOMP-ATZDWAIDSA-N 443.491 2.377 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)c1 777961378 GKFPRQWERDADDG-NSHDSACASA-N 437.430 2.305 10 20 IECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 782781382 NOSOBZWQUHKSEW-UHFFFAOYSA-N 428.445 2.037 10 20 IECD COc1ccc(Cl)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785422064 GVHFXQYVUUIWDK-UHFFFAOYSA-N 444.963 2.375 10 20 IECD Cn1ccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1 785606295 RWRDEFRNIHQUNZ-OAQYLSRUSA-N 433.487 2.457 10 20 IECD COc1cc(OC)c(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1 788938587 SSHYJCQASYJKBZ-UHFFFAOYSA-N 427.501 2.245 10 20 IECD C[C@H](C[C@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949520 JJEMOXBTQMYOIN-HUUCEWRRSA-N 443.466 2.090 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803296961 JZLIOLRRDGHDAZ-NQIIRXRSSA-N 425.529 2.074 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@]2(CCOC2)O1 803677154 HDURNLIRJBWYBT-KOSHJBKYSA-N 429.561 2.478 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCCN1C(=O)c2ccccc2C1=O 805818909 MZUSMMWFTOSTLS-UHFFFAOYSA-N 436.512 2.351 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cc2c(cc1OC(F)F)OCO2 807098280 WQLJMWSVRQDQSF-UHFFFAOYSA-N 435.427 2.324 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 807633602 FOFAHVFYIBZRMQ-KRWDZBQOSA-N 429.492 2.204 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc5c[nH]nc5c4)n3)CC2)cc1 809465505 WXULVEGYEIWKLV-UHFFFAOYSA-N 432.484 2.437 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(CO)C[C@@H]3c3ccccc3)CC2)cc1 812016710 NWNWOCCIUQPMMO-ILBGXUMGSA-N 438.572 2.283 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c[nH]1 814533006 KGOZFOCDLILBHJ-UHFFFAOYSA-N 432.388 2.372 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)C1=O 916566152 NUUUYMBGPRNXKN-IBGZPJMESA-N 430.549 2.371 10 20 IECD COC(=O)COc1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1 917827770 KHERXRNUEURTMQ-UHFFFAOYSA-N 427.501 2.316 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)N(C)C4CCCCC4)CC3)cc2F)CC1 1116442661 KBTKXGUJNWQQMT-UHFFFAOYSA-N 445.627 2.486 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 1116510315 RJBFRMRQOHBTHU-WOJBJXKFSA-N 427.526 2.438 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1255563632 AQHLKYVLKVZLBT-CQSZACIVSA-N 449.485 2.258 10 20 IECD Cc1ncsc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005167 XGZBMAACOZDQFG-IBGZPJMESA-N 437.905 2.273 10 20 IECD CCc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)co1 1788994921 TVLHOWCIEQHLTP-BNLOLNQZSA-N 449.891 2.209 10 20 IECD CC1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1804283155 LFNYAZVSFNNKIM-AHAITQMDSA-N 443.544 2.187 10 20 IECD Cn1cc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827090571 QGOYVDDEGDKUMH-IBGZPJMESA-N 441.532 2.092 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)[C@H]1C[C@H]1F 1836369566 BHBVQTZXUTTXOC-DOTOQJQBSA-N 439.915 2.294 10 20 IECD Cc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1838031455 FFQQOEIOAFFEFE-UHFFFAOYSA-N 440.500 2.122 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Cl)s1 1848112101 HFWVIGBUDTZSEW-RYUDHWBXSA-N 444.003 2.006 10 20 IECD Cc1ncc(Br)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848324220 QPIOGTAFXRNPIK-GJZGRUSLSA-N 447.289 2.088 10 20 IECD COc1ccc(N2CCC(NC(=O)C[C@](O)(c3nccn3C)C(F)(F)F)CC2)cc1 726562724 OZSZTSPKIFKVMI-IBGZPJMESA-N 426.439 2.354 10 20 IECD CS(=O)(=O)N1CCCC[C@H]1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565461 OQICRPLXHWRRHI-KRWDZBQOSA-N 431.505 2.187 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)c(OCC(F)(F)F)c1 728143052 RURRTZNDMFQBQZ-UHFFFAOYSA-N 426.347 2.375 10 20 IECD CNS(=O)(=O)C1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 731890125 RZLWZVOYMFLMRS-UHFFFAOYSA-N 447.557 2.062 10 20 IECD COC(=O)[C@H]1CC12CCN(CC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 733795632 FAYCZVGXCDNIHE-ZIFCJYIRSA-N 447.551 2.331 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097764 XYNLCKXHZJVDHS-HKBQPEDESA-N 441.553 2.213 10 20 IECD Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 741538747 AEBALCYVPRFWEY-UHFFFAOYSA-N 447.532 2.441 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](N2CCCC2=O)C1 751067803 AQNSRHIONUBCHF-HNNXBMFYSA-N 449.554 2.482 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 760519643 CFFIUBONCUAAMO-UHFFFAOYSA-N 438.571 2.138 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 763278439 AYCULAAKUKZRIV-CQSZACIVSA-N 436.530 2.498 10 20 IECD CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 769192640 OOUBNUGWWNNKII-HXUWFJFHSA-N 446.592 2.376 10 20 IECD CCN1CCN(c2cccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)c2)CC1 770732974 GFQUIAMTKLPIBS-INIZCTEOSA-N 426.517 2.359 10 20 IECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C1CC1 770763641 HPTAOUREDPDOBU-UHFFFAOYSA-N 436.560 2.084 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3CN3CCCCC3)CC2)cc1 778257425 SAMWBEOKDJPWBP-SSSWZJSRSA-N 440.588 2.377 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C3)nc12 778983483 QQIZYBCCFARVHT-KBPBESRZSA-N 433.509 2.347 10 20 IECD C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 785295073 QNDDHOLPEOQKRI-ZACQAIPSSA-N 441.528 2.393 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(CN4CCCC4=O)cc3)cc2)CC1 786256076 QOYYNJVMTLPHGS-UHFFFAOYSA-N 434.540 2.408 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCCC1 786627544 LNBWNTBNOAYXSE-JOCHJYFZSA-N 448.583 2.295 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1 788911719 QICYPRWXFURCMP-UHFFFAOYSA-N 442.604 2.254 10 20 IECD CCN(Cc1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793732978 KFOSHMZRWRSOJG-OAQYLSRUSA-N 436.556 2.362 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 793862190 ILHIYKVTNITQBT-UHFFFAOYSA-N 441.528 2.076 10 20 IECD C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662063 GNFOGUASKMLZGC-HOCLYGCPSA-N 436.528 2.270 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 806912899 OEIGFOPRGUKHST-UHFFFAOYSA-N 437.475 2.377 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(N2CCOC2=O)cc1 807386923 QOAVBAYNIOOPPI-UHFFFAOYSA-N 434.246 2.366 10 20 IECD COCCC1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807770339 KRGBFJGJKQZBOB-OAHLLOKOSA-N 425.476 2.306 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1 807841708 IRWYMRLLOZBRIV-HXUWFJFHSA-N 428.577 2.399 10 20 IECD CS(=O)(=O)c1ccc(N(CCN)Cc2cc(Cl)cc([N+](=O)[O-])c2O)c([N+](=O)[O-])c1 809729014 OHXQNNFUWNJAJW-UHFFFAOYSA-N 444.853 2.231 10 20 IECD O=C(NCCCN1CCCC1)C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 809732520 MSCQNWSKBWVYHG-UHFFFAOYSA-N 432.584 2.476 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c1 812501241 TXJUSJPDFFKQBU-UHFFFAOYSA-N 429.539 2.067 10 20 IECD Cn1cccc1C(=O)N1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916626224 XBJTYJYQHZNIED-UHFFFAOYSA-N 427.574 2.246 10 20 IECD COc1ccc(/C=C\C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 916676321 GZHXEMNXELGNKY-POHAHGRESA-N 430.526 2.268 10 20 IECD O=C(Nc1ccc(C(=O)NC2CC2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918297332 QTTXKIQDIBRXJP-FQEVSTJZSA-N 437.496 2.431 10 20 IECD COc1ncccc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 919060229 WKZWLJVPDWQQTM-HUUCEWRRSA-N 431.464 2.316 10 20 IECD CS(=O)(=O)c1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1Cl 919878293 MYZGDRQXKGTCCF-UHFFFAOYSA-N 442.946 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCN(C(=O)C(C)(C)C)C3)CC2)cc1 920714782 DZKHKYJQLYRWMJ-GOSISDBHSA-N 445.560 2.172 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(CO)c3)cc2F)C[C@@H](C)O1 921224571 AWVCSZIFDCJROQ-HZPDHXFCSA-N 430.476 2.405 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 1325016691 PWXGEIAVLBVFPG-UHFFFAOYSA-N 439.484 2.120 10 20 IECD CC[C@H](C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786405761 CXDLSTWFWHGWAC-SCLBCKFNSA-N 449.598 2.388 10 20 IECD Cn1ncnc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc(O)c(O)c3O)CCC2)cc1 1787236510 BVOAXSNVCBDGHP-ONNFQVAWSA-N 449.467 2.393 10 20 IECD O=C(Cc1cccc(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795236981 KMFLBROIMPKKPV-YVWYUNDQSA-N 448.878 2.336 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992402 YAFRCSZGBCOWKS-FDDCHVKYSA-N 432.480 2.450 10 20 IECD CCc1nc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)co1 1807996178 ZCZZWESUGBYIMW-VLIAUNLRSA-N 437.456 2.072 10 20 IECD O=C(c1cncc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429880 VKKHWMAJZNYDKZ-SFHVURJKSA-N 426.473 2.141 10 20 IECD CO[C@@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccc1 1842671066 ONIWOADRAMXAOM-XBFAEUMISA-N 438.480 2.408 10 20 IECD COc1ccccc1CC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442531 QXXCWUKXTCURNO-UHFFFAOYSA-N 446.507 2.234 10 20 IECD COc1ccc(N2CCN(CCCNCc3cnc(N4CCOCC4)s3)CC2)cc1 237274808 RMBHBKQKVNXKRR-UHFFFAOYSA-N 431.606 2.290 10 20 IECD COC(=O)c1nc2nc(C)cc(N3CC=C(CCN4C(=O)c5ccccc5C4=O)CC3)n2n1 530430973 YXYPJXSQQJGQOA-UHFFFAOYSA-N 446.467 2.042 10 20 IECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 726712727 ALXLTNOOPAWTMT-ZWKOTPCHSA-N 432.565 2.237 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCCN(C(N)=O)C2)NC(=O)OC(C)(C)C)cc1 742751416 UNJSOKVDNKHFGN-SJLPKXTDSA-N 433.553 2.225 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)n1cccn1 742800800 SZEBEJIBBLJNTN-CVEARBPZSA-N 435.475 2.289 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1 743914516 USBPFXROSRITOW-UHFFFAOYSA-N 437.479 2.308 10 20 IECD NC(=O)CCN(C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(F)cc1 744402691 PYGHMVLXEOQEAO-HXUWFJFHSA-N 429.492 2.421 10 20 IECD C[C@H](O)CN(C)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 755440834 MFMNZMHHITVRPQ-JLATVTFTSA-N 429.361 2.490 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCO[C@H]([C@H]3CCCO3)C1)c2[N+](=O)[O-] 757425641 OZCGRJKIQXDFFQ-MSOLQXFVSA-N 436.420 2.390 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 760743368 DWEAUMMYPQDNRS-FXAWDEMLSA-N 448.564 2.347 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnc4c(c3)NC(=O)CS4)CC2)cc1 765466204 PFYNAGLATFVXNN-UHFFFAOYSA-N 441.557 2.077 10 20 IECD O=C(COc1ccccc1NS(=O)(=O)c1cccc2nonc12)Nc1cccnc1 767043059 IUULPGIPXCTEKX-UHFFFAOYSA-N 425.426 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](c4nccn4C)C3)cc2F)C[C@@H](C)O1 767114231 AEHJSPIDYDXZQF-LMMKCTJWSA-N 429.540 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)CC2)cc1F 767951276 XPDFSGWGONAOAT-MRXNPFEDSA-N 425.501 2.413 10 20 IECD NS(=O)(=O)c1cccc2c(C(=O)NCc3ccc(N4CCSCC4)cc3)nccc12 768471802 PQJDWTISLPBKDP-UHFFFAOYSA-N 442.566 2.365 10 20 IECD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 771624572 YPCLVUMFALXHQN-SFHVURJKSA-N 435.521 2.190 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCCC[C@H]1CCO 776043779 YPASBKXHOUCIJR-IBGZPJMESA-N 442.539 2.389 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 779222434 NFFFHFMZEUYOLI-LEWJYISDSA-N 448.608 2.119 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1 785872678 YFZKNCJUJAVMOG-RTBURBONSA-N 432.609 2.495 10 20 IECD COc1cc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786121625 IUMTWEJKLDEHRU-UHFFFAOYSA-N 437.949 2.496 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@@H]2CCC[C@@H]2[C@H]1C(N)=O 787333443 ZTCQOWWUDJMSKK-BQLSAVKESA-N 431.492 2.375 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnn(CCO)c1-c1ccccc1 787939429 FOCMGEKKJDNNQN-UHFFFAOYSA-N 436.512 2.424 10 20 IECD CCO[C@H]1C[C@@](O)(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 788690545 KHBAYRASDPGGIC-XUZZJYLKSA-N 448.608 2.073 10 20 IECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788912518 URWBIXBZZJZKBT-QUCCMNQESA-N 428.577 2.446 10 20 IECD Cc1cccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789799456 HQHPBEUMSLFNKD-QGZVFWFLSA-N 429.492 2.171 10 20 IECD CC[C@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818370 JNTUEZLYUUFDQW-NSHGMRRFSA-N 448.583 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(OCC4CC4)CC3)cc2F)C[C@@H](C)O1 789819158 MDXOWKPKPGCYCU-IAGOWNOFSA-N 447.551 2.473 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](n4ccnc4)C3)cc2F)C[C@@H](C)O1 789827338 SAPOPRPWHTXJEF-SCTDSRPQSA-N 443.523 2.116 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1ccc(S(=O)(=O)CCO)cc1 790199233 XFERMJJFWAXKAS-UHFFFAOYSA-N 449.598 2.005 10 20 IECD C[C@@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN(C(=O)OCc2ccccc2)C1 794228763 IHODQNBTOSONIS-OAQYLSRUSA-N 447.513 2.295 10 20 IECD CN1CCCc2cc(CNC(=O)NCCN(C)S(=O)(=O)c3ccc(F)cc3)ccc21 798098018 LAZFKHXTEDNORH-UHFFFAOYSA-N 434.537 2.328 10 20 IECD O=C(CN1CCC[C@H](CN2CCOCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 801570349 PDNZMALKTRRWTB-GOSISDBHSA-N 447.535 2.445 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@]2(CCc3ccccc32)C1)c1ccc(N2CCOCC2)cc1 803301166 NFBSZRWMTCMUSC-NIYFSFCBSA-N 449.551 2.401 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1 807103947 YKFWJRTUTGEWOC-FUHWJXTLSA-N 432.565 2.439 10 20 IECD C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C)S1(=O)=O 813057891 DFGCXLCHSYLSIN-KBPBESRZSA-N 431.505 2.474 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 815360999 FGZOJUKRLLFIQU-GOSISDBHSA-N 427.457 2.257 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3CCN(CC(F)(F)F)CC3)cc2)C1 918373318 VWRPKKSMERLQBT-QGZVFWFLSA-N 426.483 2.279 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918462171 SYPIGHNLQGMDLB-UHFFFAOYSA-N 445.541 2.166 10 20 IECD C[C@H](NC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C)c1ccc(N2CCOCC2)cc1 920887848 JCNZZKKLVPZHSH-AWEZNQCLSA-N 449.511 2.239 10 20 IECD COC(=O)c1cc(Br)ccc1N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O 920979084 UHILNSPGUZLSAS-GHXNOFRVSA-N 440.319 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCCC(=O)OC(C)(C)C)CC2)cc1 1339093025 OPLZLOSBNLXHBD-OUKQBFOZSA-N 445.560 2.480 10 20 IECD O=C(CSc1nc[nH]n1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429276 CAKXFIFIOBWTFO-UHFFFAOYSA-N 440.485 2.151 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2)c1cc(O)c(O)c(Cl)c1 1799770988 XTFIHCGQNCDFKK-YVWYUNDQSA-N 446.887 2.033 10 20 IECD CCOC(=O)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1831252038 YPSJYRLCQUJTFT-QGZVFWFLSA-N 445.516 2.069 10 20 IECD Cc1cc(C)c(OCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(C)c1 1843249106 XHAMFGAOAMWXQJ-UHFFFAOYSA-N 425.485 2.314 10 20 IECD Cc1ccccc1NCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441943 JSXNEWMHKQXSNL-UHFFFAOYSA-N 445.523 2.403 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(S(=O)(=O)N(C)C)c1C 117528333 XYNLNONGCKIMBZ-UHFFFAOYSA-N 449.548 2.459 10 20 IECD O=C(Nc1ccc(NC(=O)c2nc3ncc(Br)cn3n2)cc1)C1=S=CC=C1 623594547 DPAFAJXTUIKTNI-UHFFFAOYSA-N 443.286 2.355 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1 729066613 NNDJLTNGQSLKHR-ZDUSSCGKSA-N 427.457 2.352 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](C4OCCO4)C3)CC2)cc1 729587066 NHUWBJGEUOYDBA-IBGZPJMESA-N 432.565 2.002 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCCN3C[C@H](C)O[C@H](C)C3)cc2F)CC1 730115671 XNLAXIOVWNOLHU-KDURUIRLSA-N 435.588 2.266 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](N4CCCCC4)C3)CC2)cc1 730905335 ROQLQVJWOGEMEA-JOCHJYFZSA-N 429.609 2.477 10 20 IECD COc1ccc(N(CC(=O)c2c(O)nc(=O)n(C3CC3)c2N)Cc2ccco2)cc1F 739926063 HNZCFQXSROWVBR-UHFFFAOYSA-N 428.420 2.496 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H](S(C)(=O)=O)C3)cc2F)CC1 741086034 CIRIXFZSYSNSJV-MSOLQXFVSA-N 440.585 2.123 10 20 IECD Cc1cc(C(=O)CN(C)C[C@H]2CCCN(C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741253954 ZBUDQLGKGRFNJJ-SFHVURJKSA-N 432.590 2.198 10 20 IECD COc1ccc(N2CCN(C(=O)CC[S@@](=O)c3ccc4c(c3)OCCO4)CC2)cc1 746094285 WDIHAETVVIUZJR-SSEXGKCCSA-N 430.526 2.313 10 20 IECD COCCn1cc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 747869320 GKZNEXZJNYDUFK-UHFFFAOYSA-N 430.477 2.078 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCNS(=O)(=O)c2cccnc2)cc1 751405852 NHSDTQLCQZGHJB-HXUWFJFHSA-N 446.573 2.024 10 20 IECD COC[C@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752008617 YENPWLQOELDDFU-GOSISDBHSA-N 428.512 2.263 10 20 IECD COc1ccc(N2CCN(C(=O)CCc3c(C)nc4cc(O)nn4c3C)CC2)cc1F 753742947 YVCVNKOMERQFRZ-UHFFFAOYSA-N 427.480 2.481 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCN(c3c(F)cccc3F)C2=O)c1 756387315 JTHCIBXVFKBPIF-OAHLLOKOSA-N 426.397 2.004 10 20 IECD COc1ccc(N(C)CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1Cl 757856826 HIYCXDYMCQUJKV-AWEZNQCLSA-N 426.926 2.288 10 20 IECD CNC(=O)Cc1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759931581 NDWUATFUPJYOPM-UHFFFAOYSA-N 442.516 2.355 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1N(C)C 760539308 BNIOJBFVHGSOLI-SFHVURJKSA-N 430.574 2.241 10 20 IECD Cc1cc(NC(=O)NCc2cccc(Br)c2O)n([C@H]2CCS(=O)(=O)C2)n1 765236076 WFHXNRYBKCLVHR-LBPRGKRZSA-N 443.323 2.341 10 20 IECD CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778928782 BIGPQFYACRXBMK-XSLBHYSZSA-N 436.555 2.426 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCCN3CCC[C@@H](C)C3)CC2)cc1 787913625 WTYNSSXDPDRDHL-LJQANCHMSA-N 430.593 2.409 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCCOc2ccccc21 789840452 INSHERRJIZGJEM-HXUWFJFHSA-N 441.503 2.433 10 20 IECD CNC(=O)CNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1 800594902 LHISIBMVSPBODS-UHFFFAOYSA-N 441.557 2.037 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2cccs2)C1)c1ccc(N2CCOCC2)cc1 803305111 JVESULYCIOXYSE-APWZRJJASA-N 429.542 2.362 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807771620 WIYASSLZBGKCMZ-KRWDZBQOSA-N 438.519 2.362 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nnn1Cc1ccccc1F 815519035 JOJRDNBBNMFVTK-UHFFFAOYSA-N 434.475 2.405 10 20 IECD CC(C)C(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 917055690 UHJAAPVBQNCTRJ-QZTJIDSGSA-N 448.583 2.292 10 20 IECD COc1ccc(N2CCCN([C@@H](C)C(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 917088077 NUIWRVFPVLIJMA-IBGZPJMESA-N 440.544 2.173 10 20 IECD Cc1nc2ncnn2c(C)c1CCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971360 SEMLUJIHSOJGLE-UHFFFAOYSA-N 426.496 2.090 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]3OCCC[C@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1340897164 FBWLZOYZPMLYMM-JTSKRJEESA-N 431.558 2.425 10 20 IECD Cc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1794889196 GIHIBZDNRPIKAG-ACHSLPGTSA-N 437.525 2.496 10 20 IECD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)c1ccc(Cl)cc1 1796136528 GDBQICYBPLOFAJ-ZIKOISBGSA-N 445.903 2.153 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)C1=CCCC1 1806221838 QOMDVRWFFMMSHV-QFBILLFUSA-N 444.582 2.058 10 20 IECD Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426695 AAHYLCHIZSFKDD-GOSISDBHSA-N 425.489 2.138 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)C3CCCCC3)CC2)CC1)c1cc(O)nc(O)c1 1834988106 OOHINIXQJHOJSP-UHFFFAOYSA-N 430.549 2.258 10 20 IECD Cn1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(C(F)F)n1 1843576866 TTYAFMZBDLFXRL-GQCTYLIASA-N 448.426 2.005 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2c[nH]c3cnccc23)C1 1844144377 SMHHPRSHCHUBTH-HWKANZROSA-N 434.452 2.210 10 20 IECD CCCc1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1844979338 FTAJUGSLFNGFBP-UHFFFAOYSA-N 431.583 2.316 10 20 IECD CSC[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 475945843 IKBYHHKCSGCSJR-JFIYKMOQSA-N 431.558 2.385 10 20 IECD Cc1cc2cc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2[nH]1 737137960 FRAGSYQCWQBUFY-KRWDZBQOSA-N 433.512 2.433 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 740819335 NIVKWOSVDWULHQ-UHFFFAOYSA-N 448.541 2.021 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccnc(C(=O)N(C)C)c3)cc2F)CC1 741072328 UOHADGCJUBECJE-UHFFFAOYSA-N 428.512 2.386 10 20 IECD CN(C)c1ccc(CNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1F 742247540 KIKOTOZPWCMRBT-HXUWFJFHSA-N 439.491 2.058 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@H](CN3CCOCC3)C2)c([N+](=O)[O-])c1Br 742416056 PIWVWMKVGUGFAK-LLVKDONJSA-N 445.270 2.433 10 20 IECD CCc1[nH]c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c(C)c1C(=O)OC 742927463 RKZYJBMTBFRJNN-UHFFFAOYSA-N 428.533 2.233 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccnc3OC(C)C)CC2)cc1 742940810 YNBUKPFUHJHIJS-UHFFFAOYSA-N 427.549 2.499 10 20 IECD C[C@H](NC(=O)CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1 744384194 IOKXOFRXZKTCMG-SFHVURJKSA-N 442.535 2.088 10 20 IECD C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 746831758 HYDAWDNLXQANSO-MRXNPFEDSA-N 439.578 2.041 10 20 IECD CNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 749190515 KWOZUDSLHXLCMM-UHFFFAOYSA-N 433.350 2.360 10 20 IECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc21 765925617 JAVJAFLOMSCVDZ-UHFFFAOYSA-N 447.289 2.406 10 20 IECD Nc1nc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc(-n2cccn2)n1 771653644 KODZUNYUJRFQMS-UHFFFAOYSA-N 446.494 2.112 10 20 IECD C[C@H](NC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)c1ccc(N(C)C)cc1 773617800 FXVRERFBWQLACS-INIZCTEOSA-N 441.557 2.290 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1ccc(N(C)C)cc1 773982948 VIEBDJVSYOCUEM-GDBMZVCRSA-N 431.514 2.230 10 20 IECD CCNC(=O)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778230425 CWUFNCKXTJTRSR-SEYXRHQNSA-N 436.512 2.288 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(N4CCNC4=O)c3)CC2)cc1 778231749 GOSAJHAAHYCDKJ-MDZDMXLPSA-N 449.511 2.068 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3CN3CCCCC3)CC2)cc1 778257427 SAMWBEOKDJPWBP-VDZCTEQFSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@@H](CCO)c3ccccc3)CC2)cc1 778389923 KKXSVYQZMZSEIF-OTOIZHKDSA-N 437.540 2.482 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCNc2cccc(Br)c2)c1 779047394 WFMDDTDMYBIUFO-UHFFFAOYSA-N 428.308 2.368 10 20 IECD O=C(CN1CCOC[C@H]1[C@H]1CCCC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 784356956 WRFWARXOVKBZOW-CTNGQTDRSA-N 432.476 2.471 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 787910364 LYZBARJGFDBYLQ-NHCUHLMSSA-N 444.620 2.356 10 20 IECD Cc1ccc(OC(F)F)c(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788324332 UFRXDWUHSRNWJT-UHFFFAOYSA-N 433.455 2.366 10 20 IECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789837293 YOTCCFGLNPYYRI-KRWDZBQOSA-N 448.583 2.030 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC[C@H]1c1ccccc1 789845743 LGMFRGLTVNSKES-NRFANRHFSA-N 425.554 2.456 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12 789950004 LSOPBWYTSIXDBK-RPLLJCPNSA-N 437.462 2.319 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)[C@H](Cc4ccccc4)C3)CC2)cc1 792940957 LOLZXJURFLVAGC-RPBOFIJWSA-N 438.616 2.037 10 20 IECD CS(=O)(=O)CC1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 795255858 SJMKANOQBIHJEP-UHFFFAOYSA-N 440.521 2.157 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccc(N2CCOCC2)cc1 803304088 CSPSQOIHIPWLEX-UZLBHIALSA-N 429.542 2.362 10 20 IECD CCO[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803449117 OQWHBDVLZTUXNV-SFHVURJKSA-N 425.476 2.401 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H]1Oc1ccccc1 803687342 CAOAEJYNLXTWKK-YMPZKCBVSA-N 437.540 2.426 10 20 IECD CCOC(=O)COCCOC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 805337082 JSWYWEOVGGAPEO-UHFFFAOYSA-N 427.365 2.107 10 20 IECD COCC1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 808851503 DCIDRPUHBOFMNC-UHFFFAOYSA-N 442.604 2.110 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N2C[C@H](C(=O)NC)Oc3ccccc32)cc1 918311001 QMWHDXJAKDHQGD-OAQYLSRUSA-N 438.528 2.031 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 918461572 GLAJOXLSMLWZFN-UHFFFAOYSA-N 434.500 2.262 10 20 IECD CC(=O)c1c[nH]c(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 918910432 BMTFZJQKJOWMTD-ZIAGYGMSSA-N 431.464 2.443 10 20 IECD O=C(Cc1csc(N2CCCC2=O)n1)NCc1ccc(N2CCC(CO)CC2)cc1 919969242 ZTPRNDQEMCVCQJ-UHFFFAOYSA-N 428.558 2.338 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3ccncc3)cc2)C1 1116025960 WQSQJUVGWNHELW-GGAORHGYSA-N 435.572 2.454 10 20 IECD O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)N[C@H]1CCS(=O)(=O)C1 1335030017 CUKOMUNDKBYYNS-OCTSTCLRSA-N 442.537 2.281 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cnoc3)cc2)CCC1 1788708444 MOPLUUKBVSINTP-UHFFFAOYSA-N 430.511 2.283 10 20 IECD O=C(CCc1ccco1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794127211 KAJRXMGYISJVBM-HBCWATKFSA-N 434.876 2.180 10 20 IECD Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc1C(F)(F)F 1797200070 DEHOYRNNHAJQCZ-CLLJXQQHSA-N 438.406 2.416 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccccc1=O 1798606503 BSIPFEODILYPIF-HNKHHVNMSA-N 445.903 2.426 10 20 IECD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)ccc1O 1799554206 OAEGEVCOMXHHTL-CCWDJLKJSA-N 446.887 2.282 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccn2)C3)cc1 1799620573 TWLZQYDKVQFDRS-JHDGKUDLSA-N 445.523 2.401 10 20 IECD O=C(c1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877172 XFFCNLOGZFVWLA-SUQGKYDKSA-N 440.500 2.473 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CN4CCOCC4)CC3)cc2F)CC1 303262230 DDUDCXLKTBOHTD-UHFFFAOYSA-N 447.599 2.221 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)N3CCOc4cc(N(C)C)ccc43)cn2)C[C@@H](C)O1 543883275 FEEHVUVHCHAGPL-IYBDPMFKSA-N 442.520 2.016 10 20 IECD CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729062874 GBQCYLPTIRCHOA-HNNXBMFYSA-N 443.500 2.464 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccccc1S(=O)(=O)N(C)CCO 733040928 MIVONRVOWLTWFK-UHFFFAOYSA-N 448.589 2.097 10 20 IECD CCS(=O)(=O)C[C@@H](C)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 733341657 DCBILTMSRGXIGJ-OAGGEKHMSA-N 429.558 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3CCc4ccccc4C3)CC2)cc1 735958294 WXTRGOSELIDBIM-IBGZPJMESA-N 437.540 2.334 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](CN3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739926373 MDCCGXXPOKZKGS-LJQANCHMSA-N 444.601 2.342 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)CC2)cc1 742917446 WWXSJUYKTYDAGM-KRWDZBQOSA-N 428.499 2.208 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744399453 NJGLAYHFDSDABT-AWEZNQCLSA-N 428.510 2.156 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746272359 LZMFNBNINUYPDI-OAQYLSRUSA-N 435.528 2.227 10 20 IECD Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n(C2CCOCC2)n1 746363052 JKHDZDFPMLBTAC-IBGZPJMESA-N 442.516 2.395 10 20 IECD NC(=O)CC[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060636 MTVOFXCHEMLATJ-ZDUSSCGKSA-N 437.543 2.372 10 20 IECD CCCCN(C)C(=O)C1CCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754008852 WMBYDLUUJFDOCI-HSZRJFAPSA-N 446.636 2.149 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(CN(C)C)ccc3OC)CC2)cc1F 754213221 IHOQATMVDCRGEL-UHFFFAOYSA-N 444.507 2.192 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cc(-n4nnnc4C)ccc3F)CC2)cc1F 760893097 RJMPZSZLULKFNZ-UHFFFAOYSA-N 443.458 2.018 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C(=O)NC(C)C)cc3)nc12 767801001 XGCWRZHXXDVPJB-UHFFFAOYSA-N 426.429 2.107 10 20 IECD COc1cc(OC)cc(C(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c1 768251757 JBUAONWJTPGLNH-UHFFFAOYSA-N 425.529 2.498 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=N)CN3CCCCCC3)cc2F)C[C@@H](C)O1 768516467 CYIHHAOKNYGLIG-QZTJIDSGSA-N 449.571 2.430 10 20 IECD CCO[C@@H](C)c1noc(CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)n1 769509353 WUGNZHYWNJASFE-KRWDZBQOSA-N 433.528 2.461 10 20 IECD COc1ccc(O)c(CNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c1 769540217 HAVYZSXRNWTVSW-UHFFFAOYSA-N 428.557 2.130 10 20 IECD CS(=O)(=O)[C@H]1CCCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 770002813 ZSCBXRQHOKCSJU-HNNXBMFYSA-N 440.521 2.300 10 20 IECD Cn1nc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 773471700 BWHZJUBTSUWWJG-GOSISDBHSA-N 434.544 2.317 10 20 IECD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773747677 DCOUMXQVUXNZDE-YPMHNXCESA-N 437.474 2.198 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)c(OC)c1 774847332 WPRVTFPRHWRYGL-UHFFFAOYSA-N 431.445 2.284 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3c(ncn3CCc3ccccc3)C2)c1 775812159 WCYIKOPCERPZHR-UHFFFAOYSA-N 440.525 2.401 10 20 IECD COC(=O)CC1(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 778312209 WBJGEJIUWNVCPC-ZHACJKMWSA-N 443.544 2.282 10 20 IECD O=C(N[C@@H]1CN(c2ccccc2)C1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 782876093 JGDFBFAIXVMYAY-MRXNPFEDSA-N 443.506 2.400 10 20 IECD COC(=O)CN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1cc(Cl)ccc1O 784179401 VPLGKLGHBOPSNP-UHFFFAOYSA-N 442.877 2.403 10 20 IECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785297755 SEBJNXGKLPEDCY-AWEZNQCLSA-N 441.484 2.171 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1 785574306 NMUNUNYDOBYNIK-QHCPKHFHSA-N 438.572 2.291 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCn3c(=O)oc4ccccc43)cc2)CC1 786258805 HPHNFCZDFPDICX-UHFFFAOYSA-N 436.512 2.360 10 20 IECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(C)C 789950784 QHQIAXXMCKBFIF-UHFFFAOYSA-N 444.498 2.005 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cccs3)cc2)C1 793732555 IMZTXNBQBHSCNC-HKUYNNGSSA-N 440.569 2.430 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCC(=O)NC3CCCCC3)cc2)CC1 793758952 DAPQQJRJLDZLGP-UHFFFAOYSA-N 428.577 2.494 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)cc1 797530234 CMZXTCJYWIHPKP-UHFFFAOYSA-N 430.936 2.493 10 20 IECD COCCCN(Cc1ccncc1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803303643 RNXDKHJIIHOHKU-IBGZPJMESA-N 440.544 2.161 10 20 IECD CC[C@]1(CO)CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448588 CQFJEUOPCHXFGC-OAQYLSRUSA-N 425.476 2.137 10 20 IECD C[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1=CCN(C)CC1 803451449 LETANNSHSNSBIQ-HNNXBMFYSA-N 436.503 2.140 10 20 IECD CN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1)C(=O)OC(C)(C)C 803659531 RGAPRHGJUNZUSG-MRXNPFEDSA-N 436.528 2.223 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3cc(C)nn3C)C2)cc1F 804853275 VQEXXTJYSLKGIF-GOSISDBHSA-N 444.555 2.115 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@H]3c3nc(C)no3)CC2)cc1 804857681 HXGMRTRUHJQRTQ-CFGKVWFZSA-N 439.516 2.345 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3cnccc3C)cc2F)CC1 805007093 MUUHHKCXUWMYRG-QGZVFWFLSA-N 427.524 2.165 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 806277226 UINGUYYFGUKMEV-SJORKVTESA-N 435.571 2.093 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCc4cnn(C(C)C)c4C3)CC2)cc1 807293366 UUIGAEFRSFCEHD-IBGZPJMESA-N 439.560 2.185 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CCC(O)CC1 807767577 NNVLFSSDHOYPKP-UHFFFAOYSA-N 439.556 2.404 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C 808095752 RALWWOIJHGAQRH-QHCPKHFHSA-N 428.485 2.493 10 20 IECD CN(C)C(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 916678137 LHKDTKDPPJHJHT-UHFFFAOYSA-N 430.480 2.451 10 20 IECD CCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(N4CCOCC4)cc3)cc(C3CC3)nc21 919863014 CQGRSUAFPWKGGB-UHFFFAOYSA-N 449.511 2.161 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1 1254761174 KRCOWDIWIQOJOP-WMZOPIPTSA-N 447.532 2.052 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 1323860069 PODYGNKYJWHHPB-KURKYZTESA-N 432.517 2.117 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2 1782007822 QGLHTOTVKKNLJA-BEFAXECRSA-N 426.922 2.090 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)cc1 1802019398 QOAHUHXYZINCIY-BJWYYQGGSA-N 449.573 2.257 10 20 IECD CC[C@H](NC)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807348096 DOWZXUILQGVBJN-LJHODMEESA-N 446.935 2.464 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)cn1C 1817695316 LDGASHOMKDRGBH-ZDUSSCGKSA-N 427.486 2.136 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844537 CJDTZBUIAZZVHI-OXQOHEQNSA-N 437.456 2.255 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)[nH]n1)c1cc(O)nc(O)c1 1817846792 BKLIHUNQFUAVDE-CWMCZYRISA-N 427.486 2.397 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc[nH]n1)CC2)c1cc(O)c(O)c(Cl)c1 1823708079 JDYFLHRGBBEQSZ-SECBINFHSA-N 433.877 2.470 10 20 IECD CO/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1828801505 YURGFGQYCCBCKZ-GRNBYLDVSA-N 439.603 2.017 10 20 IECD CCC1(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CCC1 1835499242 FNVUGLWKGVMQAZ-UHFFFAOYSA-N 430.549 2.258 10 20 IECD CCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839855290 BAXJBEFHPRBSSK-NRFANRHFSA-N 440.924 2.257 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2)C1 1840971426 TVYSSBWMTDTKDH-UHFFFAOYSA-N 437.887 2.345 10 20 IECD Cc1ccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)cc2c1 1847054327 NOFBOGWVTQRCMT-UHFFFAOYSA-N 442.566 2.154 10 20 IECD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NCc1ccc(N2CCOCC2)cc1 108808675 KSEFGDMYMXALTF-RUZDIDTESA-N 448.523 2.138 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1 728985598 YWPLWPXZGKCXIO-AWEZNQCLSA-N 443.525 2.439 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 732455405 KILZTQYECLHREA-SFHVURJKSA-N 449.596 2.372 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1N1CCOC1=O 743914208 QPCCJIXCQVKSST-UHFFFAOYSA-N 426.473 2.281 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 746309026 DTWZSDZERKFKMZ-MRXNPFEDSA-N 446.445 2.139 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1c1ccccc1F 753107393 HDGOPFCWCLXPFV-NRFANRHFSA-N 444.482 2.309 10 20 IECD COc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5cc(C)ccc5n34)CC2)cc1F 753856218 BGXXCIFTTUOAKS-UHFFFAOYSA-N 436.491 2.360 10 20 IECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc(Br)cc(C)c2O)C1 754153384 GXLRZYWHBVDYAE-INIZCTEOSA-N 435.384 2.336 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(c2c(F)cccc2F)C1=O 755121645 IAHKQJVHMZGLHG-IBGZPJMESA-N 430.455 2.406 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc4c(c3=O)CCCC4)cc2F)C[C@H](C)O1 760330002 VPXGHVRVHUTAKS-HOTGVXAUSA-N 428.508 2.191 10 20 IECD O=S(=O)(c1ccc(F)cc1)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768155160 BRJCRHJRSLJZOJ-UHFFFAOYSA-N 437.512 2.308 10 20 IECD CCc1ncsc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769023079 IKQWQUIHCXTBJB-UHFFFAOYSA-N 427.574 2.492 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 774372528 UQDVUADBKPVHJR-UHFFFAOYSA-N 426.404 2.462 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2F)C[C@@H](C)O1 774499568 ZVGBIQRWNKYGJK-IYBDPMFKSA-N 448.583 2.481 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCCC3)cc2F)C[C@@H](C)O1 774815489 LHILSYMYXBULDT-QZTJIDSGSA-N 448.583 2.436 10 20 IECD C[C@@H](NCC(=O)NCC1(N2CCOCC2)CCCCC1)c1ccc(N2CCOCC2)cc1 775255154 PNPLDSLGYKUXAQ-OAQYLSRUSA-N 444.620 2.325 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 776855337 HHTKECMYCQLQSB-JRYVEOFUSA-N 439.528 2.059 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cccc2c1OCO2 782823781 WPSSOZMPBYTOJH-UHFFFAOYSA-N 436.512 2.202 10 20 IECD CS(=O)(=O)c1cccc(Cl)c1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 784075330 QGPJSFXBLYOIMM-UHFFFAOYSA-N 442.946 2.231 10 20 IECD COCCc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786120601 OULRKOQAWVOQPD-UHFFFAOYSA-N 431.558 2.023 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1 786244163 JLKKBGLQIFYXER-UHFFFAOYSA-N 444.399 2.439 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)cc2)CC1 786660985 LRKFZXCLUGLEEB-UHFFFAOYSA-N 441.444 2.410 10 20 IECD COc1ccc(OC)c(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 786684610 QMMIGGBOVRECPT-FQEVSTJZSA-N 442.512 2.276 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 787910365 LYZBARJGFDBYLQ-OYRHEFFESA-N 444.620 2.356 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788070154 IYNAZEWGENXWFX-JXFKEZNVSA-N 440.544 2.322 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3nc(C)ns3)CC2)cc1 788975109 MRPYQQUGRPFKPT-UHFFFAOYSA-N 430.578 2.048 10 20 IECD CCC(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCC1 789814098 XWLWMEWBHQUIKE-JOCHJYFZSA-N 448.583 2.295 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)Cc3ccsc3)CC2)cc(OC)c1OC 793791890 NSBSBOHTCJOPDP-HNNXBMFYSA-N 447.557 2.170 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)NC)cc2C)cc1 796699643 IVMWKYSJUBBENN-UHFFFAOYSA-N 426.517 2.221 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1 798097981 JLUBYAXRHKZNDZ-ZDUSSCGKSA-N 425.482 2.221 10 20 IECD COC(=O)c1cc(C)nc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 804365534 DECPQNZROFYYSR-OAHLLOKOSA-N 427.461 2.399 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCc3ccccc3F)cc2F)CC1 805008024 YEXWLGSPMUGMBG-UHFFFAOYSA-N 444.526 2.472 10 20 IECD CC[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807771908 YZLHHKUEJOFGOC-WBVHZDCISA-N 425.476 2.401 10 20 IECD COC(=O)c1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 815635661 HGFKDVJQZIQLDY-CYBMUJFWSA-N 447.923 2.351 10 20 IECD CCNC(=O)NCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 817253774 HLQJYEMFWHNWKL-ACCUITESSA-N 426.589 2.165 10 20 IECD Cc1cccc(N2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)c1 916995925 OZILLJFFSPXAMR-UHFFFAOYSA-N 426.536 2.409 10 20 IECD Cc1nc(C)c(-c2csc(NS(=O)(=O)c3cccc(S(N)(=O)=O)c3)n2)s1 917902471 NWROKTRSMYRTPB-UHFFFAOYSA-N 430.558 2.332 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccccc3Cn3cncn3)cc2)C1 918008061 GNVHXOHLRRRHMZ-NRFANRHFSA-N 447.543 2.028 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918439637 OGWHORHUBBSNFE-UHFFFAOYSA-N 428.464 2.000 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 918442595 KSDBDVRVPHTVJE-UHFFFAOYSA-N 448.527 2.039 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccc(CC)cc2)C1 1342433832 FOUMLWZIPVJBDG-HKUYNNGSSA-N 440.496 2.304 10 20 IECD Cc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)o1 1784667131 AKWYTHNLKUUOQY-NRFANRHFSA-N 434.876 2.339 10 20 IECD COC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)CCC1 1784869666 HPMRHBGCZBDOBT-NRFANRHFSA-N 438.908 2.154 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccccc13)C2)c1cc(O)nc(O)c1 1796137944 RQQFNNSPHPDNOK-FAQVEIGNSA-N 433.464 2.163 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1C 1796934881 YAKKQPDMGUHQJA-FNLKRUPLSA-N 433.512 2.378 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CC1 1797273376 JUQSKDLLCXTBQQ-GNXNZQSNSA-N 448.825 2.297 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(Br)c1)c1cc(O)nc(O)c1 1798697525 FTAGFZRCCCZTJR-BTTYYORXSA-N 447.289 2.216 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nccn12 1801022771 NALBQHQOEHIJPS-FJXIAYRNSA-N 448.479 2.416 10 20 IECD Cc1cc(/C=C/C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1810385664 JELKYTYWCUBXMQ-IWAYSELLSA-N 449.467 2.217 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCC1)CC2 1828242186 BWZQDYWEJJEWJZ-NSHDSACASA-N 438.600 2.106 10 20 IECD Cc1cccc(CCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1843440810 CHPVAHPXOZULJB-UHFFFAOYSA-N 445.523 2.319 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(N)(=O)=O)c(Br)c1 539530491 PEERZCPGILLUSA-UHFFFAOYSA-N 440.319 2.202 10 20 IECD CCN1CCCC[C@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729332970 FYGPGDYGGSMVTP-NRFANRHFSA-N 426.540 2.433 10 20 IECD O=C(COC(=O)c1ccc([N+](=O)[O-])c(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 731518189 VVHZISBYSFBUNW-UHFFFAOYSA-N 435.383 2.183 10 20 IECD COc1cc(C)c(CN2CCN(C(=O)COC(=O)c3cc(O)cs3)CC2)cc1OC 732352642 ARUSNOMSGGXGQT-UHFFFAOYSA-N 434.514 2.281 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)c1 739085403 ITUGWIOYKAVECZ-UHFFFAOYSA-N 440.544 2.434 10 20 IECD C[C@@H](O)C[C@@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 741081374 OTJJFRGDODROHI-IAGOWNOFSA-N 430.528 2.149 10 20 IECD CN1CCCc2cc(CNC(=O)c3cccc(S(=O)(=O)NC[C@H]4CCCO4)c3)ccc21 746889561 PLMXTCNRBDPRGH-HXUWFJFHSA-N 443.569 2.456 10 20 IECD CC(=O)c1cc(F)cc(CN2CCCN(S(=O)(=O)c3c(C)noc3C)CC2)c1O 750817907 XZXOWUVVJLBELP-UHFFFAOYSA-N 425.482 2.235 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccccc3SCC(N)=O)CC2)cc1F 753856683 DYVAOHYPVOSINX-UHFFFAOYSA-N 432.521 2.172 10 20 IECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1 761995906 PFOWZAUCZRHBQP-UHFFFAOYSA-N 426.516 2.421 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(=O)n(-c4ccccc4F)n3)cc2)C1 765648364 HLIMWZCTQDHKAX-QGZVFWFLSA-N 449.486 2.003 10 20 IECD Cn1cc([C@@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 766762806 GUQRNLYOAQMFJY-AVRDEDQJSA-N 445.539 2.318 10 20 IECD Cc1nn2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cnc2c1Cl 766812682 LBHLBTBJNLDZSO-UHFFFAOYSA-N 449.964 2.378 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnn(-c2ccccc2F)c1 768706494 BNVIWBTVRLCFRS-UHFFFAOYSA-N 441.438 2.242 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC 774730862 YVNIXWFWQUDAPO-IBGZPJMESA-N 442.512 2.276 10 20 IECD COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 776161807 UIIYRYQKPUPEFX-INIZCTEOSA-N 447.557 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)N3CCc4ccccc43)CC2)cc1 778239137 QAMIVAUCGVHYFW-ZCPJJFRWSA-N 448.567 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CCO)Cc3ccc(C)cc3)CC2)cc1 783641155 ZFRDYJGHLYZBFU-QXMHVHEDSA-N 437.540 2.230 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1 785292932 CTFUUQHJKIOBBG-CYBMUJFWSA-N 435.908 2.378 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1F 785870682 OMJLSUSALHZEAC-CALCHBBNSA-N 436.572 2.292 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3nc(C4CCC4)cs3)CC2)cc1 789405481 OLQRHFMDEYHPEU-UHFFFAOYSA-N 443.573 2.296 10 20 IECD C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812579 MMRVSEBMEVQYGY-UKRRQHHQSA-N 431.430 2.468 10 20 IECD C[C@H](OC(=O)COCc1ccnn1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792505128 YPFYNLSCHWCDSS-AWEZNQCLSA-N 447.447 2.283 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)C1 793718829 KMQFUNSZVUWELE-NBGIEHNGSA-N 438.572 2.353 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@H](Cc4ccccc4)C3)CC2)cc1 804315174 GJNCWPZVPUDCDX-HSZRJFAPSA-N 437.540 2.250 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3C[C@@H](O)c3ccco3)CC2)cc1 804319594 PUVRMZZWBLXXAV-TZIWHRDSSA-N 441.528 2.488 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 806457236 HBOUULIUBDWXSC-HOCLYGCPSA-N 433.446 2.489 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 807631622 BUXHYHQQKUKKFR-DYESRHJHSA-N 442.512 2.492 10 20 IECD COC(=O)c1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 815635662 HGFKDVJQZIQLDY-ZDUSSCGKSA-N 447.923 2.351 10 20 IECD CO[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 818540610 VXZRKNNJKWHDMR-SFHVURJKSA-N 435.458 2.256 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc(C3CC3)[nH]n2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 913345582 PILZAOHYUCXUFE-UHFFFAOYSA-N 442.497 2.382 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 916198069 HGZHNJOUTOLGHP-IBGZPJMESA-N 432.565 2.192 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc2ccccc2c1=O 917177321 MDZBUFCLURQULH-UHFFFAOYSA-N 442.516 2.318 10 20 IECD Cc1cccc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804335811 LWHOXKUIYOBJBJ-MUJYYYPQSA-N 431.583 2.416 10 20 IECD CC(C)N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(C)C 1816722846 ZLROBRJCTRUAMF-ACJLOTCBSA-N 447.561 2.198 10 20 IECD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)no1 1816726300 SMAGLCUEJIMKGR-SNVBAGLBSA-N 429.458 2.039 10 20 IECD Cc1nc(N)sc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817392376 WUZBTRSNIUDWHG-LBPRGKRZSA-N 443.489 2.183 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)sc2C1)c1cc(O)nc(O)c1 1824654089 PQCUQFGFYPGZHZ-GYHMKYFYSA-N 430.511 2.050 10 20 IECD CC/C=C(\C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435610 SEOVYCWUMHROSW-JTJFFURRSA-N 438.908 2.178 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)cc1 15224633 ISIKQNMURWTHIV-UHFFFAOYSA-N 435.484 2.123 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1c(C)nc(N2CCOCC2)nc1O 302932934 GITPAZULUIUFHV-UHFFFAOYSA-N 427.549 2.375 10 20 IECD CN(CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)Cc1ccc(N2CCOCC2)cc1 741736363 QUMQNMLPLIDVGQ-UHFFFAOYSA-N 426.473 2.032 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1 742041001 GZBXYXXDPKUVNZ-INIZCTEOSA-N 435.594 2.209 10 20 IECD CN1C(=O)COc2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 743247379 IMBCQUANDDUBQD-INIZCTEOSA-N 437.500 2.065 10 20 IECD COc1ccc(N(CC(=O)N(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)C(C)C)cc1F 744394057 YGKVLXRYKDNQNM-QZTJIDSGSA-N 442.553 2.244 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](c1ccccc1)N1CCOCC1 749131858 NJMGFYFJBHYDHA-RDPSFJRHSA-N 443.613 2.473 10 20 IECD O=C(CCn1cc(Br)cn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405925 LJLFQOBAENBTGF-UHFFFAOYSA-N 425.302 2.452 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3=O)CC2)cc1F 753889996 CBIAYOUUSHCWTN-FQEVSTJZSA-N 426.492 2.467 10 20 IECD COC(=O)c1coc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 754002988 VBSKUYCGTMWNEF-BETUJISGSA-N 426.466 2.297 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccn(Cc2ccccc2)n1 759023451 XLPNPEPSLSYAOY-UHFFFAOYSA-N 433.512 2.365 10 20 IECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 761055678 WORDTZHQDMZHIT-UHFFFAOYSA-N 425.457 2.079 10 20 IECD O=C1C[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CN1CCOc1ccccc1 761473315 CMPMDOWEAWBUOL-QGZVFWFLSA-N 443.887 2.490 10 20 IECD O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771416144 LFLJSFBMCBNZDO-AUUYWEPGSA-N 438.527 2.322 10 20 IECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1F 776044187 ZPMPJSRSOWNESA-UZLBHIALSA-N 427.542 2.207 10 20 IECD O=C(Nc1cnc2c(c1)COCC2)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 777251374 XOPFQXXKIRLBQL-UHFFFAOYSA-N 446.454 2.479 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 779222436 NFFFHFMZEUYOLI-RTWAWAEBSA-N 448.608 2.119 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C)c1ccc(N2CCOCC2)cc1 785596929 CAFGLCJMAACPKX-XMSQKQJNSA-N 447.539 2.340 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc2c1OCCO2 786255180 KQRPHCCMDDIYBE-UHFFFAOYSA-N 425.485 2.065 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCS(=O)(=O)c2ccccc2)cc1 788729725 MDURXOURMRFHQN-UHFFFAOYSA-N 431.558 2.081 10 20 IECD O=C(NCCOC1CCCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837571 ZZASPIMEYBXXDM-UHFFFAOYSA-N 435.540 2.259 10 20 IECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854818 DWSDARQHCOXEBL-SSEXGKCCSA-N 445.610 2.252 10 20 IECD O=C(NCCCCn1ccnc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793737384 ICMYKMPKLUGMTK-UHFFFAOYSA-N 435.475 2.166 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c(O)c1 797538416 HEASDICLFFJIKY-UHFFFAOYSA-N 433.892 2.141 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2cccs2)CC1)c1ccc(N2CCOCC2)cc1 803298119 PFKJIANDMKKTCF-KRWDZBQOSA-N 428.558 2.111 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(CS(C)(=O)=O)ccc1OC 806846820 YOXFNQBHVJQXSE-UHFFFAOYSA-N 447.557 2.293 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc3nccnc3c2Br)c1O 806907873 ROZJZEBTAKVOTD-UHFFFAOYSA-N 431.246 2.361 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(C(N)=O)ccc3OCC(F)F)ccc21 810358769 LGOJNLRWFWWMJK-UHFFFAOYSA-N 446.454 2.067 10 20 IECD Cc1cc(CCNC(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1 915695920 AMPJSQFCBVCLED-UHFFFAOYSA-N 446.511 2.404 10 20 IECD CC(C)(CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCOCC1 915894118 DGIWYHIFUJPCHK-UHFFFAOYSA-N 444.498 2.452 10 20 IECD CN(C)C(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918118080 UWWJIHMANHAHTF-HXUWFJFHSA-N 437.544 2.090 10 20 IECD CC(C)(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)s1 1796137435 HLQYSLCGEHLWNY-HBCWATKFSA-N 445.541 2.369 10 20 IECD Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991227 OCKPSYYJKMCUNS-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCS2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807999799 WHABBLDCZAZUBM-ZSZQSSIHSA-N 428.514 2.103 10 20 IECD Cc1ncsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722412 ZXGSDTWOKIJYOO-SNVBAGLBSA-N 431.499 2.254 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCCC12CN(C(=O)C1(C(F)(F)F)CC1)C2 1847037280 IFXIZCOHPSTLSM-HWKANZROSA-N 426.391 2.363 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 731525611 LKPOQOXTRMJHHE-UHFFFAOYSA-N 438.444 2.057 10 20 IECD CCN(CC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 734585063 NGVKVAZNFAAEQD-UHFFFAOYSA-N 435.521 2.144 10 20 IECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 737106959 FUEDMIAQMHVMCS-UHFFFAOYSA-N 443.479 2.059 10 20 IECD CCNC(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 737117010 GQDWCHGNXKHSGV-UHFFFAOYSA-N 439.516 2.262 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743974710 FRINTBCMOSETSM-OAHLLOKOSA-N 446.454 2.419 10 20 IECD CCc1cccc2c1N(C(=O)C(=O)NCCN1CCN(c3ccc(OC)cc3)CC1)CC2 746997452 UUDFVOGXKOKMRW-UHFFFAOYSA-N 436.556 2.085 10 20 IECD CCN1CCO[C@@H](C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 748457176 GXARVKSBFPRKNV-AUUYWEPGSA-N 436.464 2.053 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 748865424 WFTZQWLTGCMQRC-UHFFFAOYSA-N 433.530 2.311 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)ccc([N+](=O)[O-])c3F)CC2)cc1 752561026 DALBIZAEYIYHAR-UHFFFAOYSA-N 435.383 2.387 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNCCCN3CCc4ccccc4C3)CC2)cc1 758210774 RPYGDLVLUROOJH-VWLOTQADSA-N 438.616 2.216 10 20 IECD COc1cc(Br)cc(CN2CCN(CC(=O)Nc3cc(C)on3)CC2)c1O 768227070 FGABWUQSVWAHJU-UHFFFAOYSA-N 439.310 2.216 10 20 IECD COC(=O)CC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 769122579 QPKUHSUFEBGAIK-GASCZTMLSA-N 438.496 2.188 10 20 IECD COc1ccccc1OCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 774818461 VLWPGTNVVWOZAO-UHFFFAOYSA-N 429.542 2.060 10 20 IECD O=C(NCCc1cccs1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 775098963 IMRLRRNUGIGVJN-UHFFFAOYSA-N 426.586 2.255 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(C(=O)C(F)(F)F)CC3)CC2)cc1 775854284 LWPPYJASMFQHPZ-GOSISDBHSA-N 429.483 2.022 10 20 IECD C[C@H](c1ccccc1)N(C(=O)C(=O)Nc1cnn(CC(=O)NC2CC2)c1)c1ccc(N)cc1 783487232 VWEFNQCFJZMXEN-MRXNPFEDSA-N 446.511 2.477 10 20 IECD Cc1cc(Br)cn2cc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)nc12 785440345 YSGADEJHWFASFK-UHFFFAOYSA-N 444.333 2.404 10 20 IECD O=C(NCCCN1CCCCC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 785516892 LWYIKMVORGOFEP-UHFFFAOYSA-N 438.519 2.365 10 20 IECD COc1cccc(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788318756 HAPFRWPNWXBOMO-UHFFFAOYSA-N 425.529 2.242 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@]2(CCO[C@H]2C)O1 790369498 PXCCHKKMVAHEBS-BBYNXYBVSA-N 449.567 2.324 10 20 IECD NC(=O)COc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)c1 793843434 JCLWIQIXXXIMII-UHFFFAOYSA-N 439.512 2.234 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1C(N)=O 796870784 XBFDFIVAJVXFJT-UHFFFAOYSA-N 425.485 2.412 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)CC2)cc1 797652996 YZQINKFHVHJXBJ-UHFFFAOYSA-N 433.534 2.131 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1F 803662145 SDIIWJBFNHRLGK-HSZRJFAPSA-N 448.539 2.367 10 20 IECD COCCN(C)CCCC1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803686557 DODZTHVRYHHXOC-UHFFFAOYSA-N 444.620 2.282 10 20 IECD C[C@@]1(c2ccccc2)OC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 810025883 JNRRZSYZFQYOLI-QHCPKHFHSA-N 441.459 2.173 10 20 IECD O=C(O)COc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1Br 864009302 KNONAFDQYHKWGV-ONNFQVAWSA-N 432.273 2.198 10 20 IECD COc1ccc(OC)c([C@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918213837 UFVDVPYZWLOMHM-OAQYLSRUSA-N 447.507 2.337 10 20 IECD Cc1noc(C)c1CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918894930 WBXGVBUXXSTZOL-OKILXGFUSA-N 433.480 2.446 10 20 IECD O=C(COC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NCc1ccc(N2CCOCC2)c(F)c1 1251196620 DLOAIWOPMQMURQ-RDNZODCXSA-N 446.519 2.153 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1 1323193349 PBWDPKPWLFKRAS-UHFFFAOYSA-N 435.521 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(Cc4cccnc4)c3)CC2)cc1 1337365310 PCGMQVRWIZTUPT-HJWRWDBZSA-N 446.511 2.179 10 20 IECD CCn1nc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)cc1C 1779717513 SPCFTULHJKRWTN-OAQYLSRUSA-N 448.907 2.033 10 20 IECD CCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790242045 ISAFLWDAILPYHY-MIUNTBIASA-N 449.891 2.209 10 20 IECD CC(C)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790245199 WTXXFRXYLWPJFV-ATZCPQFDSA-N 440.924 2.158 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])o1 1792399288 QWIJALSMMDJQLJ-JHQOCODQSA-N 443.412 2.270 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccn2c1 1796579294 UNGMOCTUMYMRFE-BTTYYORXSA-N 448.595 2.113 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1n[nH]c2ccc(F)cc12 1796600733 HMAPIGFUFKDKAU-BTTYYORXSA-N 425.420 2.074 10 20 IECD CCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807990893 KNOUEISBWUMPSD-VLIAUNLRSA-N 437.456 2.072 10 20 IECD Cn1nc2c(c1C(=O)N1CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C1)CCC2 1845502046 IWLBOFNOJBYOIM-UHFFFAOYSA-N 430.892 2.104 10 20 IECD C[C@@H](NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(=O)O 210686657 OFBBDBGYYAKVRD-JMUHATKESA-N 429.317 2.240 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=S)NCCNS(C)(=O)=O)cc1 727069474 WZLSQCYCXPDWTF-UHFFFAOYSA-N 436.603 2.192 10 20 IECD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 727615148 ZYOKRRGOCXHHQP-UHFFFAOYSA-N 427.526 2.487 10 20 IECD CNC(=O)C1(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCC1 730047999 RHBZZLMGIXHWCQ-ZDUSSCGKSA-N 434.448 2.249 10 20 IECD COC(=O)c1c(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)n[nH]c1C 732525503 LNSQSSWGDBEEHP-UHFFFAOYSA-N 447.498 2.314 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 733341654 DCBILTMSRGXIGJ-HRCADAONSA-N 429.558 2.404 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c([N+](=O)[O-])c1 753809633 GYOKCFXJZKYKSL-UHFFFAOYSA-N 428.445 2.353 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(N4CCCC4=O)cc3)CC2)cc1 758223780 MOGOYKMSWZFWBP-OAQYLSRUSA-N 425.529 2.384 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(CS(C)(=O)=O)c(F)c3)ccc21 759502240 DBVFOVJZYMWZFO-UHFFFAOYSA-N 433.505 2.008 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccn(C)c4c3=O)cc2F)C[C@H](C)O1 768517996 XJBDFPGMOSSIPI-HOTGVXAUSA-N 426.492 2.409 10 20 IECD CNS(=O)(=O)c1csc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771055146 BELKQMGBVBAPQM-CQSZACIVSA-N 443.978 2.410 10 20 IECD CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)CC1 774363723 VZWGBTCTRVTQEG-UHFFFAOYSA-N 440.544 2.173 10 20 IECD CN(C)C1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCC1 774852183 CEEVRYPARLRMEM-MRXNPFEDSA-N 438.519 2.364 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3cccc(Cl)c3)cc2)C1 775131347 SJLSTPMCJKFTFA-GOSISDBHSA-N 442.947 2.017 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)C(=O)C1 777397411 WUOJJUCRTBPDPJ-UGAXZCSASA-N 445.516 2.181 10 20 IECD COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)n2)cc1 779497049 DXMFEFRMDZEIQD-QGZVFWFLSA-N 449.511 2.218 10 20 IECD CCc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1S(N)(=O)=O 783316025 HAWNHIJASWMIEZ-UHFFFAOYSA-N 446.573 2.338 10 20 IECD Cc1nc2ccccc2n1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785494907 CNOLDHJWJWFGCO-IBGZPJMESA-N 436.512 2.374 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)cc2)CC1 786658716 DEMPACKMXNNDTE-GOSISDBHSA-N 426.483 2.246 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC1CCN(C2CCCC2)CC1 787191435 HJVRCJXAHNMPMI-UHFFFAOYSA-N 428.577 2.005 10 20 IECD CC(C)(C)OC(=O)N(CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 788939942 WRRPXXWGRXCPIO-UHFFFAOYSA-N 430.549 2.419 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790551494 LQZSKLDTQPJRTM-MSOLQXFVSA-N 440.548 2.338 10 20 IECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 799773992 IPBNYSCQCOYWHJ-UHFFFAOYSA-N 436.505 2.442 10 20 IECD Cn1ccnc1[C@@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451862 ZNPBBFXFFLJRSN-OAHLLOKOSA-N 447.486 2.123 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 807769869 JIJYAHJJLOASHA-UTRMSSBJSA-N 449.498 2.447 10 20 IECD CC(C)(O)[C@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770092 YAODGFKNTWHQGT-WMLDXEAASA-N 425.476 2.135 10 20 IECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)Cc1ccc(F)cc1 807807783 IETGVTJARMKSJW-NRFANRHFSA-N 443.519 2.287 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@]4(O)CCc5ccccc5C4)n3)CC2)cc1 809465600 YEIJYLCOBOYXOK-RUZDIDTESA-N 448.523 2.346 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@H](C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 810015136 IURMDNMAJDAVJL-LPMFXHHGSA-N 434.512 2.022 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@@H](O)c3cccs3)CC2)cc1 811818437 NIWMFTYCILZRSO-NQIIRXRSSA-N 428.558 2.218 10 20 IECD CC(C)OCCONC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 812877698 DUCJZDMIRFGRHM-UHFFFAOYSA-N 432.500 2.098 10 20 IECD CCN1CCN(CCCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918207204 BHHYDANSNNGSSP-UHFFFAOYSA-N 435.588 2.004 10 20 IECD C[C@H](Cn1ccnc1)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 919966003 SHSFPNXFAGHAOH-CYBMUJFWSA-N 445.457 2.116 10 20 IECD C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 920868012 ZXEWPMXHBXXUMX-RTBURBONSA-N 440.544 2.140 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(F)CCC3)[C@H]2C1 1791859846 RZXVPQHODSWLQD-RBOXIYTFSA-N 426.872 2.237 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)N1C[C@@H]2C[C@H]2C1 1798325348 WTEAWWOHXODQFH-SYHNYVLZSA-N 433.936 2.343 10 20 IECD Cc1cccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340550 VDBOVJGJVCWRQH-BTTYYORXSA-N 435.546 2.246 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C(F)(F)Cl)[C@@H]1c1cccnc1 1813211276 HMXSCGHVIAXTOU-NHYWBVRUSA-N 426.807 2.039 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1 1815542639 LJESSTQSUJBKDS-JTQLQIEISA-N 431.346 2.422 10 20 IECD Cc1nc(C)c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)o1 1820575715 UDRHQOJZZVGWTA-NSHDSACASA-N 429.458 2.094 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874682 DNIHICFFKWNORP-GYBSMXBJSA-N 446.544 2.453 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 728025163 YTEFSXSNNKQNDM-SRCYJKJOSA-N 446.617 2.191 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 728758092 UQTXWZRAHQFVNC-UHFFFAOYSA-N 429.448 2.012 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1 729066846 QRFHFRHXHSFTLV-AWEZNQCLSA-N 447.513 2.001 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1c(F)cccc1-n1cccn1 730385839 JDRKDSJBYVKLAQ-UHFFFAOYSA-N 441.438 2.242 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(c4ncccc4C(N)=O)CC3)cc2)CC1 734274909 FATALIPNADRVEB-UHFFFAOYSA-N 436.560 2.449 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c1O 737285564 HYXJMKOARPIMGT-UHFFFAOYSA-N 432.908 2.061 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)CC2)cc1 740757713 WJZRQNYPERBSAS-UHFFFAOYSA-N 435.528 2.444 10 20 IECD CC(C)[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCC1 741012202 KWZKRHVTYQDSJW-QFIPXVFZSA-N 435.540 2.332 10 20 IECD CC1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@H]4[C@H](C3=O)[C@H]3CC[C@H]4O3)cc2)CC1 742650171 XBROKJZQNSRWKO-UGESXGAOSA-N 425.529 2.092 10 20 IECD CCN(CC(=O)Nc1cccc(S(N)(=O)=O)c1)Cc1cc(Br)ccc1O 744426299 QUKKXOMGXDOLGY-UHFFFAOYSA-N 442.335 2.263 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)cc1 749631096 CDNFGUFJWSZEEN-UHFFFAOYSA-N 446.573 2.476 10 20 IECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c([N+](=O)[O-])n1 754791540 ITLFECYSINYTNG-BETUJISGSA-N 441.485 2.042 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](c3ccccc3)c3nccn3C)CC2)cc1 758200487 ZGLVYPAYDUYBRP-UPVQGACJSA-N 435.572 2.291 10 20 IECD COc1cc(N2CCN([C@H]3CC(=O)N(Cc4ccccc4)C3=O)CC2)cc(OC)c1OC 758822650 UVSQUJRQPUFXAR-IBGZPJMESA-N 439.512 2.162 10 20 IECD COc1cc(N2CCN(Cn3nc(-c4ccccc4)oc3=O)CC2)cc(OC)c1OC 758966607 YIDVKWHPFIKPBK-UHFFFAOYSA-N 426.473 2.309 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n(-c2ccc(F)cc2)n1 761899277 XBASESGMAMTRBR-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COC(=O)[C@@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767879715 BGBNRRFNIYNHAN-REWPJTCUSA-N 445.535 2.130 10 20 IECD NS(=O)(=O)c1ccc(N2CCN(Cc3cccc(Br)c3O)CC2)cc1 768251355 BJNOWFURRTVSIY-UHFFFAOYSA-N 426.336 2.124 10 20 IECD C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769857292 FXYQDVZSMFQKAX-NWDGAFQWSA-N 446.572 2.148 10 20 IECD C[C@@H](NC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(N(C)C)cc1 775404276 MJFHRLGKGJADGH-IIBYNOLFSA-N 435.528 2.480 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3nc(C(F)(F)F)n[nH]3)cc2F)CC1 776134280 FNAMQZFYGMKFLT-UHFFFAOYSA-N 429.422 2.104 10 20 IECD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(Cc2cc(F)ccc2O)CC1 778999795 JUZUXEFTFFYQQS-UHFFFAOYSA-N 426.466 2.034 10 20 IECD Cc1ccc(C(=O)N2CCCN(S(=O)(=O)c3cccc4cnccc34)CC2)c(O)c1O 780927990 CPUGGPALUMNADN-UHFFFAOYSA-N 441.509 2.491 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 785438247 BASIZCHVTLADTF-QGZVFWFLSA-N 430.499 2.428 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cnn(-c2ccccc2)c1)c1ccc(N2CCOCC2)cc1 785973212 VSBAGHIUDAYFRL-SFHVURJKSA-N 433.512 2.203 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc(N2CCOCC2)cc1 787297743 KJYWJEMQCRYMPN-LJQANCHMSA-N 447.539 2.262 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)CC2)cc1 788894372 YASMMRNOTCIRBT-UHFFFAOYSA-N 448.564 2.153 10 20 IECD CC(C)COC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccco1 789797635 CCQZXSQWUGMYRX-IBGZPJMESA-N 447.507 2.402 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)cc1F 803648715 YZGQMVUUUUYTPG-HXUWFJFHSA-N 426.536 2.189 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)c3ccncc3)cc2F)CC1 805008648 POBOILBWSSBPRS-QGZVFWFLSA-N 427.524 2.198 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCn2c(nnc2-c2ccccc2)C1 806279077 DHYDVTVHUADNPG-UHFFFAOYSA-N 428.543 2.042 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1nc(C2CCOCC2)cs1 806844490 YIARXIYHWWBQPU-UHFFFAOYSA-N 448.520 2.268 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)O[C@](C)(c4ccccc4)C3=O)CC2)cc1 809210196 SBPYFZSEVCWICD-HYBUGGRVSA-N 439.512 2.072 10 20 IECD CO[C@@H](C)c1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 809331701 JLYWAWUSDVTILK-WMLDXEAASA-N 433.530 2.380 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2ccnn2)cc1 809613253 PLYJTRXJRITCSX-DYESRHJHSA-N 449.511 2.358 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC3CCN(CCN(C)C)CC3)cc2F)C[C@@H](C)O1 918205212 JKWFZQAXRAYINN-QZTJIDSGSA-N 435.588 2.265 10 20 IECD COC(=O)CC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 918742105 VVWQAHQGRNYLGB-CALCHBBNSA-N 435.540 2.331 10 20 IECD Cc1cc(C)n(CCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 919699510 OVBPYPDVGRHSAZ-UHFFFAOYSA-N 437.523 2.462 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@@H]3CCCO3)CCC2)cc1 1792316142 SKPKFOCLNCEJKO-HNNXBMFYSA-N 433.555 2.160 10 20 IECD CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1799768881 FLGFSGMOHMPNEC-IVWMJMPLSA-N 448.907 2.115 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c(C)n1C 1811235642 BCAKGAJFSOEGCN-JTSKRJEESA-N 449.511 2.477 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C(F)(F)Cl)[C@H]1c1cccnc1 1813211280 HMXSCGHVIAXTOU-XHDPSFHLSA-N 426.807 2.039 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccco2)CC1 1825773829 WLIQZWPDFWBMOG-OAHLLOKOSA-N 435.571 2.373 10 20 IECD Cc1cccc2cc(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)[nH]c12 1847056543 QMEAFXRIFPBNJK-UHFFFAOYSA-N 442.566 2.154 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)n(C)c2ccccc12 472784226 FTORSLRFGSGYDT-UHFFFAOYSA-N 448.523 2.143 10 20 IECD CCCC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 726235101 UOYZDEHFFQEBIH-VQTJNVASSA-N 443.592 2.226 10 20 IECD COC(=O)[C@H](C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 726843435 DYTLRPQVROOCMF-IKGGRYGDSA-N 435.540 2.329 10 20 IECD CN(CCO)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc1 728314905 ZJLKVRXCRZRUOM-UHFFFAOYSA-N 431.558 2.220 10 20 IECD CC(C)(C)CN(CCO)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 730120643 SNGVQXFUIDADAB-UHFFFAOYSA-N 444.555 2.492 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cc(F)c(F)cc43)cc2F)CC1 730391306 LZQODVANVBVAIF-UHFFFAOYSA-N 446.473 2.451 10 20 IECD Cc1cc(C(=O)N2CCN(CC(=O)Nc3nncs3)CC2)c(C)n1-c1ccc(F)cc1 733877583 YLRIBNUJAHYIQW-UHFFFAOYSA-N 442.520 2.481 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NCc1ccc(N(C)C)cc1C 734405813 LNZIPUWDHWVKLH-UHFFFAOYSA-N 447.557 2.021 10 20 IECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cn(C)c(=O)n(C)c3=O)c2C)c1 735154465 YHRUERGTQMLJKK-UHFFFAOYSA-N 441.509 2.253 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3c(C)nc(SC)nc3O)CC2)cc1 742920696 MKAZOUATJYZWML-UHFFFAOYSA-N 445.589 2.092 10 20 IECD CCOc1cccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 742994135 LVCQIOOCRLKCFZ-UHFFFAOYSA-N 449.602 2.335 10 20 IECD CCOC(=O)Cc1nnc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 752342444 MQWFZUBCUSOWKX-UHFFFAOYSA-N 433.534 2.174 10 20 IECD CCOC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754214113 YTVGNGXIBYCZAF-UHFFFAOYSA-N 429.448 2.298 10 20 IECD CCc1c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnn1CC(C)C 757161045 QUEKHPSMAAVIDY-UHFFFAOYSA-N 445.539 2.457 10 20 IECD COc1cc(N2CCN(C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)CC2)cc(OC)c1OC 759222912 MOVABTXJPQSKEB-UHFFFAOYSA-N 447.492 2.173 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 763279563 MLPQCCLCPVNGMA-BZUAXINKSA-N 448.541 2.257 10 20 IECD O=C(NCC1(CO)CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771612160 NKCHCPRXASHYAU-UHFFFAOYSA-N 449.485 2.384 10 20 IECD Cc1noc(C)c1S(=O)(=O)NC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCCC1 773745005 HKAALLOPCUSGOI-LBPRGKRZSA-N 437.518 2.041 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)C2CC2)cc1 774154413 HUUXRMCOQVIPHO-SFHVURJKSA-N 448.523 2.088 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 776492543 ZORTUGMAUSCVBX-UHFFFAOYSA-N 445.541 2.307 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N=c3cc[nH]cc3Br)cc2)C1 780624961 RXZMOFCWIRHUDL-AWEZNQCLSA-N 432.322 2.289 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(CCO)C(C)(C)C1 781960430 JDRGGZRARZCGHN-INIZCTEOSA-N 435.524 2.178 10 20 IECD CNC(=O)[C@H]1CN(C(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)c2ccccc2O1 784109552 VMXIPBRFTGUPAZ-OAQYLSRUSA-N 436.512 2.332 10 20 IECD C[C@H](CN1CCCCC1)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787752926 WPRYNOPFAWUGCZ-IAGOWNOFSA-N 438.519 2.364 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cc1 787976131 DHDRHHHJGHZEOP-QHCPKHFHSA-N 438.572 2.339 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788912806 YMWIRGDHCFQGFN-QGZVFWFLSA-N 430.549 2.276 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H](C)N3CCC[C@@H](C)C3)cc2F)C[C@@H](C)O1 789823695 FCSIPECICMXXOI-HCXYKTFWSA-N 448.583 2.292 10 20 IECD CCc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cs1 789827595 SVVXRWTVKLUGOZ-HUUCEWRRSA-N 448.564 2.433 10 20 IECD CCS[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793727926 WMYPGSSGSACZMM-DFQSSKMNSA-N 446.617 2.185 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cccs3)cc2)C1 793732557 IMZTXNBQBHSCNC-MJGOQNOKSA-N 440.569 2.430 10 20 IECD COc1ccc(NCc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N1CCOCC1 796392304 BXJQSSCEKPGXBP-UHFFFAOYSA-N 447.557 2.165 10 20 IECD CCOCCS(=O)(=O)NCC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800571644 LUHZXUOYQRSVFB-HNNXBMFYSA-N 431.986 2.148 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccncc3)CC2)cc1F 804853150 LJNXKMOIVFBZCR-UHFFFAOYSA-N 427.524 2.028 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ncc(C)s3)cc2F)CC1 805006693 BNEQKDUOBAHJBF-HNNXBMFYSA-N 433.553 2.226 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccncc3)cc2F)CC1 805006871 IPOWMOYHZUKTDT-NRFANRHFSA-N 439.535 2.343 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 807097498 OYVINCFHYRSXNB-QFBILLFUSA-N 432.565 2.439 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1F 810406289 JONKMMDHZQNJQM-UHFFFAOYSA-N 443.200 2.474 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)c(COC(C)C)c1 811705560 VIOKOCKXKGSZAM-UHFFFAOYSA-N 428.532 2.416 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918006071 DGYLVJHZLAQAOD-UHFFFAOYSA-N 432.546 2.025 10 20 IECD O=C(CSc1ccc2c(c1)OCCO2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334586 ITXLOQFMUKWSAF-UHFFFAOYSA-N 448.566 2.101 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(CN(C)C)ccc3OC)CC2)cc1 918462506 VYYHFOMABJWTCI-UHFFFAOYSA-N 440.544 2.443 10 20 IECD COC(=O)CC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918742106 VVWQAHQGRNYLGB-IAGOWNOFSA-N 435.540 2.331 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C2CN(C)C2)CCO3)cc1 1781755745 SAQMIQQLJJAABG-RUZDIDTESA-N 436.556 2.099 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)ccc(F)c1F)c1cc(O)nc(O)c1 1793881779 RJHZQEYVWGZFEB-CLLJXQQHSA-N 435.402 2.405 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1C[C@]1(F)Cl 1796935109 WPELSKYJBYISPQ-IFFVWNJCSA-N 432.883 2.342 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1cc(O)nc(O)c1 1800525046 KIBIFHKLBIRYJG-QDMKHBRRSA-N 430.392 2.106 10 20 IECD Cc1nnc(CCC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)s1 1807081786 LMQOCWAFXYZEFP-UHFFFAOYSA-N 445.545 2.130 10 20 IECD CCc1[nH]nc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1F 1810543076 RZEZRXIPUAUJTI-UHFFFAOYSA-N 431.468 2.076 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1cc(O)nc(O)c1 1817843441 OKYWCJRBQHFPMD-AWEZNQCLSA-N 426.408 2.370 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3ncon3)sc2C1)c1cc(O)c(O)c(Cl)c1 1821027747 GFOGNQGIPUNFBQ-QMMMGPOBSA-N 435.849 2.130 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1 727362917 WGZIDYUNXSIDPY-UHFFFAOYSA-N 432.549 2.362 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 731453988 KSOZNQHHNACLGP-UHFFFAOYSA-N 440.435 2.206 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 731899896 VJMHYZMXEIDGBW-UHFFFAOYSA-N 446.573 2.434 10 20 IECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CN3CCC(=O)NC3=O)c2C)c1 733560798 PROXIJBNKUZVGR-UHFFFAOYSA-N 429.498 2.484 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1ccc2ccccc2c1 737245271 FZWXHFYHFULAPG-UHFFFAOYSA-N 437.521 2.330 10 20 IECD Cc1cc(C(=O)CN2CCO[C@@H](C(F)(F)F)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739923698 WOHBSLCIHCVMFJ-GOSISDBHSA-N 445.463 2.187 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1NC(=O)OC(C)(C)C 740928756 SHSFGKNMUQFMFD-DOMZBBRYSA-N 427.523 2.139 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 749106721 SGPZGVBFPGZEJE-UHFFFAOYSA-N 440.543 2.499 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1 754425606 XMOGBNAJKIGMTP-XOBRGWDASA-N 438.484 2.128 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cncc(Br)c3)CC2)cc1F 757200263 RTGKPKYEYIBAIH-UHFFFAOYSA-N 437.269 2.279 10 20 IECD COc1ncc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C(N)=O 762569895 PUYBKABUSMMQRA-UHFFFAOYSA-N 448.482 2.009 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCS[C@@H]4COCC[C@H]43)cc2F)C[C@@H](C)O1 767904469 DUXZKIVKONFRIX-VAKZPMALSA-N 437.581 2.262 10 20 IECD CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785304636 RNFPVEQJSMKIND-HNNXBMFYSA-N 443.500 2.031 10 20 IECD CCOC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 787364134 NSEVYRMSCREGCI-BBWFWOEESA-N 435.540 2.472 10 20 IECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCCCSc2nccs2)CC1 788008294 OILZPUNOUNMTHT-UHFFFAOYSA-N 426.608 2.285 10 20 IECD C[C@@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)(N(C)C)C1 789862459 TWFCESNHYFAKFJ-WZONZLPQSA-N 432.634 2.483 10 20 IECD CC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)[S@@]1=O 796365869 IXCFOZRYVAGKNB-MFWLGMASSA-N 439.597 2.287 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(N(C)C)cc1 803136195 YYQXOPXJKVXZBH-KKSFZXQISA-N 438.528 2.364 10 20 IECD O=C(CN1CC[C@H](C(=O)N2CCCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 805813974 KVBIBCRVTYLURY-INIZCTEOSA-N 431.492 2.345 10 20 IECD COC(=O)C[C@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 808295266 RZZPGJLEWKLMEQ-MRXNPFEDSA-N 429.496 2.148 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@H]1[C@H]1CCCO1)c2[N+](=O)[O-] 808902509 MXKIAVPTBAGSDW-ZWKOTPCHSA-N 436.420 2.390 10 20 IECD CN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CN(C(=O)OC(C)(C)C)C1 812011354 ZOGKOVVGXGCBBS-KRWDZBQOSA-N 445.564 2.149 10 20 IECD COc1ccc(CNC(=N)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC 849070692 UFYVSOKXYWPEDC-GOSISDBHSA-N 425.533 2.220 10 20 IECD Cc1[nH]c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1C(=O)OC(C)C 916676179 BIZFLCRPHZHPDZ-UHFFFAOYSA-N 447.557 2.362 10 20 IECD COc1ccc(OCCN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917030048 TWSRRZHGPAVIBT-UHFFFAOYSA-N 431.508 2.298 10 20 IECD C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918672750 KSMCRRJPNYJSMY-MAUKXSAKSA-N 442.947 2.476 10 20 IECD O=C(COC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)NCc1ccc(N2CCOCC2)c(F)c1 918786643 GHROTQVQLKXXCK-JWTNVVGKSA-N 432.492 2.217 10 20 IECD CCCC(=O)N1CCCC[C@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919620519 WSUBMMWTRRPUBY-FQEVSTJZSA-N 449.523 2.003 10 20 IECD COCCOc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920924617 AZHDUFLPXXBRFU-KRWDZBQOSA-N 427.501 2.364 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1[N+](=O)[O-] 1796604482 LGWBGXUOMGGABK-BJWYYQGGSA-N 440.456 2.204 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803978629 ORXUOJBLVQGREL-MQBPBFNCSA-N 441.459 2.276 10 20 IECD O=C1CCc2ccc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)cc21 1845624250 HCFSFAPTGSZPQS-RMKNXTFCSA-N 448.475 2.463 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)COc3cccc(C(C)=O)c3)CC2)cc1 23474588 LUHMVEAHXIBPDP-UHFFFAOYSA-N 426.469 2.169 10 20 IECD CCN1CCC[C@H]1CN1C[C@H](C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1=O 729627512 MPAQGMQVROAKKJ-NQIIRXRSSA-N 428.577 2.113 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1 733360334 IQJNAFSMLIXTNE-UHFFFAOYSA-N 433.530 2.458 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc4c(c3)CCCN4C)CC2)C1 746985361 NDYGSHUSBQHHBV-PMACEKPBSA-N 441.620 2.401 10 20 IECD COC(=O)c1coc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 754001930 LITZCCKOHMWKIH-UHFFFAOYSA-N 448.419 2.400 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2ccccc2C)c1C 754643464 ZHUXNNNHUPHMIH-IBGZPJMESA-N 445.585 2.210 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3noc4ccccc34)cc2)C1 760540082 YVLDAEZSOINZPK-MRXNPFEDSA-N 428.514 2.149 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@H]1N1CCN(C)CC1 764352237 SOYIDWWEKMLZFB-DENIHFKCSA-N 431.650 2.407 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)cc2)C1 765886905 VWKHHHDRGHRXOV-GHTZIAJQSA-N 441.576 2.121 10 20 IECD C[C@H](O)C[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770088399 IHYYAYZFAZRBIL-ZFWWWQNUSA-N 449.485 2.477 10 20 IECD CN1CCC(N2CC[C@H](N(C)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)CC1 771767577 BLIPKLHMUGIQFI-FQEVSTJZSA-N 447.599 2.097 10 20 IECD CCC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 772921428 PNOQFCKBJNGRBD-SFHVURJKSA-N 429.542 2.460 10 20 IECD Cc1nn(C)cc1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 773884480 HJAXWFWAEZKXAC-UHFFFAOYSA-N 445.457 2.073 10 20 IECD COc1cccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)c1OC 774858263 NSIGGKDQOWBAFJ-UHFFFAOYSA-N 431.445 2.284 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 778246824 LPRCGWWLTLQGRR-BEOQOTJZSA-N 442.604 2.383 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H](O)[C@H](O)c1nc2ccccc2s1 779486239 SUHXSEHDDJCOMX-RTWAWAEBSA-N 441.553 2.216 10 20 IECD Cc1cc(=O)n(C)cc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 781973210 SRKYGROJMXNBKS-UHFFFAOYSA-N 434.443 2.019 10 20 IECD COCCn1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(C)n1 782412824 FCMBJGNYFMMCQT-UHFFFAOYSA-N 447.447 2.409 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cc1 785295096 RDJPNXLQXAOAOY-INIZCTEOSA-N 440.544 2.314 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 785297622 QMZCKBBZXOBJET-AWEZNQCLSA-N 434.452 2.431 10 20 IECD CC(C)(C)Oc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788311498 WKNHKUVMMMXSLE-UHFFFAOYSA-N 426.517 2.028 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1nnc2n1CCOC2 791695594 LMNBTMKTRXEVBK-UKTHLTGXSA-N 449.583 2.168 10 20 IECD CC[C@@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 792210616 OOCDLHYVSDTTCR-CRAIPNDOSA-N 440.548 2.119 10 20 IECD CC1(C)CCC(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793722955 MAAXLVPFLHUSAH-IBGZPJMESA-N 428.577 2.337 10 20 IECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC12CCC2 793723472 XAJFFPPCQCCHDO-PKOBYXMFSA-N 426.561 2.043 10 20 IECD CCOC(=O)[C@]1(COC)CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 798372903 PRMQKBDPXZMPSG-JOCHJYFZSA-N 437.512 2.164 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccc(OC)c3)cc2F)CC1 805006496 UVDCDFXCQQKWLJ-UHFFFAOYSA-N 442.535 2.251 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 807372874 NJDKHSKRUBYSEN-DLBZAZTESA-N 431.558 2.217 10 20 IECD COCCN(CCN(C)C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807955263 RCMHBQUWFHMFSY-KRWDZBQOSA-N 439.000 2.229 10 20 IECD O=C(NCc1cccnc1OCC(F)F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809633875 VLVGYCHMXDPNOO-KRWDZBQOSA-N 449.454 2.255 10 20 IECD C[C@@H](OC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(N)=O 913364036 VSEJISZLVYKZSM-QKNMJKLUSA-N 429.317 2.067 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)cc1C 917355844 JYLATXMJENHXCH-UHFFFAOYSA-N 432.542 2.474 10 20 IECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccc(N(C)C)cc2)c1 921069169 RAMOHAZLAKFRNZ-FLIBITNWSA-N 434.514 2.435 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cnoc1 1778165530 MPFNQCQDFUTAAG-OXQOHEQNSA-N 435.864 2.181 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)ccc1F 1800453084 XEBZDYKJBDNEHK-QDMKHBRRSA-N 435.546 2.246 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2CC(=O)C2)cc1 1802009816 VGROMDSIJTYTEJ-JHDGKUDLSA-N 435.524 2.276 10 20 IECD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)COC1 1814559664 OJMDINBQGTUWRT-VFADXPBXSA-N 442.472 2.269 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)[C@@H]1C=CCN1 1817985848 BBZZYUKDTJRICS-DZGCQCFKSA-N 431.880 2.308 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nonc2c1 1818550781 ZKRKFURSXIRDIF-INIZCTEOSA-N 449.427 2.372 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccnc(N4CCOCC4)c3)CC2)cc1 110461580 UCTYZOCSXNEPPS-UHFFFAOYSA-N 425.533 2.395 10 20 IECD CC1(C)CN(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 726098439 BQYSVLZGZHMHGX-UHFFFAOYSA-N 444.498 2.452 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726726353 LBJMZENBTUGKNR-UHFFFAOYSA-N 446.454 2.419 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OC(F)F 727176585 MSKAQOSLMHEUCX-XYOKQWHBSA-N 438.499 2.047 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2C)cc1OC 734468182 PLHNCKFZQORXQM-UHFFFAOYSA-N 435.546 2.063 10 20 IECD CCNC(=O)N1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 741804099 OBHIBBKFRKKBSH-HNNXBMFYSA-N 434.496 2.136 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOc2ccc(Br)cc2)c1 744373292 KJVVSRFYNZEQHC-UHFFFAOYSA-N 429.292 2.335 10 20 IECD CC1(C)CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 744422013 ZLMHEEMSGZXJTM-YVLHZVERSA-N 447.582 2.465 10 20 IECD CO[C@@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 745738093 SRUFZQVWRNYZFT-FQEVSTJZSA-N 430.528 2.413 10 20 IECD O=C(NCCCNc1ncccn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748024575 QZWOOJCCFKTISP-UHFFFAOYSA-N 433.515 2.277 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1 748860797 ZYUIEHWNECCQCR-HNNXBMFYSA-N 431.514 2.046 10 20 IECD CC1(C)C(=O)Nc2ccc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 751229099 SZBSEZXMAXYASU-UHFFFAOYSA-N 447.532 2.495 10 20 IECD COc1cccc(CNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)c1O 751309226 JLPRZVUJIVHGEK-UHFFFAOYSA-N 428.532 2.176 10 20 IECD CCN(CC)CCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 757968601 XNMVUZQOGQONEG-LJQANCHMSA-N 432.590 2.460 10 20 IECD Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1S(N)(=O)=O 761984130 XAXHEPIHRXPSIU-QGZVFWFLSA-N 437.949 2.396 10 20 IECD CC(C)C(=O)NCCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 765233572 MQDRVVQULIVFKB-UHFFFAOYSA-N 425.532 2.147 10 20 IECD Cc1cc(C(=O)COC(=O)C2SCCS2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 768586231 KYJXVNDWCKNSAP-UHFFFAOYSA-N 440.568 2.274 10 20 IECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(Cc2ccccn2)nn1 771062506 ACWUZDOJQRKCNQ-SFHVURJKSA-N 426.908 2.475 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 774961641 HHOMEBUBQCTVHI-QHCPKHFHSA-N 436.556 2.093 10 20 IECD Cc1cc(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1S(N)(=O)=O 775226743 VCUPPIZCOMHHGS-MRXNPFEDSA-N 432.546 2.039 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H]1CCCOCC1 776321153 GTBIHGNSMNPILS-GOSISDBHSA-N 428.512 2.311 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)cc1 784562933 BAAXMQADQROZDF-UHFFFAOYSA-N 438.488 2.214 10 20 IECD C[C@@H](OC(=O)C(C)(C)S(C)(=O)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785990803 CJDYZGHKUVENAV-GFCCVEGCSA-N 443.477 2.155 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(N2CCOCC2)cc1 787639434 OWHFURHBYNKHKY-VGSWGCGISA-N 442.535 2.259 10 20 IECD CCCc1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 789383299 VWQIFMFWKBHDQR-HNNXBMFYSA-N 429.546 2.052 10 20 IECD CCCN(CCc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843370 JPOUYYIVNZRZGV-UHFFFAOYSA-N 442.535 2.279 10 20 IECD CN(Cc1cccnc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950783 QHKCRKISURYJHV-UHFFFAOYSA-N 436.434 2.212 10 20 IECD CCN(CC)C[C@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793789304 GAGJYIOCDHKXEC-HNNXBMFYSA-N 426.508 2.220 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)CC2)cc1 795120886 JVKGISQKJFITHV-SJBKTWHCSA-N 446.636 2.145 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803296744 GUFBJRDAPZNFRB-FQEVSTJZSA-N 442.604 2.425 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298153 QDWNTHQZNRRXNS-CVDCTZTESA-N 437.540 2.171 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(C2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803310057 DBNFOAICCSCXIQ-LJQANCHMSA-N 428.577 2.177 10 20 IECD CCN(CC)c1ccc(CNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1F 805095674 YZDGHMHXLOPZLF-HNNXBMFYSA-N 442.479 2.293 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)nc1 806279549 RSHMASQTZKJQSU-UHFFFAOYSA-N 447.586 2.322 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 808094426 ODINRBOPPZZSQW-UHFFFAOYSA-N 439.530 2.137 10 20 IECD CC(C)CCN1CCC(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 808837257 MPPKNPLBPPIWTM-UHFFFAOYSA-N 444.620 2.356 10 20 IECD CN(C)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)cn1 811822439 HZCLVQFJZIYPJL-UHFFFAOYSA-N 428.503 2.048 10 20 IECD COC(=O)c1cnn(C)c1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 815406607 NYRQGYXPZWDQRC-UHFFFAOYSA-N 439.472 2.033 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)CCOc3ccccc3C(C)=O)CC2)cc1 912939529 NPPAYOXPBUUVDS-WJOKGBTCSA-N 444.553 2.374 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)NC3CCCCC3)cc2)C1 918373120 SKUFIZAWWWTMMT-LJQANCHMSA-N 443.592 2.417 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H](c1cccs1)N1CCOCC1 919790951 USMWTHXBJIWIIB-FQEVSTJZSA-N 430.574 2.457 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)cc2)C1 919816658 CHKUAKWTGWJHBQ-IAGOWNOFSA-N 426.483 2.279 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nnc(-c2ccsc2)o1 1320275765 ZCCMFBZXPANRAS-AWEZNQCLSA-N 431.470 2.433 10 20 IECD CCOC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1320473322 VOWFZZJUIOJVPS-SCTDSRPQSA-N 435.540 2.473 10 20 IECD CC(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740781 WMLPTMOLVLFDHD-QGZVFWFLSA-N 437.924 2.121 10 20 IECD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cn1C 1838031600 UBCZDQQYICKSPZ-UHFFFAOYSA-N 442.516 2.066 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCCC3)cc2)cc1OC 106158274 LDSLQPYZTBRBJT-UHFFFAOYSA-N 447.557 2.289 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NCCN3CCN(c4ncccn4)CC3)c2C)cc1 108731938 WICGORYICMGJKB-UHFFFAOYSA-N 434.544 2.445 10 20 IECD C[C@H](OC(=O)CCN1CCCC1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 727911812 DNUXAFBFUIHKPT-AWEZNQCLSA-N 434.448 2.345 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)CN(C)Cc3ccccc3O)cc2)C[C@H](C)O1 731843509 MAMRKJDEMHWFIK-IRXDYDNUSA-N 447.557 2.261 10 20 IECD COc1ccc(O)c(CNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)c1 734014902 KOLUQRFOKQAXCK-UHFFFAOYSA-N 443.319 2.148 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC[S@@](=O)Cc3ccccc3)CC2)cc1 735095306 JCNUGCMGAXGSJJ-WJOKGBTCSA-N 444.601 2.065 10 20 IECD C[C@H](O)C[C@@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 741081376 OTJJFRGDODROHI-SJORKVTESA-N 430.528 2.149 10 20 IECD C[C@@H](CS(C)(=O)=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 746862368 PJROHEACGUIFML-YOEHRIQHSA-N 427.567 2.115 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C[C@H]2CCOC2)CC1 749852432 FSUPMOSWTUYMIO-QZTJIDSGSA-N 447.535 2.443 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1Cl 756931308 OYMRLMQQKVUSGH-UHFFFAOYSA-N 440.833 2.489 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCc4n[nH]cc4C3)cc2F)C[C@@H](C)O1 757819954 QAGVNTKDKGBICB-HLLBOEOZSA-N 444.507 2.127 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(-c4ncn(C)n4)cc3)CC2)cc(OC)c1OC 759220591 JLURROHILPQXDQ-UHFFFAOYSA-N 437.500 2.470 10 20 IECD COc1cc(N2CCN(C(=O)c3cn(Cc4cccs4)nn3)CC2)cc(OC)c1OC 759221401 PZUJVUVMTUEEDF-UHFFFAOYSA-N 443.529 2.376 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCOC4(CCOCC4)C3)CC2)cc(OC)c1OC 760130526 WDHOYYSMZWSDNB-QGZVFWFLSA-N 449.548 2.272 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccn(-c4ccc(F)cc4F)n3)nc12 766823769 PMQHOEUZEMCPCX-UHFFFAOYSA-N 443.366 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3n[nH]c4cc(OC)ccc34)CC2)cc1 773863894 RNGMDXVJQAYDBE-MDZDMXLPSA-N 435.484 2.424 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(NC(=O)OC(C)(C)C)CC3)CC2)cc1 779222651 UFPOXNDAOPZQHM-NRFANRHFSA-N 448.608 2.167 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(N(C)C(C)=O)cc3)c2)CC1 780408126 XGJHFOMVKDKYLF-UHFFFAOYSA-N 430.530 2.139 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(C(N)=O)cc1F 785192009 IWZJCYXVCBVRJW-UHFFFAOYSA-N 438.253 2.380 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cccnc1-n1cncn1 785192732 OPIIEOYSWXIREZ-UHFFFAOYSA-N 445.277 2.118 10 20 IECD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295605 XCYQWBAKNXGCQW-OAHLLOKOSA-N 425.485 2.328 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2sccc2C1 789724622 QGFXUJQQNZPFFS-MRXNPFEDSA-N 426.586 2.310 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOc4ccccc4C3)cc2F)C[C@@H](C)O1 789815829 ASUOLIYINILAJA-CALCHBBNSA-N 441.503 2.477 10 20 IECD CCc1ccnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 789823302 ZZUCJMPGDAPEQT-HOTGVXAUSA-N 428.508 2.329 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ncnn3C(C)(C)C)CC2)cc1 800029418 KSDVOVZNWSTFEN-UHFFFAOYSA-N 429.569 2.053 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(OC(F)F)nc1 802551907 ZLHWQHUOTKVTPZ-UHFFFAOYSA-N 438.406 2.038 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2cccs2)C1)c1ccc(N2CCOCC2)cc1 803305115 JVESULYCIOXYSE-QFBILLFUSA-N 429.542 2.362 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCCn1cc(Br)cn1 807097218 MQBSQRWOQPENTP-UHFFFAOYSA-N 436.354 2.233 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCCNC2=O)c1 807386717 GDUDPLWPNMEZOS-UHFFFAOYSA-N 447.289 2.329 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C[C@H](C)O)c3ccccc3)CC2)cc1 809460195 STUJBIJBHGTYOE-FPOVZHCZSA-N 439.556 2.405 10 20 IECD Cc1cccc([C@H](CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)NC(N)=O)c1 914643915 YIIZSJGFPMYMBK-FQEVSTJZSA-N 426.517 2.362 10 20 IECD CCNC(=O)COc1ccc(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)cc1 918303370 GVFZOSLJOCXXAO-UHFFFAOYSA-N 426.517 2.255 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(=O)n(Cc2ccccc2)n1 919968314 CFRYYIGZSNUZPW-UHFFFAOYSA-N 432.524 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc(NC(C)=O)c3)CC2)cc1 920255137 BPFHDLDZTVZMFA-KHPPLWFESA-N 436.512 2.175 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1cc(C(F)(F)F)ccc1=O 1248437643 SILOFVYXGXTAQU-UHFFFAOYSA-N 425.407 2.135 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(C(=O)OC)c3)CC2)cc1 1319601215 GMQWVERRIBSVMC-UHFFFAOYSA-N 434.514 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccc3)[C@H](C)CO)CC2)cc1 1321853628 WJPAKCXUHYQDRM-DRUFCSCSSA-N 437.540 2.310 10 20 IECD C/C(=C\c1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787292653 ZXKDWXGOXZCMDJ-ZGTPDUGGSA-N 443.525 2.251 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccccc1)C1=NN(c2ccccc2)C(=O)C1 1795435890 XKCLARZWMCSDNZ-FNLKRUPLSA-N 444.491 2.300 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801429574 GSDDZEOTASWUPC-FIIQBIKZSA-N 448.903 2.426 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)o1 1801475069 FDWUEXOCWAZPNE-HBCWATKFSA-N 434.876 2.099 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1F 1803261458 JFIVIJICHCEEEI-MUJYYYPQSA-N 449.573 2.257 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccc1O 1805197397 RFWPLNDVGVMUFF-YCRPNKLZSA-N 434.452 2.227 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994641 XHFHYNFQLRYGTB-LIRRHRJNSA-N 426.498 2.228 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2CCN(C(=O)C(O)O)[C@H]2c2cccnc2)cc1 1811262497 PSUPKLPTUGLEHY-UNMCSNQZSA-N 448.523 2.119 10 20 IECD O=C1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1814087589 AXFFAPSJNJOZHY-DJJJIMSYSA-N 443.887 2.445 10 20 IECD Cc1nccn1[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822879133 DQVGOOLYNKJNNM-LRDDRELGSA-N 439.476 2.288 10 20 IECD CCC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825157175 QJVZSUSGCRRCAU-JTQLQIEISA-N 440.616 2.352 10 20 IECD C/C=C/C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1838745468 AKIHUMXPJKIMFR-QGZVWANCSA-N 430.501 2.391 10 20 IECD CSC[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 475945846 IKBYHHKCSGCSJR-XYJFISCASA-N 431.558 2.385 10 20 IECD Cn1ncc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)c(Br)c1=O 480823356 FNEQXJQOYLFYLH-UHFFFAOYSA-N 443.301 2.366 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 734496959 VJDKZFCGWDFNSY-UHFFFAOYSA-N 434.518 2.012 10 20 IECD Cc1nc(-c2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2)n[nH]1 737159182 UPHHUAXYKHFNLK-OAHLLOKOSA-N 434.500 2.433 10 20 IECD Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 748647178 MKMVGCUPHJBOGE-KRWDZBQOSA-N 446.529 2.392 10 20 IECD O=c1onc(-c2ccccc2)n1C[C@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 749298630 QGLXVKUIEXHBCT-UXHICEINSA-N 425.485 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN3C(=O)c3ccc4c(c3)OCO4)CC2)cc1 749470932 UHVBNQVHZNCWNZ-FQEVSTJZSA-N 437.496 2.377 10 20 IECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 752100022 QHJYHWNMHYLGQA-UHFFFAOYSA-N 425.485 2.236 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3c(C)nc4c(c(O)nn4C)c3C)CC2)cc1F 753742587 RKTVGYSACQVDFU-UHFFFAOYSA-N 427.480 2.330 10 20 IECD COc1ccc(N(C)CC(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1F 757852169 XEIRRVHYSKOOGE-UHFFFAOYSA-N 425.482 2.168 10 20 IECD COCCNS(=O)(=O)c1ccc(NC(=O)NCCCSc2nccs2)cc1 758619933 HKCVDPYACKHDJS-UHFFFAOYSA-N 430.577 2.372 10 20 IECD C[C@@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCS1(=O)=O 758625808 WMFMOVGRJSSPNE-CQSZACIVSA-N 431.505 2.475 10 20 IECD COc1cc(N2CCN(CN3C[C@H](c4ccccn4)CC3=O)CC2)cc(OC)c1OC 758953152 BDZBUOBWDGLKIJ-QGZVFWFLSA-N 426.517 2.203 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)cc(OC)c1OC 759242380 YFOYUWZLKCUUBT-INIZCTEOSA-N 431.533 2.152 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3cc(-n4cnnn4)ccc3F)sc2n1 761045356 AMXQQFMUSBCTTO-UHFFFAOYSA-N 441.448 2.406 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)COCC(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 761967053 FKJUQWMUKWKVTB-KBPBESRZSA-N 432.473 2.186 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2NC1=O 765926700 PLOCEZGVVIYXSI-SECBINFHSA-N 434.246 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CN(C)C(=O)OC(C)(C)C)n3)CC2)cc1 771059280 ZGWYQPGNYOEMBV-UHFFFAOYSA-N 445.520 2.336 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407960 SAHDGTFGYFCNSK-UHFFFAOYSA-N 435.477 2.082 10 20 IECD COc1ccc(C[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 781299212 XDCDHAUUYFNLAJ-QGZVFWFLSA-N 446.569 2.434 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cc1F 781934289 QVTXTOGDJRTBEZ-KRWDZBQOSA-N 426.558 2.428 10 20 IECD O=C(CN1CCOC[C@@H]1[C@@H]1CCCC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 784356958 WRFWARXOVKBZOW-PZJWPPBQSA-N 432.476 2.471 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc(N(C)C)c3)cc2F)C[C@@H](C)O1 786897510 HPVNTFZWJUVNGY-IAGOWNOFSA-N 442.535 2.438 10 20 IECD C[C@@H](CN1CCCCC1)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787752923 WPRYNOPFAWUGCZ-DLBZAZTESA-N 438.519 2.364 10 20 IECD Cc1cccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789799453 HQHPBEUMSLFNKD-KRWDZBQOSA-N 429.492 2.171 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCO[C@H](c4ccco4)C3)cc2F)C[C@@H](C)O1 789822955 BURXFHLVHVTORI-ZOCZFRKYSA-N 445.491 2.249 10 20 IECD Cc1cc(C(=O)COC(=O)C2CCC(O)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795649300 KZENSXVQTVJLPY-UHFFFAOYSA-N 434.514 2.019 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)cc1 797431612 ULJADPNBGOVOQM-UHFFFAOYSA-N 434.883 2.234 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(N2CCOCC2)cc1 803312056 UFDRKHNCWDNMIS-DENIHFKCSA-N 428.577 2.177 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](Oc4ncccc4F)C3)ccc21 803688183 LPOJGUAYSBISNJ-GOSISDBHSA-N 426.492 2.289 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3cc(F)cc(F)c3)cc2F)CC1 804029326 FRZQFFZENIADMG-UHFFFAOYSA-N 448.489 2.221 10 20 IECD C[C@@H](NC(=O)C(=O)NCC1(CN2CCOCC2)CCCCC1)c1ccc(N(C)C)cc1 807670720 HHWHVFAEVJGOIP-LJQANCHMSA-N 430.593 2.329 10 20 IECD O=C(CCc1nnc(-c2ccccc2)o1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676622 MOUYRKBYIISKDE-UHFFFAOYSA-N 440.525 2.220 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1OC(F)F 918338006 JARULYKZBVBNPQ-UHFFFAOYSA-N 440.468 2.461 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 919968308 BFFPYQRHGYPPOJ-UHFFFAOYSA-N 449.548 2.019 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(N2CCCS2(=O)=O)c1 919969031 DAHDUQGUQJCUOH-UHFFFAOYSA-N 447.532 2.257 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 920090343 LZCIXSIXTRCEDC-WOJBJXKFSA-N 430.593 2.361 10 20 IECD COc1ccc(N2CCCN(C(=O)c3n[nH]cc3I)CC2)cc1 1255036152 JNQGFBILQQDKJN-UHFFFAOYSA-N 426.258 2.375 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCC(OC[C@@H]2CCCO2)CC1 1330407873 DPKLJQOBNFRXGF-BTRQGYIVSA-N 435.517 2.443 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1Cc1ccc(F)cc1 1342435957 XLVXRMGDBQCFNP-RBUKOAKNSA-N 430.476 2.492 10 20 IECD C[C@@]1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CC=CCC1 1777851967 VQGHVDQUGHRJRO-NLSFWIRASA-N 429.517 2.367 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H]2CCOC2)C3)cc1 1799622448 BCTXLZFYUDTCPR-CUDBPUKSSA-N 437.540 2.334 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC1CCCC1)C2 1802080977 FTBMNGMWWVRFSC-JWMIDBARSA-N 444.528 2.377 10 20 IECD Cn1cnc(C(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)c1 1808677601 GBMOQFAIBWVFSH-UHFFFAOYSA-N 448.527 2.058 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@@H]1C[C@@H]1C1CC1 1814762899 HDSDYUMMMUXQTL-NFAWXSAZSA-N 447.586 2.308 10 20 IECD O=C(c1nc[nH]n1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736817 KLLONQKHOOEJQQ-OAHLLOKOSA-N 433.896 2.416 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)C3(F)CCCCC3)CC2)CC1)c1cc(O)nc(O)c1 1834987668 TWUZCCPAQKSUAV-UHFFFAOYSA-N 448.539 2.350 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 10619865 DTTFIBPCJNCFJV-HNNXBMFYSA-N 433.482 2.026 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 437021976 GDDPMILCPAABAC-UHFFFAOYSA-N 438.509 2.410 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)n(C)c2ccccc12 578040577 FGYBGTVKZXYGFM-UHFFFAOYSA-N 436.487 2.227 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2cc(Br)ccc2O)c1 730017764 MKRCTDWLYDSAIU-NSHDSACASA-N 442.335 2.180 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccc(OCC(=O)OC)c3)cc2F)CC1 730194832 QLPRSRBJFPZWGA-UHFFFAOYSA-N 429.492 2.449 10 20 IECD Cc1c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nnn1-c1ccc2c(c1)OCCO2 731453092 BEYXSJPRJCGHAD-UHFFFAOYSA-N 449.511 2.456 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4nc(=O)o[nH]4)cc3)cc2F)CC1 732289462 RIXYLPTXSOZAKZ-UHFFFAOYSA-N 425.464 2.241 10 20 IECD CCOC(=O)C1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)Cc2ccccc2C1 735873343 JLAWHLJTVMQORJ-UHFFFAOYSA-N 437.540 2.034 10 20 IECD CN(CC(=O)NCCc1ccc(S(N)(=O)=O)cc1)Cc1ccc(N2CCCCC2)cc1 741712295 SWQTWHVZUYQFNM-UHFFFAOYSA-N 444.601 2.115 10 20 IECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCc1ccc(N2CCOCC2)c(F)c1 742342036 MUFUKSUYVVUOAB-XKGZKEIXSA-N 436.553 2.004 10 20 IECD C[C@@H](NC(=O)CNS(=O)(=O)c1ccc(Cl)s1)c1ccc(N2CCOCC2)cc1 749852373 YZNYLVMXLAQDSI-CYBMUJFWSA-N 443.978 2.394 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754214123 YZLGVDQLLXQYHT-UHFFFAOYSA-N 429.448 2.217 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 765977907 KJHDNZFGYYKNNX-YKSBVNFPSA-N 443.613 2.301 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 767937705 RLVGWKXOLWVAEQ-YADHBBJMSA-N 434.556 2.229 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)c3ccccc3)cc2F)C[C@H](C)O1 768647426 YXZHACHICMFRQB-WCJKSRRJSA-N 430.476 2.332 10 20 IECD CC1CCC(NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 769320725 VUQBQDVPJZATCD-UHFFFAOYSA-N 432.584 2.475 10 20 IECD C[C@H](NC(=O)N1CCOC[C@H]1c1noc(-c2cnn(C)c2)n1)c1ccc(N(C)C)cc1 776237224 FSKNHFIOZSZNOQ-KSSFIOAISA-N 425.493 2.380 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)c4ncccc43)cc2F)C[C@H](C)O1 777714189 PJFAQHBJEZOCPS-IRXDYDNUSA-N 427.524 2.407 10 20 IECD O=S(=O)(Nc1cc(S(=O)(=O)N2CCCC2)ccc1Cl)c1cccc2nonc12 778084935 REQQOFZJOHVSMV-UHFFFAOYSA-N 442.906 2.462 10 20 IECD O=C(NCc1ccc(O)c(O)c1)c1cc(S(=O)(=O)NC2CC2)ccc1Br 778922493 GFYVUMYEBSBNHM-UHFFFAOYSA-N 441.303 2.231 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)Nc3c(C)cccc3C)CC2)cc1 779219896 PFASPCRYXRLUPO-JOCHJYFZSA-N 440.588 2.365 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 784025953 PFOXEVGFJHRQIJ-UHFFFAOYSA-N 426.441 2.451 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1 784031219 XYHCCFSDWGATIQ-UHFFFAOYSA-N 433.530 2.328 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785297582 QFEDVUAJRUXLSE-AWEZNQCLSA-N 449.529 2.326 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1C 803451113 DROSJCGOCIZSIM-KFWWJZLASA-N 425.476 2.397 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3C[C@@H](C)[C@H]3c3ccccc3)CC2)cc1 803751855 XFDZOBKWXHYDMI-XXBNENTESA-N 436.556 2.153 10 20 IECD Cc1cnc(COCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1 803899461 HQGBFBGFYDBFAI-HOTGVXAUSA-N 449.479 2.112 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(CCC(C)(C)C)CC3)CC2)cc1 804316719 IUBQSZSKGAWTJI-UHFFFAOYSA-N 430.593 2.361 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cnc(N(C)C)n3C)cc2Cl)C1 805566749 QNOADAWPGPQCLT-HNNXBMFYSA-N 446.983 2.308 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccccn3)cc2F)C[C@@H](C)O1 805691815 LPYBWRLCUYNRBU-IAGOWNOFSA-N 445.491 2.211 10 20 IECD CCOc1cc(CCO)ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 808273394 ZPBKVVRBGMIKBM-UHFFFAOYSA-N 432.492 2.291 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H]4CN(C(C)=O)C[C@@H]43)cc2F)CC1 808357765 OKWBPQUQSFLWOW-JAXLGGSGSA-N 445.583 2.414 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)c4ccc(C)c(F)c4)CC3)nc12 917154952 COESBTKMOPORNL-UHFFFAOYSA-N 441.463 2.017 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 918288990 YKPGPQYKDJPWKS-GASCZTMLSA-N 442.491 2.054 10 20 IECD CCOC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918309074 UYISGVNHQBZMTM-UHFFFAOYSA-N 425.485 2.297 10 20 IECD CCOC(=O)c1[nH]c(C)c(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1C 918797676 PHPIEPYHGQAIRG-UHFFFAOYSA-N 430.417 2.090 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccc(N2CCOCC2)cc1 920925604 KLGPKCHWYAAGET-ZDUSSCGKSA-N 430.892 2.091 10 20 IECD Cc1ccc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)ccc2n1 1777907238 ZYLCSWAEDZNAJU-XMMPIXPASA-N 448.479 2.107 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)C3CCOCC3)C2)CC1 1809372710 CGPDNENBWNTJEK-HWKANZROSA-N 444.528 2.474 10 20 IECD CC(C)N[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)C(C)C 1810544206 YTXXOGKVQLLJJV-FQEVSTJZSA-N 432.565 2.360 10 20 IECD CC[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)N(CC)CC 1816720375 OHTXOENRWAJFNH-HIFRSBDPSA-N 447.561 2.296 10 20 IECD C[C@](O)(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1824832012 JTICGBWUJQISCY-KUHUBIRLSA-N 445.438 2.039 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2noc3c2CCCC3)C1 1843257789 YDLQYBNURIXAKW-UHFFFAOYSA-N 447.495 2.163 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)on1 1847038155 BSRIYOLLXJTQKT-FNORWQNLSA-N 427.457 2.445 10 20 IECD Cc1cc(/C=C/C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)no1 1847038324 MOJFRFIBPKCBOA-NSLJXJERSA-N 425.441 2.030 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 22692592 RABHWPOSLDENQE-FQEVSTJZSA-N 431.558 2.482 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 109190424 HBFBDNQHSZLGOZ-SJORKVTESA-N 447.557 2.076 10 20 IECD CCOC(=O)C1=S=C(NC(=O)c2ccc(C(=O)OC)o2)C(C(=O)OC(C)(C)C)=C1C 432372023 JPEHLOXXWAZXSW-UHFFFAOYSA-N 437.470 2.066 10 20 IECD CCN1C(=O)c2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2S1(=O)=O 735520393 ZOPHMMFQWZTXKC-QGZVFWFLSA-N 444.509 2.378 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccccc1N1CCOC1=O)c1ccc(N2CCOCC2)cc1 737158183 OJZWFGCXRHLPLS-INIZCTEOSA-N 438.484 2.296 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2c(c1)OCCCO2 751229136 VBIQLIXHAIFBKN-UHFFFAOYSA-N 436.505 2.427 10 20 IECD CS(=O)(=O)CC1(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 752022895 DSNGVAIYQVDQLC-UHFFFAOYSA-N 431.505 2.381 10 20 IECD Cc1oc(S(N)(=O)=O)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754202859 ZIPIOMDUSRFAQM-UHFFFAOYSA-N 429.445 2.236 10 20 IECD CO[C@H]1CCN2C(=O)N(Cc3ccc(N4CCOCC4)cc3C(F)(F)F)C(=O)[C@H]2C1 761096594 JYVRTHHGGRVQHB-DOTOQJQBSA-N 427.423 2.484 10 20 IECD CC(C)OC[C@@H](CO)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 764218199 RCYMHPOTNRMNCJ-QGZVFWFLSA-N 433.471 2.469 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1O 774880956 MNWOPOLLLAZCNQ-UHFFFAOYSA-N 440.500 2.406 10 20 IECD Cc1cc(Br)cc(CNCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1O 776078285 WWRJFFBYRFNVLC-UHFFFAOYSA-N 444.307 2.439 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCn3cnc4ccccc43)CC2)cc1 778220045 PQQLAEILNAZIBV-QXMHVHEDSA-N 447.539 2.456 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3c(F)cccc3F)CC2)cc1 778346023 HXNFKVHEVYLRIY-GDCKJWNLSA-N 445.466 2.028 10 20 IECD CN(C[C@@H](O)CN1CCOCC1)C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 784971319 MJBSNWKVWFLXDP-HXUWFJFHSA-N 425.489 2.192 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)C3CN(C(=O)OC(C)(C)C)C3)cc2)CC1 787328678 SQLPCMJQMQVFJS-QGZVFWFLSA-N 444.576 2.474 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ncsc4C3)cc2F)C[C@H](C)O1 789823234 ZQJCMQOOGWBJOG-KBPBESRZSA-N 432.521 2.097 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3Cc3ccccc3)cc2)C1 793716747 FDUWYXYAGASCPS-GMAHTHKFSA-N 448.567 2.238 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 793808973 CQYSCEBMPIGNRA-YADARESESA-N 430.593 2.361 10 20 IECD COC(=O)CN(CCN1CCN(C)CC1)C(=O)c1cc(C)n(-c2ccccc2C)c1C 799035954 RZJMHAIXDIIEJP-UHFFFAOYSA-N 426.561 2.265 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@H]2COC3(CCOCC3)O2)cc1)C1CCCCC1 803677950 VSCWUWCHVKRVNW-NRFANRHFSA-N 445.560 2.110 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](c3ccc(F)cc3)c3cnn(C)c3)ccc21 803686852 IOOAFTKNJCZKCP-QFIPXVFZSA-N 435.503 2.464 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687788 PPIHSKSTPRLONX-VQIMIIECSA-N 444.576 2.447 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1 806885411 DQRHDHIJEPDZGH-GFCCVEGCSA-N 435.427 2.332 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(C2OCCO2)c1 808859910 DSGZNCWONJQPED-UHFFFAOYSA-N 431.514 2.289 10 20 IECD O=C(NC[C@@H]1COC2(CCCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809673308 PNZDYLFANIKUQG-WOJBJXKFSA-N 446.544 2.482 10 20 IECD COc1cc(Cl)cc(CN(CCN)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1O 809728197 OEQKQZQHBMRKEO-UHFFFAOYSA-N 429.882 2.331 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(NC(=O)C(C)C)CC3)CC2)cc1 916196607 NYSKSWIJRGAMAP-UHFFFAOYSA-N 445.608 2.154 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3cc(F)cc4c3OCOC4)cc2)C1 917832846 HTOIHYFPSMSCRQ-MRXNPFEDSA-N 427.476 2.253 10 20 IECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 917928058 QFICAECXLPCBIH-UHFFFAOYSA-N 437.587 2.356 10 20 IECD C[C@H]1Oc2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2NC1=O 918032651 GCBCINPVFARUQO-GDBMZVCRSA-N 437.500 2.429 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 918112548 CCFJADKNZNCJLS-UHFFFAOYSA-N 447.557 2.289 10 20 IECD CCNC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918295326 DLRKWXCUMLTYSH-IBGZPJMESA-N 425.485 2.288 10 20 IECD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)Nc2cccc(N3CCCCC3)c2)c1 919861601 VNVRVXZCGLFIOS-UHFFFAOYSA-N 444.557 2.413 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(-c2csnn2)cc1 920188616 JHXLRCBSPANVFJ-UHFFFAOYSA-N 441.488 2.436 10 20 IECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319949621 ACIAMEJMPPKNIZ-UNMCSNQZSA-N 445.627 2.390 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 1324121724 SOECPCVNVGZGLD-CJNGLKHVSA-N 448.422 2.020 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(F)c1)C1=NN(c2ccccc2)C(=O)C1 1795222271 DYWDPNBRNUAWOW-GGPHIMKMSA-N 435.459 2.265 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc(OC)c1C 1796603463 OBRBYZRHJZETGA-BJWYYQGGSA-N 441.484 2.384 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NNC(=O)C2)cc1 1798374432 FVQOAPOMVBCLFM-FNLKRUPLSA-N 433.512 2.222 10 20 IECD O=C(C[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815602632 JVHYFZYBOUDDTD-GOEBONIOSA-N 429.477 2.481 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848582 QZWYARPTPGBSTD-BBRMVZONSA-N 439.476 2.055 10 20 IECD CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821973299 KSKHTAMNBUSRFN-MEBBXXQBSA-N 449.895 2.305 10 20 IECD CN(C[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)C(=O)OC(C)(C)C 116080997 YILOSGPYKXPKRA-CQSZACIVSA-N 441.550 2.483 10 20 IECD Cc1c(CNC(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)n(C)c2ccccc12 472221859 OSGDUQZDVSUSIO-UHFFFAOYSA-N 449.559 2.145 10 20 IECD C[C@H]1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 725803783 QBTGYGWJAMQWDL-YRUBURHZSA-N 433.555 2.075 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)cc3F)cc2)C1 729854169 WOXOFKNRZJZKDV-ZDUSSCGKSA-N 427.448 2.284 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(CCCOC)CC3)cc2F)CC1 730127717 UYXXBVQBNZZVQT-UHFFFAOYSA-N 435.588 2.268 10 20 IECD COc1cc(F)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 730680812 XGMAQTAPAKCLBL-CQSZACIVSA-N 431.464 2.495 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 737130217 CSHYTPHUWPBBQA-UHFFFAOYSA-N 431.489 2.420 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cnn(-c2ccccc2)c1 741400191 TZODRSVIUDAGHV-UHFFFAOYSA-N 425.514 2.429 10 20 IECD COC(=O)c1cccc(CS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751236371 IKMFTORYYMQSNW-UHFFFAOYSA-N 432.542 2.302 10 20 IECD Cc1ccc(O)c([C@H](C)NCCOc2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc2)c1 756787901 SUNHUPPFTFYHMI-HNNXBMFYSA-N 442.559 2.156 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](C)CC3(C)OCCO3)CC2)cc1 758679062 IRQFOMNKPHNPGT-IBGZPJMESA-N 434.581 2.296 10 20 IECD CCOC1CC(CNC(=O)NCc2ccc(N3CCSCC3)cc2)(N2CCOCC2)C1 767778284 GTXDBBZLONPSCI-UHFFFAOYSA-N 448.633 2.309 10 20 IECD Cc1cc(C(=O)CN2CCS[C@@H]3COCC[C@@H]32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767910000 DHCXTEBSCINKOD-PZJWPPBQSA-N 449.598 2.131 10 20 IECD CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NCc1c(O)ccc2c1CCCC2 769563123 XRLXYSFVTVBDTE-UHFFFAOYSA-N 427.526 2.482 10 20 IECD C[C@H](NC(=O)N1CCC[C@@H]([C@@H](O)c2nccn2C)C1)c1ccc(N2CCOCC2)cc1 769976841 ABVZKHLEMOCHJM-FBBABVLZSA-N 427.549 2.473 10 20 IECD CC(C)=CCC[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772899542 IMFALEVCDNZDAR-HSZRJFAPSA-N 446.523 2.335 10 20 IECD COCCC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 773241202 FJFMRTOQCKAXMK-UHFFFAOYSA-N 434.514 2.284 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1-n1nnnc1C1CC1 773860221 WVPUKQXOCDLEEW-CQSZACIVSA-N 449.515 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1 778217492 HFKPEARJKWGMQT-DSTYWPJMSA-N 436.556 2.319 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C/C(=O)Nc3ccc4n[nH]cc4c3)cc2)C1 778638412 YGJKWHRRBSYASE-FVNWOWOISA-N 446.511 2.076 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)ccc21 778728685 HCCQEEWUENFSQE-MRXNPFEDSA-N 438.528 2.494 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC 784027463 HRVNFKXHJAPBPN-UHFFFAOYSA-N 449.529 2.028 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc(F)c(F)c1 786681920 GJXCVZKUMRKSPV-UHFFFAOYSA-N 442.510 2.429 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3[nH]cnc3C(=O)c3ccccc3)cc2)CC1 787322269 NTZIIYQVVFZSMD-UHFFFAOYSA-N 431.496 2.239 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1 787981736 YAJVZDIISLWCFF-HSZRJFAPSA-N 438.572 2.291 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1CCC(N2CCCCC2)CC1 788318895 JDWCGKFGWVFUAS-UHFFFAOYSA-N 428.577 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)CC2)cc1 794085999 JFJBGINBIOTJHE-POGSWGBUSA-N 439.556 2.460 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 795064340 UBZZIVCRHLWBSF-UHFFFAOYSA-N 434.562 2.051 10 20 IECD C[C@@H]1C[C@@H](N2CCOCC2)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 796377385 LGTHNIOPINPKCF-IAGOWNOFSA-N 433.508 2.196 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(c3cnn(C)c3)CC2)cc1)C1CCCCC1 803677295 LSAQMPOVRNMTMM-UHFFFAOYSA-N 438.576 2.154 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@](C)(CNC(=O)OC(C)(C)C)C3)ccc21 803686962 KPJJUTUDOSQHSB-DEOSSOPVSA-N 444.576 2.449 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc(OC)c1OC 806928388 UAMKOHPSOWEVBP-BRWVUGGUSA-N 433.549 2.302 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O 808158726 ABWYDKCPYXZZPX-FQEVSTJZSA-N 438.528 2.223 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 915732123 SCZSPIBNJICSHX-UHFFFAOYSA-N 432.546 2.086 10 20 IECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C(=O)O 917929526 GTAQEGXNFMZSDV-KRWDZBQOSA-N 445.541 2.182 10 20 IECD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918138709 QFQORKKEVPQLOL-UHFFFAOYSA-N 447.532 2.341 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284646 MGYSLRMWFVDNCA-UHFFFAOYSA-N 430.436 2.096 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3cccs3)cc2F)C[C@H](C)O1 918632994 HJIGVQBCDONICX-KBPBESRZSA-N 441.550 2.096 10 20 IECD Cc1ccc(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cn1 919485980 WVXOUFUXLVPEDZ-UHFFFAOYSA-N 441.509 2.414 10 20 IECD CCN(CC)[C@@H](CN/C=C1/C(=O)NC(=S)N(CCOC)C1=O)c1ccccc1Cl 920979391 KTNNAKFQXOQJBS-KSVUCXBSSA-N 438.981 2.086 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)CC2)cc1 1253443693 ZTBCEYZKABWDJJ-VWLOTQADSA-N 448.523 2.127 10 20 IECD Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)c1 1780672835 LZYRKIYBSBSFBS-VWLOTQADSA-N 446.507 2.231 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1F)CCO2 1785507671 RQVZDTIRORJKJO-AVAOGFIGSA-N 442.443 2.099 10 20 IECD O=C(CN1CCCCC1=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791510798 RESDZBJFSLJEHH-UHFFFAOYSA-N 438.484 2.253 10 20 IECD CC(C)N(C)CC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1792003151 QVHKJMGXFQLTON-UHFFFAOYSA-N 448.614 2.321 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)C1(O)CCC1 1792557189 NUOFWBKODPDSRW-KXSQSXTESA-N 430.501 2.006 10 20 IECD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c1 1799768847 BABWYHNHCILRQI-CCWDJLKJSA-N 446.887 2.277 10 20 IECD CC(C)n1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1800714812 HOQNKDCTYZYKQH-BTTYYORXSA-N 433.896 2.489 10 20 IECD CCC(=O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1812568600 KIVRDQUEJGVQTE-FZKQIMNGSA-N 431.876 2.445 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729166 RRXDKMZXJAPXJV-OCCSQVGLSA-N 447.561 2.153 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1 1831997052 SYXRYNDTMQEBSF-WDSOQIARSA-N 431.533 2.277 10 20 IECD CC(C)n1nccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441632 JRIYWNYHKRFZKI-UHFFFAOYSA-N 434.500 2.074 10 20 IECD Cc1cc(C(=O)COC(=O)Cc2ccc(O)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 10536310 ZGCYWZDIDYEPKT-UHFFFAOYSA-N 442.493 2.416 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1 620275934 QTPLPHZZJPXEPN-UHFFFAOYSA-N 433.511 2.323 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc([C@H](C)OC)c3)CC2)cc1 727035433 QEMMCEKOGHMAFO-SFHVURJKSA-N 440.544 2.280 10 20 IECD Cc1noc(COc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)n1 734074384 SSKQYQWFYZJQFK-UHFFFAOYSA-N 427.436 2.417 10 20 IECD CCOC(=O)C1=C(CN(CC)Cc2cc(Br)ccc2O)NC(=O)N[C@@H]1C 743870791 BHCPNBNFHSLFAT-LLVKDONJSA-N 426.311 2.495 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](N2CCNC2=O)C1 744200475 KRYIVGFPVQMRHW-CVEARBPZSA-N 446.507 2.279 10 20 IECD CCn1c(S)nnc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751061000 QFBSEJFHZRPMRM-UHFFFAOYSA-N 439.544 2.085 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)[C@@H]3CCCN(C4CCC4)C3)CC2)cc1 754462289 DMSGPAXFLCCUMU-YZUZCNPQSA-N 430.637 2.421 10 20 IECD C[C@H](O)CN(C)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 755440832 MFMNZMHHITVRPQ-BNDQCTAISA-N 429.361 2.490 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3(CNC(=O)OC(C)(C)C)CC3)CC2)cc1 759024085 IJUYMYBOEOIRKJ-UHFFFAOYSA-N 432.565 2.238 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3nnc(C(C)C)s3)CC2)cc(OC)c1OC 759886272 LSFCWZDORIEZPT-UHFFFAOYSA-N 435.550 2.448 10 20 IECD COc1ccc2c(c1)[C@H](NC(=O)/C=C\c1cnn(C)c1)CCN2C(=O)/C=C\c1cnn(C)c1 760651207 YPRKGCRHGCDUJW-FWPOIIBBSA-N 446.511 2.483 10 20 IECD CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 764923939 GPXKBNCWTNUKSE-KRWDZBQOSA-N 437.512 2.305 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c1O 768724621 KCFIAKZGHHXOEE-UHFFFAOYSA-N 435.362 2.255 10 20 IECD O=C1C[C@@H](Cc2ccc(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc2)C(=O)N1 772057790 PZVGQEDEYWZCOL-CYBMUJFWSA-N 427.844 2.220 10 20 IECD CCC(=O)N1CC[C@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 773221948 KWYGCRPXJHZGMS-AWEZNQCLSA-N 434.448 2.202 10 20 IECD C[C@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 775191349 NDCDAWDCSQHQEQ-KRWDZBQOSA-N 432.590 2.312 10 20 IECD COC[C@H](C)n1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 784768516 YWJZJOQVFCUQQR-YOEHRIQHSA-N 449.939 2.169 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 785298018 UACIBLDDMABFEH-CZUORRHYSA-N 432.448 2.481 10 20 IECD O=C(NC1CCN(c2ccccn2)CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788643716 QISOAWXINSXVOS-HXUWFJFHSA-N 438.528 2.080 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 788974331 DDSRTXVEGANYFR-QFIPXVFZSA-N 436.556 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](CCC(C)C)(C4CC4)C3=O)CC2)cc1 789667653 KHVDLGZMGCPULL-XMMPIXPASA-N 442.560 2.481 10 20 IECD CCN(C[C@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798196 DAELJRZGJJPQGV-QFIPXVFZSA-N 443.519 2.169 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@H](Nc2ccccc2)C1 789799117 IZVLAFFMRWOLPD-FQEVSTJZSA-N 440.519 2.382 10 20 IECD CN1CCCc2cc(CNC(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)ccc21 791341561 SKSDBCFPUSRAOH-GOSISDBHSA-N 428.920 2.013 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cnc(CC2CC2)nc1 793014038 REXYLVGITRCJDK-UHFFFAOYSA-N 448.571 2.216 10 20 IECD Cc1oc2ccccc2c1CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793731461 DULPXLDXNAKUAS-GOSISDBHSA-N 448.523 2.376 10 20 IECD CCN(CC)C[C@@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793795479 QMQRQGPERDLADW-CVEARBPZSA-N 426.508 2.220 10 20 IECD COc1cc(N2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC2)cc(OC)c1OC 801949639 PKUBEECGOLRLMV-UHFFFAOYSA-N 434.424 2.304 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(N2CCOCC2)cc1 803299129 ZIQCYAKDPYUERK-LEDOBFOHSA-N 440.588 2.176 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(CCCN(C)C)CC1)c1ccc(N2CCOCC2)cc1 803307207 YJTYKHWAFCUWBG-IBGZPJMESA-N 430.593 2.281 10 20 IECD CC[C@H]1CO[C@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448929 IJDABAUAIJXYSJ-ZBFHGGJFSA-N 425.476 2.399 10 20 IECD C[C@](O)(C1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1)C(F)(F)F 806278133 NLYIBEDDPSKHCE-HNNXBMFYSA-N 425.498 2.293 10 20 IECD CCOc1cc(NC2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)ncn1 807670107 BCMLCDLIVGDUNN-MRXNPFEDSA-N 440.548 2.222 10 20 IECD CCOC(=O)C(C)(C)c1csc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 807877587 SPIQNMYQVWSQTI-UHFFFAOYSA-N 427.504 2.313 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CNS(=O)(=O)c1cccc(Br)c1 810411703 SIMDHZOVMIKWJE-UHFFFAOYSA-N 440.363 2.418 10 20 IECD COc1ccc(N2CCN(CCNC(=N)NCCc3ccc(OC)c(OC)c3)CC2)cc1 849066646 KRFUAGCPUGNKIW-UHFFFAOYSA-N 441.576 2.191 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1OC 916611387 JRSXBEGJZHCEAX-UHFFFAOYSA-N 437.470 2.177 10 20 IECD COc1c(C)cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 917929299 CONQVKQOHWTZDR-GOSISDBHSA-N 431.558 2.492 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4ccccc4C3)cc2)C1 918005413 YRMZPIYCLYGGKT-JOCHJYFZSA-N 435.572 2.246 10 20 IECD COc1cccc([C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)c1 919805324 NAPKUKPYTAIFCM-IBGZPJMESA-N 433.530 2.339 10 20 IECD Cn1c(S)nc2cc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2c1=O 919968610 JMUOWUYTFMATCP-UHFFFAOYSA-N 438.553 2.361 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3ccoc3Cl)C2)C1 1780459405 KEIPMIDXBUJNIX-ZZNNXKBLSA-N 448.859 2.207 10 20 IECD Cc1cccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243241 YGXMKUTZMVPYQB-YEWWUXTCSA-N 445.903 2.362 10 20 IECD CCn1nc(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816724732 DSWRIDWXSMFJAS-GFCCVEGCSA-N 442.501 2.014 10 20 IECD CC(C)[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708416 YPQPSGHELYEGEI-BONVTDFDSA-N 439.921 2.450 10 20 IECD O=C(c1ncon1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877022 QXFFTTPDYYEBDZ-BIENSFFJSA-N 442.472 2.133 10 20 IECD CC(=O)Nc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)ccn1 1843602004 WIMAFBIXSITSKM-UHFFFAOYSA-N 444.875 2.235 10 20 IECD CO[C@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1ccccc1 1847038779 BMIMKAQGJNIIIH-CRWWQRIJSA-N 438.480 2.408 10 20 IECD COCCCn1c(=O)c2ccccc2n2c(SCC(=O)c3ccc(O)c(O)c3)nnc12 23939257 SHMSTVVUMYMQDE-UHFFFAOYSA-N 440.481 2.467 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NCc1ccc(C)c(S(C)(=O)=O)c1 436225404 SBRRWJZOUYUDOX-UHFFFAOYSA-N 432.523 2.033 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3cccc(NS(C)(=O)=O)c3)C=C2)cc1 467301395 NHNTYVCYPHPUJC-UHFFFAOYSA-N 445.522 2.041 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)CC4CCCC4)CC3)nc12 730808401 LPCZBDKPANBCSL-UHFFFAOYSA-N 429.521 2.226 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)c3ccccc3)cc2F)C[C@@H](C)O1 740946638 YXZHACHICMFRQB-MCFFVMPBSA-N 430.476 2.332 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 751227037 ASPQDRZKUUTCRZ-UHFFFAOYSA-N 439.484 2.363 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)nc21 754554024 WIWGBGOBWSZMTB-UHFFFAOYSA-N 427.420 2.416 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 755245103 QYZUGIFVRSSSIS-KRWDZBQOSA-N 435.569 2.030 10 20 IECD Cc1nnc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1C1CC1 756014886 USHJPJBRUYBGPZ-UHFFFAOYSA-N 433.515 2.419 10 20 IECD COc1cc(N2CCN(C(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc(OC)c1OC 760084896 BVLDDAXKONBFIU-UHFFFAOYSA-N 442.516 2.239 10 20 IECD O=C(O)[C@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 769523566 ZUDGSIBRGJAMCW-FNWMBBJUSA-N 426.541 2.042 10 20 IECD C[C@H](O)C[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770088390 IHYYAYZFAZRBIL-DZGCQCFKSA-N 449.485 2.477 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 773744418 BHWXOHOPRBWWRR-JTQLQIEISA-N 426.441 2.178 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1NS(C)(=O)=O 774296564 PBFPLXDAKYOVKI-UHFFFAOYSA-N 428.561 2.060 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(C[S@@](C)=O)c3)CC2)cc1 778284778 XFFTYGPNXACHHP-WJTGLZGKSA-N 441.553 2.417 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1 779648824 PPTJVQOWNUHPCB-SJORKVTESA-N 434.290 2.474 10 20 IECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 784640234 MYHNAJWPPFIPGC-UHFFFAOYSA-N 425.485 2.484 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1 785296255 MXNOMAXMAIXTHL-WIONRGSFSA-N 430.404 2.411 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 787685262 DEYMXFAOLRHYML-IBGZPJMESA-N 436.556 2.269 10 20 IECD Cn1ccc2cccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c21 788327290 IZIVVRGCONMTGA-GOSISDBHSA-N 433.512 2.135 10 20 IECD CC(C)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789818812 LDPAFJJRLYUAHB-JENIJYKNSA-N 435.540 2.329 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@]2(CCO[C@@H]2C)O1 790369500 PXCCHKKMVAHEBS-BERAWNTRSA-N 449.567 2.324 10 20 IECD C[C@H]1C[C@@H](N2CCOCC2)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 796377382 LGTHNIOPINPKCF-DLBZAZTESA-N 433.508 2.196 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H]1COC2(CCCCCC2)O1)c1ccc(N2CCOCC2)cc1 803312104 VIJLCEFXHFBIGS-GHTZIAJQSA-N 445.560 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@@H](C4CCC4)C3)CC2)cc1 817041746 KDPVDSMJSGRPFK-XTXLJPNXSA-N 427.545 2.175 10 20 IECD C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 920890387 ZTSNVSPVQVDCJZ-MRXNPFEDSA-N 435.521 2.208 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(Br)ccc1F 1116873327 WSRHEYCTLBGRJS-NSHDSACASA-N 427.226 2.299 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 1324163629 ZQAHLCPGZMTZHM-UHFFFAOYSA-N 445.545 2.024 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C 1326330775 ZOHPVWXEHRENDV-QXSJWSMHSA-N 434.489 2.086 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3c(F)cncc3F)sc2C1)c1cc(O)nc(O)c1 1820793480 MCRCPAJYXSRFJT-SECBINFHSA-N 447.423 2.162 10 20 IECD CCOC(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)OCC 1822561875 ZKORESYREVRXHT-HNNXBMFYSA-N 447.492 2.311 10 20 IECD CC[C@@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708303 QYEGUCYDWXBHMA-BXKDBHETSA-N 425.894 2.204 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424421 WVZWROMERZZTFL-QGZVFWFLSA-N 447.532 2.458 10 20 IECD Cc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428511 SLLTYWSMHYYUBM-KRWDZBQOSA-N 425.489 2.138 10 20 IECD NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831407488 OCXMCODXYLXZPV-MRXNPFEDSA-N 437.924 2.250 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccnc1Cl 1848139008 VWAXIHLAIKDZBS-IRJXADNDSA-N 443.887 2.310 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1F 731409054 JUIQQDLJTJANFM-UHFFFAOYSA-N 425.468 2.211 10 20 IECD CCN1CCC[C@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 745649215 SBRMCRMPNANBQK-FQEVSTJZSA-N 435.588 2.220 10 20 IECD COc1cccc(CNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1O 745793722 RJRUBDJQGHWVHK-UHFFFAOYSA-N 432.908 2.202 10 20 IECD CCOC(=O)C1(O)CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 745972812 IWAYERBGPSHXTK-UHFFFAOYSA-N 448.226 2.169 10 20 IECD COCCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc3c(c2)CCCN3C)cc1 758543376 FIHUCFLSRMOXQH-UHFFFAOYSA-N 431.558 2.489 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H](C)NC(=O)C3CCCCC3)CC2)cc(OC)c1OC 759402639 ACIKMOWTBKSAHT-MRXNPFEDSA-N 433.549 2.446 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NC1CCN(C(=O)C2CCCCC2)CC1 759595174 IZAYTXNGDLBORX-CLFYSBASSA-N 430.501 2.342 10 20 IECD COc1cc(C)c(N)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 759746531 LNYJXNRRDUSSQI-UHFFFAOYSA-N 431.464 2.035 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccccc3S(C)(=O)=O)CC2)cc(OC)c1OC 759930002 HZORRYIOXQKIAD-UHFFFAOYSA-N 449.529 2.470 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4ccc(F)cc4C)nn3)CC2)cc1 767334514 NFMQJUCRJKATDE-UHFFFAOYSA-N 438.507 2.275 10 20 IECD CCOc1ccc(CN2CCN(S(=O)(=O)c3cc(C(=O)OC)cs3)CC2)c(O)c1 768212515 KVSFTOSVXDSTDP-UHFFFAOYSA-N 440.543 2.146 10 20 IECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 772776200 OVJIRGXFWFASRE-HTZNOQTFSA-N 438.358 2.215 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)c1 777508304 XFCDJLMIAOPNQQ-HNNXBMFYSA-N 441.868 2.092 10 20 IECD COc1ccc(N2CCN(CCNC(=O)/C=C/C(=O)Nc3ccc4n[nH]cc4c3)CC2)cc1 778668394 VWOVOAIXRWUUIR-CMDGGOBGSA-N 448.527 2.005 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc4c(cc3C)OCO4)cc2F)CC1 781514176 FQBAQZPPWQAJLW-UHFFFAOYSA-N 442.491 2.260 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)n1 784768320 VYDPBVKTQJTVKX-OAHLLOKOSA-N 448.907 2.177 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)nc1Br 786657542 ZKOHYUREBTWJJL-UHFFFAOYSA-N 447.333 2.451 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1csc(-c2ccco2)n1 788332490 OBPKBQMTBKWYID-UHFFFAOYSA-N 426.498 2.172 10 20 IECD CCO[C@H]1C[C@](O)(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 788690543 KHBAYRASDPGGIC-URXFXBBRSA-N 448.608 2.073 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 789811725 GONNFJKWOUALNY-NRFANRHFSA-N 445.466 2.018 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H]3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 789835934 RNKXOXFFZMVICF-NUJGCVRESA-N 433.524 2.273 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)N1CC[C@@H](C2CC2)C1 789949405 ICUHZJBFJNVLJD-MRXNPFEDSA-N 425.451 2.417 10 20 IECD CC(C)(C)OC(=O)NC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)(C)C 799091769 ZGLNAIZPFBILSN-HNNXBMFYSA-N 429.539 2.433 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCN(CCc4ccccc4)C3)ccc21 803648036 UBKHPBQKUGPOIE-JOCHJYFZSA-N 434.584 2.366 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCc4sccc4[C@H]3C)CC2)cc1 803752943 VSBRJECQIPZTAN-QGZVFWFLSA-N 442.585 2.141 10 20 IECD COCc1cc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1F 804315690 QBBCBBXDQCFTRR-UHFFFAOYSA-N 429.492 2.382 10 20 IECD CN1CCN(CCNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1(C)C 806787053 DLIRLPKDNIPPFJ-UHFFFAOYSA-N 430.593 2.196 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(C[C@H]1CCOC1)C1CC1 807771891 YPXZMGIUVYUPGT-CVEARBPZSA-N 437.487 2.401 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(-n2cc(C(=O)OC)nn2)c1 812984519 JGRRLIXWUHIGHX-UHFFFAOYSA-N 437.456 2.137 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 914687418 JKCTZZZWXZKIKG-SFHVURJKSA-N 433.578 2.152 10 20 IECD CC(C)[C@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676836 VSSQUTKFKGUKOF-IBGZPJMESA-N 449.598 2.054 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(NS(C)(=O)=O)cc3)CC2)cc1 918008006 JSJDTIZLQGDYQH-UHFFFAOYSA-N 432.546 2.489 10 20 IECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1C[C@@H](C)C[C@@H](C)C1 920636308 QRTUKXXGTGPUNG-QWQRMKEZSA-N 426.535 2.450 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1)c1ccc(N2CCOCC2)cc1 920927387 WNOCFQSLQXQXSQ-INIZCTEOSA-N 436.512 2.231 10 20 IECD Cc1ncc(Br)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 1326308724 WHJJGRYWLBDSQH-CQSZACIVSA-N 432.322 2.179 10 20 IECD Cn1cccc1C(=O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791920887 HRPNEVJFOLECGZ-UHFFFAOYSA-N 434.452 2.462 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2CC(O)C2)C3)cc1 1799619848 FXAVDCHEOSGJBM-HLALYHJFSA-N 437.540 2.068 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)[C@@H]3C[C@@H]3F)C2)CC1 1806456461 KFCLDHIKHWNASI-MSOLQXFVSA-N 426.492 2.369 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2onc3ccccc23)C1 1845638299 YVFQDHNLXIYTOG-VQHVLOKHSA-N 435.436 2.475 10 20 IECD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1845901894 CUEBSEACAJSLEC-AWEZNQCLSA-N 449.573 2.068 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 110359444 IKWNMBFZOWXNAO-HJPURHCSSA-N 428.533 2.281 10 20 IECD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 110362316 YBHUYHFGYZSTOX-UHFFFAOYSA-N 426.517 2.363 10 20 IECD COc1cccc(CNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1O 727762481 KRQZVHVVHJXBPK-UHFFFAOYSA-N 448.419 2.284 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c[nH]c(C(=O)N4CCCC4)c3)cc2F)CC1 730235201 OFBHSTNNSCKIGD-UHFFFAOYSA-N 427.524 2.462 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1cccc2c1CCCC2 737244847 BGGVLOYZWDLPMP-UHFFFAOYSA-N 441.553 2.055 10 20 IECD CC[C@H](C)NC(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748035913 OOTMZCNVJQSDDN-LBPRGKRZSA-N 425.532 2.289 10 20 IECD C/C=C(/C)C(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 750895433 IBSOQANIXZAWKA-KYCSPVIHSA-N 448.522 2.242 10 20 IECD CCCN(CC)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 751345139 JICITGFINVCJBL-UHFFFAOYSA-N 430.574 2.483 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2nc(O)c3cnn(C)c3n2)cc1 751405230 JQRPYCUIVSWKFC-SFHVURJKSA-N 438.532 2.275 10 20 IECD CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)COC(=O)c1cccc(O)c1O 758559231 RIJZKTGDLOLLFR-UHFFFAOYSA-N 426.347 2.371 10 20 IECD O=C(Nc1ccn(Cc2ccccn2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 759022296 KTYMQLLACJESKQ-IBGZPJMESA-N 435.484 2.178 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCC(n4cnc(C(N)=O)c4N)CC3)c2C)cc1 773500077 ZEUDNBYXCZWCGZ-UHFFFAOYSA-N 436.516 2.458 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1)c1ccc(N(C)C)cc1 773854875 CSMSDAUVFUAQHN-INIZCTEOSA-N 437.544 2.270 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 779479672 MSSVXTLGPPBQMT-WOJBJXKFSA-N 427.526 2.438 10 20 IECD CCCn1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cn1 781698817 VGLMEEDFVTWOGU-UHFFFAOYSA-N 444.513 2.388 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)cc1F 788990246 PNNQWDGTVJNZGI-KRWDZBQOSA-N 426.558 2.381 10 20 IECD COc1ccc(F)cc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789078246 ZAPUKDYPOHQASC-AWEZNQCLSA-N 447.482 2.428 10 20 IECD COc1ccc2c(c1)CN(C(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)CC2 789847849 XKFFQLINQGMUSN-UHFFFAOYSA-N 425.554 2.450 10 20 IECD Cc1cnc(COCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)o1 803899842 NUBLVEUFUVXPTB-UHFFFAOYSA-N 434.404 2.457 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(N2CCNC2=O)CC1 917161688 PCXDFQQMPMOSEH-HNNXBMFYSA-N 446.507 2.279 10 20 IECD CCc1c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cnn1-c1ccccn1 919113421 IZJHZXAOGCWLPD-UHFFFAOYSA-N 449.511 2.344 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2cccnc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993873 PAQVNWHYTOTOMO-UEFYJELNSA-N 445.479 2.316 10 20 IECD CC[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)N(CC)CC 1810547956 ZWXVBXUTFGQHKL-SFHVURJKSA-N 432.565 2.458 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848383 GXBWZBDAZDXHRF-AWEZNQCLSA-N 445.476 2.111 10 20 IECD O=C(CSc1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251122 YEYZEOZEZYCLPN-UHFFFAOYSA-N 444.469 2.010 10 20 IECD O=C(CC12CCCN1CCC2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442707 VJCJYPRLQAIVDB-UHFFFAOYSA-N 449.555 2.001 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)cc1Cl 1847362116 YGSJSMLQHYDSQV-GJZGRUSLSA-N 437.974 2.324 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1 9932606 LDIQBWWUVJMLDT-UHFFFAOYSA-N 448.589 2.164 10 20 IECD NC(=O)C1CCN(c2ncccc2CNC(=O)NCc2ccc(N3CCCC3)cc2)CC1 729223302 CZPIEZQZFDXMEL-UHFFFAOYSA-N 436.560 2.383 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccnc3OC(C)C)cc2F)CC1 730390814 BEWGEJYVNYOARH-UHFFFAOYSA-N 443.523 2.405 10 20 IECD CCOC(=O)[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 731842661 IAKDKFOBGQMVLE-HSZRJFAPSA-N 439.556 2.450 10 20 IECD Cc1cc(C(=O)CN2CCN(C3CCC3)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 734150785 AOYPJWFXGAWNEF-UHFFFAOYSA-N 430.574 2.094 10 20 IECD C[C@H](Nc1ccn(CC(=O)N(C)C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 734157373 BDQLQDFUORJPQD-AWEZNQCLSA-N 445.479 2.186 10 20 IECD Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c1 736622330 SAKJZCBSLUHOJB-HXUWFJFHSA-N 438.572 2.289 10 20 IECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 741181656 AOWIQARFCGEAQN-VQTJNVASSA-N 443.592 2.082 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)n3nnc(-c4ccccc4)n3)CC2)cc1 742491384 LMSXHJLIFGABEK-IBGZPJMESA-N 449.559 2.238 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2cccc(OC)c2O)c(Br)c1 751308892 FMYAXKVRWHMKMV-UHFFFAOYSA-N 430.276 2.428 10 20 IECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 760841595 YFSONYWKLBUDRM-SFHVURJKSA-N 440.479 2.435 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 765114816 HQIZYKWYZSFRMM-CYBMUJFWSA-N 445.950 2.232 10 20 IECD Cn1cc([C@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 766765209 RGODURKRHFMWBB-GHTZIAJQSA-N 431.512 2.194 10 20 IECD CCNS(=O)(=O)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 771467318 SIIOIGQTFCLVBX-GOSISDBHSA-N 447.557 2.062 10 20 IECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)s1 773282608 NYULMNDXOOOREK-UHFFFAOYSA-N 445.632 2.117 10 20 IECD CC1(C)CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS1(=O)=O 773970989 KSGLOFXGQVVJNF-UHFFFAOYSA-N 440.521 2.300 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1 774362690 DFFYVSJJSLMNAM-UHFFFAOYSA-N 431.876 2.285 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1C 780409184 SDYVEHKROCXFHI-UHFFFAOYSA-N 431.514 2.251 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@@H]3CCC[C@@H](C)C3)CC2)cc1 785527615 MDGWPAABMBGCCF-TZIWHRDSSA-N 430.593 2.361 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C(=O)c2ccoc2)CC1 786652304 YVXOYBLTKPEYKF-UHFFFAOYSA-N 426.517 2.115 10 20 IECD COc1ncccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787280316 MWSMABSIOMAEDY-HNNXBMFYSA-N 434.443 2.093 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(O[C@H]4CCOC4)cc3)nc12 789205662 NXMDGDUATJKHDK-INIZCTEOSA-N 427.413 2.136 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 789818713 KJJCAULSWLJAQM-CALCHBBNSA-N 435.540 2.379 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccn(CC(F)F)n1 789904567 SALUSHFOFLJPHQ-UHFFFAOYSA-N 445.449 2.334 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cn1cccn1 790218468 YMZLUGCWQIAXHP-HZPDHXFCSA-N 435.475 2.022 10 20 IECD COc1cc(N2CCN(CCS(=O)(=O)Cc3ccccc3)CC2)cc(OC)c1OC 791489487 CHTOAFYVWBGHQH-UHFFFAOYSA-N 434.558 2.449 10 20 IECD O=C(NCCCCn1ccnc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793722248 AZUPJYUYEGUGAP-INIZCTEOSA-N 435.475 2.166 10 20 IECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803312283 WPYHXQBCVMQXRN-RBUKOAKNSA-N 436.556 2.268 10 20 IECD CN(Cc1cc(Br)cn1C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662675 ZLUIFZPTFQDNQU-UHFFFAOYSA-N 425.302 2.268 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCNC(=O)C(C)(C)C)cc2Cl)C1 804098383 VCFJTTRYATVHOP-OAHLLOKOSA-N 436.984 2.471 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@H](c4cccs4)C3)CC2)cc1 804316790 JOROMVVZXBLSCS-IBGZPJMESA-N 429.542 2.442 10 20 IECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)c1 807671971 VRSWMLXAGGLNFX-SJLPKXTDSA-N 440.544 2.342 10 20 IECD CN(Cc1cccc(O)c1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854206 SWENXLCMNOSVFE-UHFFFAOYSA-N 436.556 2.199 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3C[C@H](C)O[C@H](C)C3)CC2)cc1 916196961 STIDLRYCUDDXPH-OYRHEFFESA-N 447.624 2.006 10 20 IECD CCCNC(=O)CN1CCC(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 916518693 GTZLVMLWVGIOHO-HXUWFJFHSA-N 432.565 2.073 10 20 IECD CN(C)c1ccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)cc1 917999577 UUFMHQYPOPVYNF-OAQYLSRUSA-N 440.544 2.426 10 20 IECD CS(=O)(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918201790 NEODMDNMAKBKQQ-UHFFFAOYSA-N 446.573 2.266 10 20 IECD C[C@H](NC(=O)NCc1cccc(NS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920866444 DVCBDGPJNJDJHJ-INIZCTEOSA-N 432.546 2.455 10 20 IECD CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1319929070 TWLJMJSAURQSQW-GOSISDBHSA-N 426.521 2.294 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC=CCC3)C2)C1 1781161043 LYXVOAKNPJMWSD-NRDKSBKSSA-N 428.485 2.003 10 20 IECD NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1791269148 HRWRLTGXJKYPBH-UHFFFAOYSA-N 447.495 2.179 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)C3CCC(CO)CC3)C2)CC1 1806727654 UUWYRUVXODJIMM-UHFFFAOYSA-N 431.533 2.136 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ccn1 1807996090 XSYMCLPHFWNVNO-LAUBAEHRSA-N 433.468 2.225 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)C(F)F)sc2C1 1812659947 BUDKCAGXZVDWIS-BBJBCUTESA-N 425.413 2.150 10 20 IECD O=C(CCCn1cccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813450283 XAZCRGNHXLIFEW-JPYJTQIMSA-N 449.511 2.489 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814191564 KQTJDKAQGOAOIU-ALIJUJOJSA-N 446.598 2.304 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCCC2)[nH]n1)c1cc(O)nc(O)c1 1817845076 XJQWGJJGBVRXOY-INIZCTEOSA-N 428.493 2.008 10 20 IECD CC[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1824081108 XYXMFVMCQSGKHG-SFTDATJTSA-N 440.544 2.170 10 20 IECD O=C(c1cccc2nc[nH]c12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441572 IQEKNNCBSGZSBZ-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 23403775 VUHYLCGFTDNKAW-UHFFFAOYSA-N 428.514 2.027 10 20 IECD NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccccc2-n2cnnn2)c1 728836008 RIXBQAPVLRRIKV-UHFFFAOYSA-N 427.468 2.407 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1 729535080 JJHQIUWBVUWMDD-SSDOTTSWSA-N 435.321 2.363 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)C1 730175708 UJCVQTYNVQOGCU-MSOLQXFVSA-N 438.503 2.197 10 20 IECD CCS(=O)(=O)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 732603919 AKAAHWCOOIXOGG-XFFZJAGNSA-N 449.373 2.116 10 20 IECD Cc1cc(C(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)n1-c1ccccn1 735059528 GDEKWNYWPRAUFE-UHFFFAOYSA-N 443.485 2.106 10 20 IECD Cc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1S(N)(=O)=O 737111674 ZZIWAXOFIYEMHO-UHFFFAOYSA-N 443.481 2.109 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccccc3SCCC(N)=O)ccc21 737168212 ZZJOGMZVKLIFFI-UHFFFAOYSA-N 426.542 2.291 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)CC1 741097057 JXPOSMHFHASNPU-UHFFFAOYSA-N 433.556 2.460 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnc(OCC(F)(F)F)c1 741673895 LZECJJDYHOKVIS-UHFFFAOYSA-N 443.447 2.188 10 20 IECD CCCNC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 747836644 CENPBKFELHOVTD-CMKODMSKSA-N 448.583 2.294 10 20 IECD CC(=O)NC1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 747856225 JIAIMGASQLUWNH-UHFFFAOYSA-N 428.455 2.352 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C)c2cnn(C)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750560847 XQVIFZNXNJJQLW-AWEZNQCLSA-N 444.513 2.005 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cc(C(N)=O)n(C)c3)c2C)c1 750681030 WNSLDJMPDDWJQN-UHFFFAOYSA-N 428.514 2.267 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)C2 752302539 MQLBAVHURDURFA-HNNXBMFYSA-N 431.492 2.391 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](C4(C)OCCO4)C3)CC2)cc1 753094591 MNCFKUXUGWJKBV-FQEVSTJZSA-N 446.592 2.392 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1=O 754461809 HWOAOUTWCZKLBX-UHFFFAOYSA-N 430.530 2.286 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)cc2F)C[C@@H](C)O1 760535920 XUVHTEUOZIHGSJ-HZPDHXFCSA-N 439.491 2.254 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cn4nc(C)c(Cl)c4C)n3)CC2)cc1 771055643 HUXVYERGRNEBJY-UHFFFAOYSA-N 444.923 2.485 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C(=O)O)sc2C(C)(C)C)ccc1O 773250445 DFZVLMBJLPZIGK-UHFFFAOYSA-N 448.544 2.158 10 20 IECD CC[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)ccc1O 775523644 LDFVWWAFQQMOBG-RDJZCZTQSA-N 426.355 2.129 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCO[C@@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 776422329 YTNVBBHCYSYOPM-HOCLYGCPSA-N 434.514 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccc3)C[C@H](C)O)CC2)cc1 778288469 DOAZKMHTLAFOMJ-SJFMBGHLSA-N 437.540 2.310 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CCC[C@H]1CCO 779540397 QZWSISPTXRYHEK-ICSRJNTNSA-N 442.539 2.293 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1 784026573 BBMOCWFGHCYAGP-UHFFFAOYSA-N 434.514 2.193 10 20 IECD CCC1(CNC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1 785530230 NFCFGPVUIGHHHB-UHFFFAOYSA-N 430.593 2.410 10 20 IECD Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 787473361 LLDJJIIUZVTESQ-UHFFFAOYSA-N 425.514 2.240 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1 787736597 MEVHFSALMUDCNF-JOCHJYFZSA-N 432.524 2.159 10 20 IECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1(C)C 789816103 BUSJNEQVSIUJAP-PREKQLOASA-N 435.540 2.375 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823751 FXFCVHZKKZIYTR-KZNAEPCWSA-N 434.556 2.046 10 20 IECD C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793717136 HHSIQLGPVVOOSP-BVYCBKJFSA-N 448.567 2.409 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H]3c3ncc[nH]3)cc2F)CC1 805010192 XAEFNSBQLJKJGV-FQEVSTJZSA-N 442.539 2.061 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F 806568999 GZZMRGIYEOREOA-MRXNPFEDSA-N 438.516 2.495 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCN(c3ncccc3F)C2)C2CC2)cc1 807912379 IVNHUHDLUIXHLH-QGZVFWFLSA-N 425.508 2.173 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)[C@@H]1CCOC1 807954954 IXFHYULOVSORSY-FUHWJXTLSA-N 437.968 2.456 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCC4=O)cc2)CC1 814390725 KVGXQZCNACSKLS-UHFFFAOYSA-N 441.553 2.353 10 20 IECD Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 918138061 GQOASEQQTDOMEV-UHFFFAOYSA-N 449.548 2.264 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1 919810234 JUDLZAQKFWHTFY-CQSZACIVSA-N 433.534 2.101 10 20 IECD CCOCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781122993 KOOLFICAWJMLKJ-DYESRHJHSA-N 440.924 2.305 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccncc1F 1804286688 YMHYSJYMMNNUIM-BPQKRJORSA-N 427.432 2.303 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810550911 XQYCHBGGEHUKLI-INIZCTEOSA-N 427.505 2.104 10 20 IECD O=Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816722684 URGURAYDUJEHNB-JTQLQIEISA-N 444.494 2.363 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccn(C(F)F)n2)[nH]n1)c1cc(O)nc(O)c1 1817845816 ABIZABODIMHXOY-CYBMUJFWSA-N 447.402 2.427 10 20 IECD CC(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831400734 CEOCYGQMVVFFMS-KRWDZBQOSA-N 437.924 2.121 10 20 IECD CCOCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877670 XIZBCTRHGGBAOO-KOEDOTQGSA-N 432.517 2.473 10 20 IECD O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12 731808843 JQWMVBSBKLSGOH-UHFFFAOYSA-N 438.513 2.018 10 20 IECD COC(=O)CN(CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)Cc1cc(Cl)ccc1O 731845180 QQQZBRHZQNSGKV-UHFFFAOYSA-N 449.847 2.098 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1F 732098256 UHHWJQNMKADILB-NRFANRHFSA-N 434.556 2.001 10 20 IECD CC(=O)N(C)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738916398 LXFLFZFTHROMIQ-UHFFFAOYSA-N 430.530 2.226 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(N4CCCS4(=O)=O)cc3)c2)CC1 739767319 YVIXGPQURZDNHS-UHFFFAOYSA-N 442.541 2.181 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1 743362845 JYLHHNMMJKAARC-QHCPKHFHSA-N 425.577 2.419 10 20 IECD CN(c1ccc(CNC(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1)C1CCCCC1 748570011 HRSITPSOUFLEOP-UHFFFAOYSA-N 444.557 2.358 10 20 IECD COC(=O)COc1ccccc1[C@H](C)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753660833 BOTAKBXDRMKNRG-KRWDZBQOSA-N 432.542 2.324 10 20 IECD CCN(CC)CCNC(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1OC 753923177 DHHKVOZKSWDKGY-UHFFFAOYSA-N 447.517 2.104 10 20 IECD CCc1nc([C@@H]2CCCCN2C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)no1 754013315 ROIZMTNCDUNWDX-FPOVZHCZSA-N 429.565 2.351 10 20 IECD COc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1[N+](=O)[O-] 759163883 JSADKDGGETYSTO-UHFFFAOYSA-N 435.867 2.429 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)CC2)cc(OC)c1OC 759984561 DBEFSNRZSIFIAI-SFHVURJKSA-N 445.520 2.442 10 20 IECD CCOc1nccc(C)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 769072822 IJUGETGSXOXLGK-UHFFFAOYSA-N 431.464 2.238 10 20 IECD Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769749505 OHJGZPNJGDEKOH-INIZCTEOSA-N 435.527 2.226 10 20 IECD C[C@H]1CN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CCN1c1nccn2cnnc12 771174551 WUOLJUNNZISJSI-INIZCTEOSA-N 444.495 2.477 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(C(F)(F)F)cn1 772956483 YXENYMSMTWHICH-UHFFFAOYSA-N 440.397 2.456 10 20 IECD CC(=O)N1CCCCC[C@@H]1C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785427257 BPBQNWAIQKGSKW-JOCHJYFZSA-N 428.577 2.399 10 20 IECD C[C@@H](OC(=O)CCCCNC(N)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785566179 LTCZZYQIUUSCKA-CYBMUJFWSA-N 437.452 2.171 10 20 IECD COc1cccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1OC 787922570 CLIAWQKFZCSFOQ-QGZVFWFLSA-N 441.528 2.077 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)COCc1ccccc1 788320932 RTKSOEFUSSLJBV-IBGZPJMESA-N 425.529 2.109 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccoc2CC(N)=O)NC(=O)OC(C)(C)C)cc1 796728846 MRFYDUVKIIOGDV-QGZVFWFLSA-N 430.505 2.369 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(Cc2cccs2)CC1)c1ccc(N2CCOCC2)cc1 803298760 DJKBYDWRRRZWOS-SFHVURJKSA-N 442.585 2.106 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(N2CCOCC2)cc1 803301120 ZEVZZBXNQWDWCW-VGOFRKELSA-N 439.512 2.006 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(c4nnc5ccccn45)CC3)ccc21 803686074 UZYVFCGUAPTGMN-UHFFFAOYSA-N 432.528 2.134 10 20 IECD COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457814 RQHATMORLSXXEX-LJQANCHMSA-N 447.429 2.424 10 20 IECD C[C@H](O)CN1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H](C)C1 806683709 BNPPBLGQZZPYKN-HOTGVXAUSA-N 426.508 2.353 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc(OC)c1OC 806928463 UAMKOHPSOWEVBP-YESZJQIVSA-N 433.549 2.302 10 20 IECD Cn1c(=O)ccc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc21 807387049 WRKHUNAZEQXRGF-UHFFFAOYSA-N 430.258 2.262 10 20 IECD CC(C)(O)CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 807769445 UKESKPOGYMBNBY-CQSZACIVSA-N 425.476 2.135 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@H]2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC[C@H]21 816999667 CCOKWQVOJDNPIK-CZUORRHYSA-N 439.534 2.235 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3c(C)oc4ncnc(O)c34)CC2)cc1 849192398 CVQYCHWOFAVDFA-UHFFFAOYSA-N 425.489 2.188 10 20 IECD COc1cc2c(cc1OC)CN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 916998276 LUPDQVIWADFNTC-UHFFFAOYSA-N 443.519 2.354 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 917371671 PEFYMTTYJUKMKA-PTNGSMBKSA-N 430.526 2.469 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 918742481 KINCEHSWAVYKEH-UHFFFAOYSA-N 437.587 2.084 10 20 IECD CCc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919391482 IUJPGDHGIPBMKU-GASCZTMLSA-N 430.480 2.265 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242235 XLLYQZJWKXBJCI-GYOIFBIXSA-N 449.866 2.192 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nc1 1795232919 VEZJBPGPCFICIW-GGPHIMKMSA-N 431.496 2.435 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843593 SFFXFRAETWVYDU-CVEARBPZSA-N 428.493 2.006 10 20 IECD Cc1noc(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843760 YKDTVVDNMHCNPI-MRXNPFEDSA-N 440.460 2.369 10 20 IECD O=C(/C=C/c1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428640 AHIBQIDHUBLTDE-WRFKIARRSA-N 425.489 2.163 10 20 IECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1O 1845302086 IKMUWTKIUHAFMF-UHFFFAOYSA-N 432.480 2.311 10 20 IECD CCOC(=O)[C@@H]1CCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 727227674 FWYNBBIDZYUEBM-FQEVSTJZSA-N 447.557 2.342 10 20 IECD CCN(CC(=O)Nc1ccc2c(c1)OCCO2)CC(=O)N(C)Cc1ccc(N(C)C)cc1 727238507 ZVZNGEOFBVJNMN-UHFFFAOYSA-N 440.544 2.443 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1 729062893 GIQFNMKERPJWJC-QLFBSQMISA-N 428.489 2.225 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cncc(-c4cnn(C)c4)c3)CC2)cc1 731183568 JUAFNILKURPSHZ-UHFFFAOYSA-N 434.544 2.433 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(Cn2cccn2)cc1 738916867 QJSRUIHKUQQXGT-UHFFFAOYSA-N 439.541 2.488 10 20 IECD C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 749125491 HJAKAJSLERBTAZ-PXNSSMCTSA-N 444.601 2.489 10 20 IECD O=C(CN1CCC[C@H](Cn2ccnn2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 752062686 CKCCVYUGNUVXFN-INIZCTEOSA-N 429.480 2.404 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O 755191970 LYDANYFLIWMLLI-UHFFFAOYSA-N 444.557 2.062 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cn(Cc2cccc(F)c2)nn1 759224368 OLCCIEXRQDKKMI-UHFFFAOYSA-N 427.455 2.496 10 20 IECD COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc(C(=O)OC)c1 759595032 PHPAAICHIOVYLB-PZBABLGHSA-N 443.408 2.255 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(=O)n(-c2ccccc2F)n1 765844912 VDCIPBYDFMLTBA-UHFFFAOYSA-N 440.450 2.402 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 765925491 GQQROTGFGCLVRA-UHFFFAOYSA-N 448.195 2.134 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnc(CO)n3C3CC3)cc2F)C[C@H](C)O1 767217817 TWRSDGZQOUHCFJ-KBPBESRZSA-N 449.552 2.267 10 20 IECD COc1cc(O)c(CN2CCN(C(=O)c3ccc(OC)c(OC)c3OC)CC2)cc1OC 768465355 ZRLLMLNGVSOCQR-UHFFFAOYSA-N 446.500 2.393 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cs1 773630633 VAAHJFZLIABARJ-AWEZNQCLSA-N 437.591 2.295 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc([S@@](C)=O)c(F)c3)CC2)cc1 774152766 JVAORJJWHVYOHA-SSEXGKCCSA-N 433.505 2.249 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 774356122 IBFWDVBRNNTGHK-IBGZPJMESA-N 449.511 2.039 10 20 IECD C[C@H](NCC(=O)NCC1(N2CCOCC2)CCCCC1)c1ccc(N2CCOCC2)cc1 775255151 PNPLDSLGYKUXAQ-NRFANRHFSA-N 444.620 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3ccc4c(c3)CC(=O)N4)CC2)cc1 778235100 VMGIFTQMBBJNNA-DOOKAGJSSA-N 448.523 2.272 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CC(C)C)C3CCN(C)CC3)CC2)cc1 778275008 DZQIWUAZQIGJKP-MDZDMXLPSA-N 442.604 2.479 10 20 IECD CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 778686209 VJAMNTUUXROEFE-UHFFFAOYSA-N 429.473 2.420 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n(C)c1 779343052 XTNBDSMLPNJTAB-UHFFFAOYSA-N 437.477 2.303 10 20 IECD Cn1cc(-c2ccc(F)c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)cn1 782579235 HFQNZWDNASZJIQ-UHFFFAOYSA-N 442.516 2.391 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nccn1C 785644767 SGMYLWBTUMPBSM-HXUWFJFHSA-N 439.491 2.156 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(Br)n1 786146821 UGUOEANJIJFQAW-UHFFFAOYSA-N 439.335 2.401 10 20 IECD C[C@@H](C1CCCCC1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735362 XNQQXQMJSWJSNM-PXNSSMCTSA-N 428.577 2.432 10 20 IECD O=C1C[C@H](c2cccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)c2)CN1 807386721 GGYJCOKQZUUKTA-LBPRGKRZSA-N 432.274 2.013 10 20 IECD COc1ccc(N2CCCN(c3nnc(C(=O)NC(C)C)n3C[C@H]3CCCO3)CC2)cc1 812307450 DXWPSNMGZOWPFJ-HXUWFJFHSA-N 442.564 2.321 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](CO)(c4ccccc4)C3)cc2)C1 813044275 WCTGIVDDLKKDFU-CJFMBICVSA-N 436.556 2.234 10 20 IECD Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917930917 ZIHNHENCVRQQJX-MRXNPFEDSA-N 432.502 2.083 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1 918429698 MQICQOPKFDAAFT-UHFFFAOYSA-N 444.557 2.328 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(-c2nncn2C)c1)c1ccc(N2CCOCC2)cc1 920922601 GQLUQBHZTMQDDS-MRXNPFEDSA-N 434.500 2.135 10 20 IECD O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1319033284 OPHCHGVIMIWNPL-CYBMUJFWSA-N 449.554 2.385 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnnn1-c1ccccc1Cl 1320520447 YYLVXMKOHDWACV-AWEZNQCLSA-N 430.848 2.236 10 20 IECD Cc1n[nH]c(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286371 SEBUOQMAJIAMIF-SEDYWJOHSA-N 426.473 2.109 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1[C@H]2SC=C[C@H]21 1821706272 BMWKHFBGZOEFTA-WQVQDQMGSA-N 427.486 2.397 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncc[nH]1)CC2)c1cc(O)c(O)c(Cl)c1 1823707886 FSFIBJHJMXNRHR-VIFPVBQESA-N 433.877 2.470 10 20 IECD O=C(c1cc(O)ccc1F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442204 DOJAPOHAKRQDEV-UHFFFAOYSA-N 436.443 2.141 10 20 IECD O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)N[C@H]1CCS(=O)(=O)C1 11643510 JFSLAOAIZXSVCC-DLBZAZTESA-N 435.571 2.125 10 20 IECD O=S(=O)(Nc1ncccn1)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 13948410 KTTGYLXSTWNQLE-UHFFFAOYSA-N 448.511 2.083 10 20 IECD CNc1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1[N+](=O)[O-] 36225350 PORPQKWATLXWAQ-UHFFFAOYSA-N 428.445 2.151 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)CC2)cc1 726726242 QIFNPBPQMDTZNR-CQSZACIVSA-N 438.484 2.138 10 20 IECD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2=O 731856869 UTZWRHPXKVINAH-UQNRQAKVSA-N 429.517 2.401 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN(C)[C@@H]2CCN(CC(F)(F)F)C2=O)c1 732798916 MJBIRRRBKYCVBV-GOSISDBHSA-N 443.466 2.022 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1 734687556 IJUQIFDFTLKYSW-RTBURBONSA-N 429.609 2.393 10 20 IECD Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2=O 740083378 HECOCNQVGADPIE-UHFFFAOYSA-N 425.460 2.008 10 20 IECD CN(c1ccc(CNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1)C1CCCCC1 742416216 OLWVWUMHGJTWQS-NQIIRXRSSA-N 447.601 2.107 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3CCCN3C(=O)OC(C)(C)C)nc12 745453328 KBALOBSGZWYZMP-CQSZACIVSA-N 448.476 2.444 10 20 IECD CCO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 745692484 WBUXHARLVRPVLG-WBVHZDCISA-N 444.536 2.210 10 20 IECD C[C@@H](OC(=O)c1ccc(C(N)=O)o1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747179895 WUZOETTZPVUXGR-LLVKDONJSA-N 432.388 2.338 10 20 IECD COc1ccc(Cc2nnc(SCC(=O)N(C)Cc3ccc(N(C)C)cc3)n2N)cc1 749162975 WJXBRTLMCGSANU-UHFFFAOYSA-N 440.573 2.408 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CC(=O)N(CCN4CCOCC4)C3)c2C)c1 749394255 UWSWRKWVMUHRGN-NRFANRHFSA-N 438.572 2.374 10 20 IECD Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NCCCSc1nccs1 749730877 YMAYHXBVMYUDJZ-UHFFFAOYSA-N 448.570 2.161 10 20 IECD COc1ccc(N2CCN(C(=O)c3sccc3S(=O)(=O)N(C)C)CC2)cc1F 753739999 XKMIAFBEDAOBKK-UHFFFAOYSA-N 427.523 2.109 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(NC(C)=O)cc3F)CC2)cc1F 754040815 YOOQKMNSKDYJFX-UHFFFAOYSA-N 425.457 2.443 10 20 IECD CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 767976826 BLWXRPBUTSOIHQ-KRWDZBQOSA-N 439.528 2.333 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(O)(c4ccccc4)CC3)CC2)cc1 768588035 CXBGZEQLHHCYFS-QXMHVHEDSA-N 449.551 2.410 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(C)nc3-c3cccs3)nc12 768690479 XKMVXFRHACMELD-UHFFFAOYSA-N 427.442 2.431 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(OC)c(S(=O)(=O)N(C)C)c3)c2)CC1 770146693 HOAYZOPMHHPYDK-UHFFFAOYSA-N 446.573 2.340 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 772457492 WTOLDEPMGSVPJK-LJQANCHMSA-N 443.592 2.050 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)cc1F 772559959 WGXSKOJPOUSVNW-UHFFFAOYSA-N 441.550 2.155 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(Cn4cncn4)CC3)cc2F)CC1 779559146 YLMPQNHTTIJMPY-UHFFFAOYSA-N 429.544 2.181 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 784467735 WICQFWGFOXQTLP-RTBURBONSA-N 428.533 2.428 10 20 IECD CCC(=O)Nc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 787081279 KYCRRVUUDWXMBJ-KRWDZBQOSA-N 438.528 2.365 10 20 IECD C[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C[C@@H](CO)O1 787480428 YDVUNMJNBDYPQT-DVTVXSLWSA-N 426.585 2.338 10 20 IECD COC(=O)c1cncc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)c1 788543577 AIBYXRZIQQOMPQ-UHFFFAOYSA-N 436.471 2.022 10 20 IECD CC1CCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789823714 FETVFGBIIXYUJZ-QYZOEREBSA-N 448.583 2.292 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCOC2(CCSCC2)C1 789862541 VKKDVKWWBVMDNR-SFHVURJKSA-N 449.642 2.417 10 20 IECD COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1OC 790046220 XRZJVUUGSFWRAG-UHFFFAOYSA-N 448.906 2.308 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 793844403 MRZAVMDGIXKQPM-NQIIRXRSSA-N 442.560 2.493 10 20 IECD CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nncn1C 796187743 RGQICAGWNIYZJG-ZOCZFRKYSA-N 432.544 2.171 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NCCN3CCCS3(=O)=O)cc2Cl)C1 799905243 UKJFHIJQVXPFOS-HNNXBMFYSA-N 428.986 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)CC2)cc1F 801167686 ZZSZNPPXCPZQGF-UHFFFAOYSA-N 437.449 2.108 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1 802609701 JHWRCNVVNMPXDP-UHFFFAOYSA-N 449.529 2.342 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297530 YYWQGLLEUABQEI-QZTJIDSGSA-N 441.528 2.293 10 20 IECD CCCN1CC[C@@H](CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803447923 BRRJBIXHRFDMCB-INIZCTEOSA-N 438.519 2.221 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCC(n2ccnc2)CC1 803448834 DZUVXZLOPYEKAV-UHFFFAOYSA-N 447.486 2.433 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)cc2Cl)C1 804059411 ZXJVVPLQISKKOT-BHIYHBOVSA-N 448.995 2.172 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC(=O)N(C4CC4)C3)cc2Cl)C1 805755401 DAHSYIKSSPXQMG-NVXWUHKLSA-N 446.979 2.320 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(OCCN2CCCC2)cc1 805995426 DCJJVZYJYVLRAU-UHFFFAOYSA-N 438.572 2.468 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 806865491 ADEPJDONRHNDJM-AWEZNQCLSA-N 431.514 2.496 10 20 IECD CCOC(=O)Cc1csc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 918000474 HQUUEOLAFSBKSI-HNNXBMFYSA-N 445.545 2.272 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCNS(=O)(=O)Cc3ccccc3)CC2)cc1 918069400 TXLKEYABUNQJAE-UHFFFAOYSA-N 446.573 2.037 10 20 IECD CCn1c(O)nc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2c1=O 918138055 GEQWQXBWNBPXDU-UHFFFAOYSA-N 426.448 2.028 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918296232 ISICVTRKALQVKJ-NRFANRHFSA-N 439.512 2.375 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1OC 918398879 BCAFTRPLKRBCPB-UHFFFAOYSA-N 433.439 2.305 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1 919812982 RUYDRQWWHPOHLI-UHFFFAOYSA-N 437.905 2.015 10 20 IECD Cc1nc(COc2ccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc2)no1 919840512 QKMDJCYDXZYTOK-UHFFFAOYSA-N 442.497 2.444 10 20 IECD COCCCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920194270 AOXSJSHNNVAVMY-UHFFFAOYSA-N 427.501 2.193 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(Cl)c1-n1cncn1 920194811 HWGOBCFQVPJBPS-UHFFFAOYSA-N 440.891 2.012 10 20 IECD C[C@@H](NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 920880940 JQRBMYZTZUKYIA-MRXNPFEDSA-N 426.473 2.429 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C(C)C)N3C[C@@H](C)O[C@H](C)C3)CC2)cc1 921202867 IHUHZKSYAMTYCG-LGVFNWMJSA-N 446.636 2.457 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCC(=O)N4)cc2F)CC1 1318307120 FTHCLWZORCYNCI-UHFFFAOYSA-N 446.548 2.331 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(c2cc(C)cc(C)c2)C1=O 1320385317 GWJGESTUMGCXRW-MOPGFXCFSA-N 440.496 2.358 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)c1 1324297745 FBNIICKHOKWXCF-UHFFFAOYSA-N 435.521 2.485 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC1)C2)C1=NN(c2ccccc2)C(=O)C1 1778126161 ISOYQFFFSDZAOK-HYBUGGRVSA-N 438.528 2.093 10 20 IECD Cn1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)c1=O 1786512959 GZXWHSXLKCPLKI-UHFFFAOYSA-N 434.452 2.253 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCO2)c1cc(O)c(O)c(Cl)c1 1798098964 GDXXMZZUIVDDCD-BTTYYORXSA-N 446.891 2.296 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ncc[nH]2)cc1)c1cc(O)nc(O)c1 1803782584 PPWCEQHKOKDBTE-BCDXTJNWSA-N 433.468 2.449 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)no1 1832130405 RYCPDOOBBRYYTN-GOSISDBHSA-N 428.489 2.265 10 20 IECD C[C@@H](Oc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502396 SQOSJYCZPFYDCN-CYBMUJFWSA-N 431.876 2.431 10 20 IECD CC(C)C(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 726234678 JDTGVBDMHPMLRE-WOJBJXKFSA-N 443.592 2.082 10 20 IECD CO[C@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 727036915 AFRJMTDZQGSQPS-APWZRJJASA-N 438.528 2.351 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N3CCC(C(=O)OC)CC3)ccc21 728638210 ZCFYVKWAJVPWRC-UHFFFAOYSA-N 430.501 2.473 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](C(C)C)N3CCN(C)CC3)cc2F)CC1 730115590 TWHVLHHUXLUNRR-QHCPKHFHSA-N 448.631 2.039 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3nc4c(s3)COCC4)cc2F)C[C@@H](C)O1 735584177 FJWYIQKARWLQTP-CHWSQXEVSA-N 448.520 2.223 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3ccc(N4CCOCC4)cc3)nc12 738297750 BACOGWFMDFNKBN-UHFFFAOYSA-N 425.489 2.080 10 20 IECD CCOC(=O)c1ccsc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 743888660 AMYMTELQOIUQCQ-UHFFFAOYSA-N 431.514 2.359 10 20 IECD CCN(CC)[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 744423398 HYWVPWFORDIWFP-IBGZPJMESA-N 432.590 2.340 10 20 IECD O=C(CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 749515636 NEYIBVOWROAJDD-UGKGYDQZSA-N 430.568 2.227 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 750256000 NSVLICLMBFOSRD-UHFFFAOYSA-N 426.517 2.416 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(S(C)(=O)=O)cc1 753205562 UJNQGKGMVBKRMG-QFBILLFUSA-N 443.569 2.212 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 754072493 ZTNSSWNMUCTRHF-OPHFCASCSA-N 428.621 2.127 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(NC=O)cc3)cc2F)C[C@@H](C)O1 762859708 PZIBKXHPZJQXTK-HZPDHXFCSA-N 443.475 2.481 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3c(C)cccc3F)CC2)cc(OC)c1OC 763429609 IAHISSDWLJVCMK-UHFFFAOYSA-N 431.464 2.447 10 20 IECD C[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 765329421 GQLAJVXWZSSAIV-UTKZUKDTSA-N 425.529 2.498 10 20 IECD Cn1cnn(-c2ccc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)cc2)c1=O 771190795 LLCZNWBHCVFSBU-UHFFFAOYSA-N 447.451 2.037 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)c2ccnc(S(N)(=O)=O)c2)c1C 772428416 MTTXVQRDBSTGAR-UHFFFAOYSA-N 427.482 2.485 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 774357359 SEPVUOXKZBWAHR-UHFFFAOYSA-N 436.346 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-c4nncn4C)c3)CC2)cc1 778233985 IEOAIINHLMXPHX-KHPPLWFESA-N 446.511 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)C(=O)Nc3ccccc3)CC2)cc1 778273824 ZCNOCEXBJOLXIR-HHNLSAEISA-N 436.512 2.043 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCN(C4CCCC4)CC3)CC2)cc1 778286972 GNOPJEHLTWSBPJ-QXMHVHEDSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc(Cl)nc3)CC2)cc1 778334384 KITDUCAIUWTOCT-HJWRWDBZSA-N 428.920 2.307 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)[C@@H](C)O)cc1 779498069 HOOGWKDAHPEPPG-VGSWGCGISA-N 445.585 2.280 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(F)cc1 789833188 FFQUCMYUMMHDMO-OAHLLOKOSA-N 431.483 2.462 10 20 IECD COCCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845977 XRMYFPUGIFRBPH-UHFFFAOYSA-N 443.519 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)c3ccc4c(c3)OCO4)CC2)cc1 795928094 JMAFTWCUJSVVJQ-INIZCTEOSA-N 426.469 2.419 10 20 IECD COc1ccc(N2CCC(NC(=O)NCC(=O)NCCc3ccccc3OC)CC2)cc1 798107850 AILCRMNDNLEANL-UHFFFAOYSA-N 440.544 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CCO)Cc3ccccc3)CC2)cc1 799811548 KSOVATPAJKEGCY-VIOKTNGOSA-N 437.540 2.010 10 20 IECD CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 803298790 DWSKURPOOSDDJU-MGPUTAFESA-N 427.549 2.318 10 20 IECD C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451446 LDJBJYWPMOMFRP-DNVCBOLYSA-N 438.519 2.172 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N3CCCC[C@H]3C)cc2)CC1 805023779 AVTRDVIAGFAAJV-MOPGFXCFSA-N 428.577 2.445 10 20 IECD CC(C)(O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 806855439 LVTSUWJWBOUIDE-UHFFFAOYSA-N 425.529 2.378 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1 807099943 HZHALDPHTULDNE-JOCHJYFZSA-N 436.556 2.488 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)Oc3ccccc3OC)CC2)cc1 807635539 RRWGRCNQVAWMBV-SFHVURJKSA-N 441.528 2.326 10 20 IECD CCN1CCC[C@H]1CNC(=N)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 849064310 OGNNYQIBFPJSLP-IBGZPJMESA-N 440.571 2.041 10 20 IECD CNC(=O)NC(=O)[C@H](C)OC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 913362279 VLNMPUYVCVBFOC-LZAIMSLLSA-N 441.556 2.117 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1 917735265 JQBSLYRYMQFWKD-UHFFFAOYSA-N 445.950 2.191 10 20 IECD COc1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1OC 918015758 CUPFGUJTIYNNOO-SFHVURJKSA-N 426.517 2.405 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21 918309643 CUMLQBVADGWSSH-OAQYLSRUSA-N 434.540 2.497 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918461373 ABAHDMKJUYNHQK-UHFFFAOYSA-N 427.501 2.398 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 918463529 KGNJCJBDLNLCIP-INIZCTEOSA-N 442.491 2.181 10 20 IECD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)cc1F 1780358871 NZOYMIXEZOQSTG-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)o1)CCO2 1785506005 XJHJJNIVHPARAN-FNLFUECCSA-N 448.859 2.207 10 20 IECD CCc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992100 UXSPZHQKVWTCHI-OPAMFIHVSA-N 447.495 2.479 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc[nH]1)CC2)c1cc(O)c(O)c(Cl)c1 1823709115 ZOHXRFPORFKCLQ-VIFPVBQESA-N 433.877 2.470 10 20 IECD CN1CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1823861480 BHAULSAFWWPSQO-FQEVSTJZSA-N 444.576 2.458 10 20 IECD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)COC1 1823877782 MGMJKMSTBXMJCR-IWHGQQBYSA-N 444.528 2.473 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1cocn1 1834310172 OSPJAFNTPGUUSS-UHFFFAOYSA-N 448.907 2.238 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2CNc3ccccc32)C1 1842933951 KWYJADHPAVBUHC-LJQANCHMSA-N 443.507 2.192 10 20 IECD C[C@H](Cc1ccco1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442179 DWDWVPYFNMEFTG-QGZVFWFLSA-N 434.496 2.455 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2sccc2Cl)C1 1844562559 UXUMKNKUOZRZTR-UHFFFAOYSA-N 429.976 2.079 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cc1 108577558 KWHAOIQFEWZOKG-UHFFFAOYSA-N 429.542 2.488 10 20 IECD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NCc1ccc(N2CCOCC2)cc1 108808673 KSEFGDMYMXALTF-VWLOTQADSA-N 448.523 2.138 10 20 IECD COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 472780970 ASMNJXHFJBEYMQ-UHFFFAOYSA-N 443.525 2.162 10 20 IECD COc1cc(OC)cc([C@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 735759012 ONDNEFCYLXGMAZ-JOCHJYFZSA-N 447.507 2.337 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(OC(C)C)cc3)CC2)cc1 743433143 XKWSBHXSVGGCTP-UHFFFAOYSA-N 440.544 2.359 10 20 IECD CC(C)(C)NCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743483207 WDCOKFJUUWNBEF-UHFFFAOYSA-N 436.490 2.219 10 20 IECD COc1ccc(N(CC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)CC(C)C)cc1 746170964 ZVXYSRMZCLMBMN-UHFFFAOYSA-N 437.548 2.183 10 20 IECD O=C1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2N1 749633660 USPPZLBTYHJZNG-UHFFFAOYSA-N 436.512 2.035 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(CO)C[C@H]3c3ccccc3)CC2)cc1 753078911 BRTASTIENAERHU-DZLQFSGCSA-N 449.551 2.182 10 20 IECD CCc1nnc(O)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1CC 754570420 WDCVKLDHVAAKFX-MRXNPFEDSA-N 440.548 2.008 10 20 IECD COCCOc1ncccc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759219431 BASZDPNUCFLHGC-UHFFFAOYSA-N 431.489 2.095 10 20 IECD COc1cc(N2CCN(C(=O)c3cnn(C)c3C(F)(F)F)CC2)cc(OC)c1OC 759242167 NVIIRZVQBQNEEK-UHFFFAOYSA-N 428.411 2.427 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc(OC)c1OC 760117451 JGJQXXXMLUYWGP-IRXDYDNUSA-N 448.564 2.191 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@H](C)CC3(C)OCCO3)CC2)cc(OC)c1OC 760128000 GVIYSXNVDSYFSM-MRXNPFEDSA-N 437.537 2.333 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C(=O)[C@H]2C1 761091371 NZJOUPNZTRLXLN-QHHYFVSCSA-N 433.480 2.155 10 20 IECD C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NCCc1ccc(O)c(O)c1 762273853 DMHJREMYZXZPCJ-NSHDSACASA-N 432.420 2.142 10 20 IECD CCCN(CC)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 764212607 PUDDDXMFUWRUGB-BOPFTXTBSA-N 435.571 2.465 10 20 IECD O=C(COc1ccc2c(c1)CCCNC2=O)NCc1ccc(N2CCOCC2)c(F)c1 766302705 XEXRINYYWZESBM-UHFFFAOYSA-N 427.476 2.034 10 20 IECD CC(C)[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768520744 ADRSVYXSPNWPLO-DOQJBMMISA-N 434.512 2.022 10 20 IECD NC(=O)c1c[nH]c(-c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)c1 771721689 DGSQODFAXZXMFD-UHFFFAOYSA-N 431.455 2.399 10 20 IECD CCOC(=O)C1=C(COC(=O)/C=C\c2ccc(O)c(O)c2)NC(=O)N[C@H]1c1ccco1 772775200 MRGBKTICXJODAO-QJSCKGPTSA-N 428.397 2.119 10 20 IECD O=C(CNc1cc2c(cc1Cl)NC(=O)CO2)NCc1ccc(N2CCOCC2)c(F)c1 772905680 GPWGIJGDEFVKKQ-UHFFFAOYSA-N 448.882 2.375 10 20 IECD CCOC(=O)N1CCC([C@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778232930 JUTINPFRLAEXON-SFHVURJKSA-N 432.565 2.190 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCCn3ccnc3C)CC2)cc1 778289397 LIEDRUQVDATTAK-KTKRTIGZSA-N 425.533 2.002 10 20 IECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1S(=O)(=O)Cc1cc(C)no1 778916460 HQDABIZVBZMNAW-UHFFFAOYSA-N 432.454 2.307 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(OCCCC(=O)O)c(F)c1 779457931 DPBWLJDLSCPOHM-UHFFFAOYSA-N 427.406 2.362 10 20 IECD COCc1ccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)o1 788332456 NBKAYSFODNNUAD-FQEVSTJZSA-N 427.501 2.243 10 20 IECD COCCOc1cc(OC)ccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 788436826 OSQONVRFHVGLCT-UHFFFAOYSA-N 434.514 2.208 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3nc(C)c(C)s3)CC2)cc(OC)c1OC 789726955 DQDLBWPLYPAUIN-UHFFFAOYSA-N 434.518 2.073 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccnc1 789813363 UEDBHOJUJUIIDQ-IBGZPJMESA-N 428.508 2.230 10 20 IECD C[C@H](Cc1ccncc1)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789826217 PAGIVTYVCADGAJ-BRWVUGGUSA-N 428.508 2.198 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccccc1-c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 803299064 YMCHHWXUFAGVLB-GOSISDBHSA-N 447.539 2.417 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCN(CC(F)(F)F)C3)cc2)CC1 803381198 LDDUEQKCRJGIJS-QGZVFWFLSA-N 426.483 2.292 10 20 IECD CC(C)(C)[S@@](=O)CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448712 WGMDQEARNZYCRN-PMERELPUSA-N 445.532 2.036 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676619 HSWKIMKFOTWORI-TXPKVOOTSA-N 448.564 2.070 10 20 IECD Cc1cc(CN2CCN(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)CC2)c(O)c(C(C)(C)C)c1 914851046 XLVYHSDFUZSOSB-HDICACEKSA-N 439.622 2.470 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCN(C(=O)C2CC2)CC1 916632577 ZYAKGOOHXFCHKW-UHFFFAOYSA-N 440.466 2.306 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C(=O)C(C)(C)C)CC3)cc2F)C[C@H](C)O1 917012775 DHKOWBBOQWXERF-ROUUACIJSA-N 448.583 2.246 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(CS(C)(=O)=O)cc1 918018592 XEFDAROUMUHUMQ-UHFFFAOYSA-N 431.558 2.409 10 20 IECD C[C@@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)O1 918200048 UXEGTASZOCPYMS-IAGOWNOFSA-N 436.572 2.474 10 20 IECD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1780135853 MXGIOOXKPDRMHB-DYESRHJHSA-N 448.907 2.224 10 20 IECD C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1 1790922334 CATYDDGNGGNFDK-UHMOLFJZSA-N 439.512 2.280 10 20 IECD Cc1nn(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1F 1827426808 IAMSQKZAFOUWMP-MRXNPFEDSA-N 445.495 2.221 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429572 MHNPVPMFGGZVNB-YOEHRIQHSA-N 449.504 2.288 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829073669 PPHLPKOEFJWJCD-CRAIPNDOSA-N 446.548 2.031 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nnc(C)n3CC(N)=O)c2C)cc1 728219569 MGEJYUBVQOHTTO-UHFFFAOYSA-N 441.513 2.241 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H](C)N1C(=O)OC(C)(C)C 733363751 FZTOBLBWFMDYII-STQMWFEESA-N 427.523 2.234 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(N2CCNC2=O)ccc1F 737857216 LGKONFLVOFPRAH-UHFFFAOYSA-N 426.492 2.494 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738961085 SGZQFEHEBCZRHI-UHFFFAOYSA-N 445.541 2.349 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(S(=O)(=O)N2CCOCC2)cc1 743719146 QSDMAMVBPVWVIC-UHFFFAOYSA-N 430.526 2.222 10 20 IECD CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 743880885 ZMGAPWGYLOHBEC-UHFFFAOYSA-N 439.560 2.158 10 20 IECD C[C@@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 747615886 BFCCEIWYUNLQME-ZIAGYGMSSA-N 449.485 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(-c4ncccn4)s3)CC2)cc1 750198821 SNIJLMLFFKNSLU-UHFFFAOYSA-N 439.497 2.114 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCCN3C(=O)c4ccccc4S3(=O)=O)cs2)cc1 751944545 GDJJITVLJVOTER-UHFFFAOYSA-N 443.506 2.318 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2ccccc2C)c1C 754643465 ZHUXNNNHUPHMIH-LJQANCHMSA-N 445.585 2.210 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc(OC)c1OC 759406691 VQWLBBWYGILLJG-UHFFFAOYSA-N 449.529 2.046 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@](=O)C1 762550576 ZGQFUUVYLGUYFK-RYZVSIALSA-N 428.557 2.095 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 762638596 IFEDOPRLTDGGCC-HKBQPEDESA-N 443.569 2.029 10 20 IECD C[C@H]1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cc(Br)ccc2O1 767312185 QBTDXSPVTXNKRL-NSHDSACASA-N 438.303 2.061 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cccc(OCC)c3O)CC2)cc1 768161719 XOVUOHMOWNMNIA-UHFFFAOYSA-N 448.541 2.474 10 20 IECD CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 768559964 JZVXGDKXZRUUKG-HSZRJFAPSA-N 446.523 2.169 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCC(=O)c3ccc(Cl)cn3)nc12 769185097 RLJXWSUIKHRXOE-UHFFFAOYSA-N 432.820 2.366 10 20 IECD C[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(N2CCOCC2)cc1 775256086 VIPSGLXWMZFNHF-CQSZACIVSA-N 428.445 2.449 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1ccc(OCC(F)(F)F)nc1 777977106 RMGJEVAXPRGINF-UHFFFAOYSA-N 431.436 2.338 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CC[C@H]3CCCCN3C)CC2)cc1 778287691 CNIGKYRYSXFIDC-YVNCXZRQSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3cc(OC)ccc3O)CC2)cc1 778389281 GALDYQVFFTWTSI-QXPKXGMISA-N 439.512 2.492 10 20 IECD COCCO[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 780306784 OWJVEJBNROMYJZ-KRWDZBQOSA-N 431.455 2.489 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(OC)c1 782109290 ZEELVXHZAZHNKN-UHFFFAOYSA-N 441.484 2.214 10 20 IECD C[C@H]1CN(Cc2cccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)C[C@H](C)O1 785293846 CDAFTTWBIARIBS-IKGGRYGDSA-N 441.528 2.393 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)CC1 787320111 SAHXUONVZOCFQZ-UHFFFAOYSA-N 436.556 2.246 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 788950604 CYJRIRAWDVXGHZ-UHFFFAOYSA-N 439.516 2.406 10 20 IECD CCc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 789825632 NFTQXJNRJNGWGA-KBPBESRZSA-N 434.537 2.391 10 20 IECD CNC(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)nc1 792626503 QLWSPGMESUUZFP-UHFFFAOYSA-N 430.376 2.377 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccc(S(C)(=O)=O)nc1 795127738 HBGMISONARKRIA-UHFFFAOYSA-N 449.348 2.164 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c(C)c(C(=O)O)c2)cc1 797432850 VTMAAJFYBLKRNQ-UHFFFAOYSA-N 433.895 2.024 10 20 IECD C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807600147 ZIIBUKBLHWXSKF-OWCLPIDISA-N 425.476 2.304 10 20 IECD NS(=O)(=O)N1CCC[C@H](C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 815260493 BCMDULRVLLYFKE-HNNXBMFYSA-N 445.501 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(c4ccccc4)CC3)CC2)cc1 913461971 YFEUTFNEUSLJCZ-VAWYXSNFSA-N 434.540 2.249 10 20 IECD NC(=O)c1cccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 914530793 ZNAWTFACOLJHPO-UHFFFAOYSA-N 429.388 2.399 10 20 IECD Cc1nc(C)c(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(O)n1 915464911 UFTPJEPLOLQTDL-UHFFFAOYSA-N 445.431 2.299 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)c1cccc(S(N)(=O)=O)c1 916196674 CVAJFLCCVOAHRE-OAHLLOKOSA-N 434.587 2.448 10 20 IECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918295630 RPLAXDNYBKNKPN-SFHVURJKSA-N 425.485 2.207 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918437611 KUIJQCOVZWNLBF-UHFFFAOYSA-N 444.463 2.220 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OC(F)F)c3)cc2)C1 918463194 ILJBEWHMFSOKEA-HNNXBMFYSA-N 446.454 2.245 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC=CO3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790244961 HJJKDLKYRINLMR-KYABYICQSA-N 436.892 2.037 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1O)C1=NN(c2ccccc2)C(=O)C1 1794860984 PENBPBZYUSOAMA-VBUUOAMHSA-N 432.480 2.437 10 20 IECD C[C@]1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC=CCC1 1801542401 IRUDAJVLCHMQLT-VMIJDXDNSA-N 442.512 2.153 10 20 IECD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)n1cccc1 1816729233 YDJVFCCXYLRVHL-DGCLKSJQSA-N 427.486 2.238 10 20 IECD O=C(CCN1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816972251 ZSWZSCRJZQCGMT-QGZVFWFLSA-N 442.520 2.398 10 20 IECD O=C(c1ccc2c(c1)COC2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037966 XSSMSSFQEWRRHK-FNORWQNLSA-N 436.464 2.364 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCc1ccccc1F 1847548428 SZHUHMVQIANLGP-IRXDYDNUSA-N 449.573 2.211 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCc1ccncc1 1848229634 WBNMGLQHAJDQNZ-GGUXULKNSA-N 437.496 2.436 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCn3nc(C)cc3C)CC2)cc1 97394547 DDTQKMSWMRLIOS-UHFFFAOYSA-N 428.581 2.410 10 20 IECD COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1OCC(N)=O 105038704 MULYUMXQHPGNJL-FQEVSTJZSA-N 441.528 2.447 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)Nc3cc(C)ccc3NC(C)=O)nnc2n1 110696893 SWHRPMIFRCHERG-UHFFFAOYSA-N 443.537 2.381 10 20 IECD COC(=O)CN(CC(=O)NC(=O)NCc1cccs1)Cc1cc(Cl)ccc1O 731844420 ANQFDSHQQYDNLC-UHFFFAOYSA-N 425.894 2.108 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 733131735 HIIXRVVPJVCKPX-PZJWPPBQSA-N 430.618 2.189 10 20 IECD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740920437 ZJEVAGCKJGHVMQ-HXUWFJFHSA-N 425.577 2.291 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 742805527 KTJXITWLOQKUMF-LBPRGKRZSA-N 445.513 2.325 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCC[C@@H](O)C1 745738085 SQLZZLWPTRTHJD-IEBWSBKVSA-N 442.539 2.293 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)cc1 749629322 ONVREZTZKHOPPQ-UHFFFAOYSA-N 446.573 2.428 10 20 IECD CS(=O)(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 751138062 YFFXTYWEEDZWMS-HNNXBMFYSA-N 443.518 2.305 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCOCC4(CCOCC4)C3)CC2)cc1 753095929 QRMVEBPWPNGAQT-UHFFFAOYSA-N 446.592 2.046 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(=O)OC(C)(C)C)C[C@H]3C)CC2)cc1 754081171 JGHAXASZIFRHCQ-TZIWHRDSSA-N 448.608 2.119 10 20 IECD COc1cc(N2CCN(CC(=O)NC(=O)N[C@@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 759872379 IIOFPJXXSVAXHX-SJLPKXTDSA-N 448.564 2.239 10 20 IECD COc1cc(N2CCN(CC(=O)NC(=O)Nc3ccccc3)CC2)cc(OC)c1OC 759885250 BQRFJJBAKUDXML-UHFFFAOYSA-N 428.489 2.183 10 20 IECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)c1 771418839 STRQNAHWCHEVCD-FQEVSTJZSA-N 435.839 2.277 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@@H](C)O)cc1 779501501 AJBSCADHHYMXGF-XMSQKQJNSA-N 445.585 2.329 10 20 IECD COc1ccc(CN(CC(=O)NCc2ccc(N(C)C)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 781350823 QOHYNDWJPYJNCP-OAQYLSRUSA-N 445.585 2.067 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 781523164 ILEVTXZUZCTQGI-UHFFFAOYSA-N 442.468 2.330 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 784024098 KXZSJLBVMGVERK-UHFFFAOYSA-N 445.541 2.004 10 20 IECD O=C1NC2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)CC2)CO1 784212540 HNORPJPEGABPTK-UHFFFAOYSA-N 442.438 2.326 10 20 IECD CC(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)on1 789819440 MYPKVXNYAVNXOZ-GASCZTMLSA-N 432.496 2.483 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3C[C@@H]4CCC[C@H](C3)N4C)cc2F)C[C@@H](C)O1 789823322 DEOGXNRYCMVPAJ-SYXAYUIZSA-N 446.567 2.187 10 20 IECD COc1ccc(Cl)cc1NC(=S)NNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 792672232 MOMYTUGNERIKGR-UHFFFAOYSA-N 431.883 2.218 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@@](F)(CO)C3)c2C)c1 802012890 PMDYGYPALSIXGU-QHCPKHFHSA-N 446.475 2.256 10 20 IECD COCCc1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 803676379 GKKAASNKPHBUND-UHFFFAOYSA-N 443.548 2.302 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(c3cnccn3)CC2)cc1)C1CCCCC1 803677063 DXLDWOCSFDHUOO-UHFFFAOYSA-N 436.560 2.211 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccncc3)cc2F)CC1 805006872 IPOWMOYHZUKTDT-OAQYLSRUSA-N 439.535 2.343 10 20 IECD COC[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccco1 806774998 OFBOWCIWEPRFQV-WMLDXEAASA-N 437.443 2.470 10 20 IECD CCC[C@@]1(CO)CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 808796209 HKDHXRFXSLQMSD-JOCHJYFZSA-N 433.574 2.409 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3csc([C@H](C)OC)n3)CC2)cc1 809332504 XKZPTQMDISILDY-HNNXBMFYSA-N 432.546 2.214 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc5oc(O)nc5c4)n3)CC2)cc1 809465490 WWBGZDGAMWLKKI-UHFFFAOYSA-N 435.440 2.483 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 811501340 WMUADDXKWMKMNZ-UHFFFAOYSA-N 433.530 2.458 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H]4C[C@H]4N3C(=O)OC(C)(C)C)CC2)cc1 814111208 SILAROPXJSXONX-UIFIKXQLSA-N 444.576 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(CC(=O)N4CCCC4)CC3)CC2)cc1 915680709 BAXLCOPBOIGHIK-UHFFFAOYSA-N 428.577 2.068 10 20 IECD CN1CCN(c2cc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccn2)CC1 916390420 PKISAMSPIYAYLY-UHFFFAOYSA-N 438.576 2.012 10 20 IECD O=C(NC[C@]1(N2CCOCC2)CCSC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916636638 HMHVRIBFPQCZQL-SIKLNZKXSA-N 435.590 2.291 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(Cn4cncn4)c3)cc2)C1 918050751 VWECNODRQKMWGG-IBGZPJMESA-N 433.516 2.350 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 918334526 HMKZSGFANSOMMG-UHFFFAOYSA-N 444.513 2.334 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(N4CCCC4=O)c3)CC2)cc1 918461428 BXHCRYRMSDRNJN-UHFFFAOYSA-N 436.512 2.499 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O)c1ccc(N2CCOCC2)cc1 920880282 BKXHSEVPTBQCQX-XDHUDOTRSA-N 436.512 2.168 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1OCC(F)(F)F 1321048722 MSDZLDDJFXGGCB-ZDUSSCGKSA-N 428.363 2.338 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(F)nc3)C2)C1 1779440388 OESCWTOEYACKAQ-HXUWFJFHSA-N 435.839 2.043 10 20 IECD COC(OC)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781752357 MIKAKLWUSTYLOR-DEOSSOPVSA-N 441.528 2.157 10 20 IECD Cc1csc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1785503273 GKVPRJZOMGJLJR-YXMLYAQVSA-N 444.509 2.330 10 20 IECD COCCCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786046487 XVQFYKCJSLTQPZ-UHFFFAOYSA-N 435.571 2.407 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3F)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790244216 USOSVGZTLJYZSI-BNLOLNQZSA-N 449.866 2.192 10 20 IECD Cc1noc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932592 MBUKYZHDOYEXOX-VBUUOAMHSA-N 435.484 2.336 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc(OC)c1C 1803814794 OILUDIPVOFMPLB-BJWYYQGGSA-N 441.484 2.384 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)C(F)F 1806438762 JDNARMXSJAXVCX-PRIUCCMZSA-N 433.411 2.183 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@@H]1CCCO1 1822162327 SNYPQYGHWJYXCP-OJJSLQOQSA-N 442.472 2.411 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)N(Cc3cccnc3)C3CC3)nnc2n1 108223792 AHQNOIUHVCPGLK-UHFFFAOYSA-N 427.538 2.061 10 20 IECD CCC(CC)N1C[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1=O 195591327 YSDOYFAUGMPXOQ-IBGZPJMESA-N 430.593 2.361 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC(C(=O)NCCN(C)C)CC3)ccc21 490397622 GMTGBADMMBQYQR-UHFFFAOYSA-N 428.577 2.435 10 20 IECD Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)C1=S=C(CCNS(C)(=O)=O)C=C1 541371377 YKUDZYGFFHIJRW-UHFFFAOYSA-N 446.554 2.448 10 20 IECD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 728948100 DLNMRTOMDZGYEQ-UHFFFAOYSA-N 430.549 2.230 10 20 IECD CN(CC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)Cc1ccccc1O 731843499 KPSPTPLAXGGSGF-UHFFFAOYSA-N 437.949 2.011 10 20 IECD O=C(CN1CC[C@@H](CN2CCOCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 741809202 QYFBWWGUPBJMCZ-KRWDZBQOSA-N 433.508 2.055 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743975007 KSDVCZZLAVCKDC-INIZCTEOSA-N 446.454 2.371 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)c1 751395381 IKJRSUXPMMJUMQ-UHFFFAOYSA-N 445.541 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C(=O)N(C)C)ccc3C)CC2)cc1F 754210712 DGMFVRIUGXFFJO-UHFFFAOYSA-N 442.491 2.132 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN(C)C3CC(O)C3)c2C)c1 759869298 MJFFHNCFYPWMGU-UHFFFAOYSA-N 428.485 2.305 10 20 IECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1OCC(=O)N(C)C 769710577 CFDSEKDVJGCVHS-KRWDZBQOSA-N 449.529 2.112 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc(S(C)(=O)=O)sc1Cl 770636560 KJLLRQPQIUWQCA-UHFFFAOYSA-N 436.964 2.459 10 20 IECD COc1ccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N(C)C)cc1OC 774857469 FOYWVFCSQWPHOF-OXQOHEQNSA-N 442.560 2.366 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@H]3CCCc4c3cnn4C)CC2)cc1 778393137 YWKDRZNGWXDRBH-GMGKOPGTSA-N 437.544 2.170 10 20 IECD Cc1c(C(=O)NCc2ccc(O)c(O)c2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1 778922079 CXSSKMSAJGYQHL-UHFFFAOYSA-N 431.493 2.500 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]4CN(C)CC[C@@H]43)CC2)cc1 779329965 HRZMYZISLWPFBP-OFNKIYASSA-N 429.609 2.333 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1ccccc1S(=O)(=O)NC1CC1 780777017 MHYXATIIHCNYHH-UHFFFAOYSA-N 433.602 2.045 10 20 IECD COC(=O)c1scc(C)c1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785495240 MUFUIMWHDULSOV-UHFFFAOYSA-N 442.534 2.422 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)c1F 786121925 KPCRATATDIIMKR-UHFFFAOYSA-N 435.521 2.290 10 20 IECD CCOc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789840678 MMCUQGYJKJTSQY-UHFFFAOYSA-N 443.519 2.460 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(OC)c1 789854807 DQFVTFDFOFLHFD-UHFFFAOYSA-N 443.569 2.232 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCCC1 793707145 DTRWKKWWHITIDO-DLBZAZTESA-N 438.519 2.364 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H]1CCc2ccccc21 793733714 NWKLWFSMVMTMQB-KNQAVFIVSA-N 434.540 2.150 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3COc4c(C)cccc4C3)CC2)cc1 794167453 IQYNYPOXPHIXEM-CFGKVWFZSA-N 435.524 2.328 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 797620140 ADKYSRMAEWDQTJ-OAHLLOKOSA-N 439.516 2.304 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(-n4ccnc4)cc3)CC2)cc1 803348749 WEKFGSNBUSJXRI-UHFFFAOYSA-N 433.512 2.282 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1(c2cccc(F)c2)CC1 807409573 NQSRHCXXJSJNFW-UHFFFAOYSA-N 425.504 2.469 10 20 IECD C[C@@](O)(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 807498063 VZOOJEJRWDTPAP-HYBUGGRVSA-N 426.513 2.314 10 20 IECD COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 808034072 HXBXCXNYFJFCAE-DLBZAZTESA-N 443.500 2.497 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 808109739 CUZBONWZRPRNDC-UHFFFAOYSA-N 444.557 2.248 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](O)C23CCCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 814668143 ZZOAJLZIOOOQLC-OAQYLSRUSA-N 431.558 2.304 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCCOC)cc2)cc1OC 917759790 ZLXDCGFYFACIIY-UHFFFAOYSA-N 444.531 2.283 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(CN2CCCC2=O)cc1 919878764 XDQRXBUMPANIFX-UHFFFAOYSA-N 427.526 2.296 10 20 IECD CC[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753009 YZZJONLPTBLDNP-QPPBQGQZSA-N 425.529 2.309 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)C(C)C)cc1 1793078286 XPNKNWXZKMGTMK-MQFRRQCYSA-N 439.556 2.314 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(Cl)nn1 1804285612 BOLCGAABVSFNJG-ITJFMEAMSA-N 444.875 2.212 10 20 IECD Cn1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1Cl 1804288677 ADVBTRDPQZDXLL-JDGWPXKUSA-N 446.891 2.156 10 20 IECD CC1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1824364723 DXWMYRNIBVXPMN-FQEVSTJZSA-N 444.576 2.458 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)COc2cccnc2)CC1 1825064829 OUUFQKXYCDMCGI-LJQANCHMSA-N 440.500 2.200 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)CC1 1836658048 HGTOMUKWOBOVAK-RTBURBONSA-N 429.517 2.151 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729062463 BLARZRLWJSNCBR-CQSZACIVSA-N 449.529 2.295 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1 734471656 SIQQYGFFAFRJLW-SFHVURJKSA-N 433.578 2.118 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CN(C)c3ccccc3[N+](=O)[O-])CC2)cc1 742491851 QSUDHAAKRKOHPJ-UHFFFAOYSA-N 441.532 2.368 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 743809482 UINDRUSGLCALPJ-BMEPFDOTSA-N 433.302 2.310 10 20 IECD CCCNC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 747836649 CENPBKFELHOVTD-QWFCFKBJSA-N 448.583 2.294 10 20 IECD Cc1c(NC(=O)C(=O)N(C)Cc2ccccc2O)cccc1C(=O)N1CCSCC1 749029605 JLMYZKUEPGZZMK-UHFFFAOYSA-N 427.526 2.487 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1C 751239402 IJAYVEYZLMJISE-UHFFFAOYSA-N 432.542 2.469 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1 754425599 XMOGBNAJKIGMTP-JLTOFOAXSA-N 438.484 2.128 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1ccccn1 768413608 HBSGPUHIOMDHIV-UHFFFAOYSA-N 442.520 2.261 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CN(C)CCO1 769974193 UCWCZAKVQTYDHM-KBXCAEBGSA-N 430.471 2.060 10 20 IECD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 771631376 VCLZHXREGYNCOL-SFHVURJKSA-N 435.521 2.237 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N(C)C)cc1 773855790 GZXJUVMYQQDZBD-AWEZNQCLSA-N 430.530 2.009 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCN(C(C)C)C3)CC2)cc1 778251916 HBFRPSOQGHYDGU-CFGKVWFZSA-N 428.577 2.137 10 20 IECD COC(=O)[C@@H]1CN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 778270964 CIHBJIOTTNJUEJ-RJRNSMGGSA-N 449.507 2.203 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 781368754 UEWZMLVTFQZPOG-ICSRJNTNSA-N 440.548 2.011 10 20 IECD CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1F 783289156 BENPQOWRTNJLBY-UHFFFAOYSA-N 425.468 2.381 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1N1CCCCC1=O 785297580 QBVHNEMPADNSPP-AWEZNQCLSA-N 441.484 2.309 10 20 IECD NC(=O)[C@H]1CCC[C@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 787840515 LKWAEDVWYAVVHN-KBPBESRZSA-N 434.448 2.235 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 789823093 YUFGSIGRODMLOO-QZTZHPFYSA-N 447.551 2.475 10 20 IECD C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855653 VFWLPLQNBGTMCM-QRVBRYPASA-N 432.634 2.339 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 793907167 AHNYAZUNFRCCJR-VAMGGRTRSA-N 430.593 2.217 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccc(OC)cc2O)c1 795356361 AKFQVGPJACCPKD-VMPITWQZSA-N 437.470 2.083 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@@]4(CCCOC4)C3)cc2F)CC1 797451627 MDSDMAALNSUFAM-MBSDFSHPSA-N 434.556 2.447 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1 800709965 OHSUBANZRGIJLQ-FQEVSTJZSA-N 447.605 2.468 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)CCC3=O)cc1 800843564 RLNAVJSCTKQYPS-UHFFFAOYSA-N 429.907 2.146 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 804713626 ZBZJVOMSNUXQEJ-LJQANCHMSA-N 442.560 2.442 10 20 IECD CNc1nc(C)cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 806549915 BYDCTXRLGYGGNX-UHFFFAOYSA-N 436.495 2.012 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 806846305 JHKNTOWKGGRXNF-UHFFFAOYSA-N 432.471 2.465 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCCC3(C)C)CC2)cc(OC)c1OC 806875759 PELFDIJWNMFZAG-LJQANCHMSA-N 433.549 2.446 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(C)(C)O)c3)cc2F)CC1 806890262 CSILKKBKJCQDIM-UHFFFAOYSA-N 442.535 2.450 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(=O)CC(C)C)CC2)cc1 810181454 MHOMSBXOJLMLDM-OAQYLSRUSA-N 427.549 2.231 10 20 IECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1 810317703 AHOFNGKUZCIYHA-UHFFFAOYSA-N 431.558 2.376 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(F)(F)[C@@H](CO)C3)cc2F)C[C@@H](C)O1 812858886 FGXJGSJNAGILLE-BFYDXBDKSA-N 429.483 2.005 10 20 IECD C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818999570 LDCBNUDQITXMEU-RNODOKPDSA-N 449.485 2.382 10 20 IECD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)N(C)Cc2ccccc2O)CC1 917307200 GBVTUSGVKGHHLJ-UHFFFAOYSA-N 446.525 2.238 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCN(CC(F)(F)F)C3)cc2)C1 918116902 CAKANGITHQKOHF-IRXDYDNUSA-N 441.498 2.072 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2ccnc2S)cc1 918337032 BUTYCPAKHUUMGP-UHFFFAOYSA-N 442.566 2.326 10 20 IECD COC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918440819 UEKKQHGBUIBLBU-UHFFFAOYSA-N 443.525 2.047 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1 918444449 SYZSNABCUWOBSN-UHFFFAOYSA-N 426.498 2.436 10 20 IECD O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NCc1ccc(N2CCOCC2)cc1 919767104 CKWPTIACFUBSQY-GZTJUZNOSA-N 429.542 2.120 10 20 IECD COc1ccccc1[C@H](CN/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O)N1CCCC1 920980746 ZKSUYGAYQPLSJF-FSEPTYSPSA-N 430.574 2.205 10 20 IECD Cc1ccsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777847501 CJHYNKSMCZTGLO-QVKFZJNVSA-N 431.514 2.304 10 20 IECD CC1(C)CC(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)C1 1785510701 YODOENVMDAIQPF-FIYNHDKVSA-N 430.501 2.083 10 20 IECD CNc1nsnc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425236 IRKNBWPDHGKFER-UHFFFAOYSA-N 440.485 2.448 10 20 IECD COC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796604838 QRFSMDFOCVRYBV-BJWYYQGGSA-N 440.456 2.237 10 20 IECD O=C(CCc1ccc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931758 IJBSFPCHMSBSLL-FNLKRUPLSA-N 433.512 2.378 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnc2ncccn12 1800717933 BXRFJAGKMBXYOJ-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc2ncccn2n1 1800718032 IUHKVBAJGFVQRK-BTTYYORXSA-N 441.875 2.360 10 20 IECD Cc1ccc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804340082 HMLLIIFWQLCVFU-MUJYYYPQSA-N 431.583 2.416 10 20 IECD Cc1nn(C)c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815390547 SQLDYBCPNSQAHA-HNNXBMFYSA-N 439.476 2.186 10 20 IECD O=C1CC(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1832882496 JNVWGFLLASQNCJ-WSSFADSRSA-N 442.512 2.415 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835505615 IISMOMQSSATQNP-BEFAXECRSA-N 430.549 2.114 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CSc2ccncc2)C1 1841964110 DTRVLYBPRBWMJL-UHFFFAOYSA-N 449.536 2.170 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1842197668 XBPZZFMLWWONJI-QPJJXVBHSA-N 430.482 2.404 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(N)(=O)=O)ccc1Br 28333843 MZQOZSMQLGKCLH-UHFFFAOYSA-N 426.336 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)NC(=O)CS4)CC2)cc1 39517499 OHSFKIPGJQEYLN-UHFFFAOYSA-N 441.509 2.245 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(OCC(F)(F)F)cc2)SC1=S 727176080 GFHVXOQNWFUEFH-WQLSENKSSA-N 440.490 2.378 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4ccc(F)cc4)ccc3=O)cc2)C1 731577333 FABDCFNPXXHKQE-QGZVFWFLSA-N 449.486 2.003 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cccc(CN4CCOCC4)c3)CC2)cc1 732064617 WLLAKJBCJVEVAG-UHFFFAOYSA-N 438.572 2.079 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccccc1CN1C(=O)CCC1=O 743958155 OLYLWBRGZMJAKL-UHFFFAOYSA-N 435.480 2.175 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccn(-c4ccc(F)cc4)n3)nc12 745419002 NWVXULHHGYKQIC-UHFFFAOYSA-N 439.403 2.222 10 20 IECD Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405510 FWFQLGBRRKPESB-QFIPXVFZSA-N 438.507 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(OC[C@H]4CCCCO4)CC3)CC2)cc1 750062520 OJYXSUGVZQZQNX-HSZRJFAPSA-N 431.577 2.394 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCCNC(=O)C3CCC3)cc2F)C[C@@H](C)O1 759999519 ONPBIEIGOGMZTJ-QZTJIDSGSA-N 448.583 2.294 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1F 761981844 IPMFAAUGQFOBSG-HNNXBMFYSA-N 441.912 2.227 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCC[C@H]1N1CCOCC1 763662209 YBNCIKJBTNMIFQ-RBBKRZOGSA-N 434.556 2.229 10 20 IECD Cc1cc(O)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 766321920 SVHAGFNGRZPMCS-UHFFFAOYSA-N 435.867 2.435 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]3C)nc12 776607775 WUKLETIWXCLICQ-KGLIPLIRSA-N 433.509 2.441 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H]1CCO 779285573 RXULQNVNWCDCMH-AWEZNQCLSA-N 435.458 2.088 10 20 IECD COCC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccco1 781041633 KENBTEJGMSGYIN-SQUSKLHYSA-N 427.501 2.387 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cc(C)ccc3OC)CC2)cc1 785525566 WZUPRGCWTDJXAM-UHFFFAOYSA-N 425.529 2.410 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)C[C@H](C)[C@@H]3C)CC2)cc1 785530847 QATATPHRFIAQIF-AABGKKOBSA-N 430.593 2.217 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(S(C)(=O)=O)cc(C)c3C)cc2)CC1 786262495 OGBZETOHUXBFOS-UHFFFAOYSA-N 443.569 2.305 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)cc2)CC1 786660116 WBKFRDBKHLFNCM-YRXWBPOGSA-N 425.451 2.327 10 20 IECD COc1ccc(CNC(=O)c2cccc(C(=O)NCc3ccc(OC)cc3O)n2)c(O)c1 796349475 CWYXWHNGMTZCLN-UHFFFAOYSA-N 437.452 2.370 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 804318513 MMWWBGXDOAUCJR-QHCPKHFHSA-N 436.556 2.296 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)c3cccnc3)cc2F)CC1 805007708 XZUJUIFGYUCHTA-QGZVFWFLSA-N 427.524 2.198 10 20 IECD C[S@](=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 805865786 KQNLEJMVGVZIOG-QJWGWKRISA-N 442.585 2.266 10 20 IECD CN(C(=O)C(=O)NCCCSc1nccs1)C1CCN(CCc2ccccn2)CC1 806276741 SXLNUFQBASPEBY-UHFFFAOYSA-N 447.630 2.302 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 806547275 FGVIJFWXWCEDQL-CQSZACIVSA-N 436.509 2.453 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387411 JPEVZQLZKDSTGV-UHFFFAOYSA-N 430.262 2.299 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@](C)(O)c3ccccc3)CC2)cc1 807495316 ASALMWZTXPXXNV-DEOSSOPVSA-N 425.529 2.148 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(CCCN2CCOCC2)CC1)c1ccc(N(C)C)cc1 807674059 FMNDYVUDPFHIQD-LJQANCHMSA-N 430.593 2.281 10 20 IECD O=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 813525932 FZUQPBUIENNNQK-OKILXGFUSA-N 445.453 2.437 10 20 IECD Cc1cc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc(N2CCCC2)n1 813589833 GKBGLWSXKDPWJN-UHFFFAOYSA-N 428.512 2.360 10 20 IECD COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NCc1cc(Cl)cc(Cl)c1O 813684345 OEFMBEZLFBPGQM-UHFFFAOYSA-N 435.285 2.294 10 20 IECD COc1cc(OC)cc(C(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 917364447 HHIGIPDALKDWDH-SFHVURJKSA-N 428.485 2.347 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 918205922 XCVLNBWQRHGRBS-UHFFFAOYSA-N 437.544 2.104 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)N4CCCC4)CC3)cc2F)C[C@@H](C)O1 918223350 ZXHYBWUZZQHIGB-HDICACEKSA-N 447.555 2.482 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(N2CCOC2=O)c1 918312074 ZWHVMJXKDMIJFW-UHFFFAOYSA-N 438.484 2.077 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)NC3CCCCC3)cc2)C1 918373119 SKUFIZAWWWTMMT-IBGZPJMESA-N 443.592 2.417 10 20 IECD O=C(COC(=O)CCn1ccccc1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919253788 CCEIWMSJMIYWLM-UHFFFAOYSA-N 430.416 2.196 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1C(=O)c1cccs1 1116592002 MQLRUHMSHXXNPZ-HOTGVXAUSA-N 446.525 2.445 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1CCCC1 1816683443 KIENALHJEQOKLF-AWEZNQCLSA-N 435.575 2.452 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1=CCCC1 1816702994 PAHSPGHFSBJKSA-AWEZNQCLSA-N 433.559 2.372 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[nH]1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362260 SZHUGGMWMNRVMA-ZDUSSCGKSA-N 448.508 2.490 10 20 IECD CN1CC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)C1 1821295229 IUTCIDZVLJKBGC-OAHLLOKOSA-N 433.896 2.342 10 20 IECD O=C(Cc1ccccc1O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822011660 QBKWCGQBDQACJU-INIZCTEOSA-N 437.456 2.470 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1842023777 LUSDLZVQNIRDHI-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)COc3ccc([N+](=O)[O-])cc3)CC2)cc1 24088566 LFTDVVFRESRMRQ-UHFFFAOYSA-N 428.489 2.311 10 20 IECD CCS(=O)(=O)c1cccc(CNC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)c1 410225015 RBMLBJUMYNEWDX-UHFFFAOYSA-N 432.523 2.115 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](n4cc(C(=O)OC)nn4)C3)ccc21 545453144 LRWCIJIVPFPQBH-KRWDZBQOSA-N 425.489 2.370 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1 729232015 BWLCEKOWVXWHDF-QGZVFWFLSA-N 428.537 2.153 10 20 IECD C[C@H]1COCCN1CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729595106 XALJMRXAOVRVIW-HNNXBMFYSA-N 430.471 2.062 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)Cc3ccccc3)cc2F)CC1 730194368 OTCPHUDARPBMOV-UHFFFAOYSA-N 426.536 2.333 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC1CCN(CCS(C)(=O)=O)CC1 731760848 DKYHUUITUCQGIY-UHFFFAOYSA-N 436.622 2.327 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1C(=O)N(C)C 734491322 DNKUOLKXYNEQAJ-UHFFFAOYSA-N 449.598 2.429 10 20 IECD Cc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 737246515 XULMXMJKEPASFI-UHFFFAOYSA-N 429.542 2.102 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)CC(=O)N(C)C3CCCCC3)CC2)cc1 743363728 WPEBGNOVTPDHAM-UHFFFAOYSA-N 445.608 2.250 10 20 IECD C[C@@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 743638604 RXTCWYODOKZLNO-ZIAGYGMSSA-N 448.501 2.314 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1F 743904583 BDXFIKPGDVYKIB-UHFFFAOYSA-N 428.464 2.282 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(F)c3C)CC2)cc1 746039391 IPJIPCMDGGZNPB-UHFFFAOYSA-N 428.508 2.410 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCN3C(=O)CC(C)(C)C)nc12 748381280 DYAGWKLXAWZONP-OAHLLOKOSA-N 432.477 2.082 10 20 IECD COc1ccc(N2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCO4)CC2)cc1F 753861148 MXAISILFNAHHPN-UHFFFAOYSA-N 430.436 2.033 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC(=O)[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761463859 YMLQPXKWGVIGNF-CZUORRHYSA-N 446.525 2.473 10 20 IECD COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NCCc1ccc(O)c(O)c1)CC2 762268561 KPQMEQZISVONBW-UHFFFAOYSA-N 428.485 2.139 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-c4ncco4)cc3)cc2)C1 766576795 LABASFZOONLMDK-SFHVURJKSA-N 447.495 2.298 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC([C@@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904957 ZPIBMWKIICINEU-HXUWFJFHSA-N 429.483 2.369 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3cccc(-n4cnnn4)c3)cc2F)C[C@@H](C)O1 768510798 FCIBCQQCXCROIG-HZPDHXFCSA-N 440.479 2.110 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)cc2)[nH]1 769560460 GUNSHXRPBCCUPL-UHFFFAOYSA-N 435.480 2.396 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc5onc(C)c5c4)n3)CC2)cc1 771058977 WXPMPRHOJNHXQO-UHFFFAOYSA-N 434.456 2.481 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 772108193 SUZVBCFJPBAOGB-UHFFFAOYSA-N 432.544 2.272 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)OC)cc2)cc1OC 777612201 RWUMXABHTNWPOM-UHFFFAOYSA-N 443.503 2.436 10 20 IECD COC(=O)[C@@H]1C[C@H](OC)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778239578 TZINUTUSMYHCGD-QRWLVFNGSA-N 436.464 2.053 10 20 IECD COC(=O)Cc1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778379191 ZTVZJKNKGDESJS-KHPPLWFESA-N 437.496 2.254 10 20 IECD CCO[C@H](C)c1nc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788317970 BSCGJBQCBOGSLK-MRXNPFEDSA-N 446.573 2.352 10 20 IECD COCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788432832 FDUZPKZIUANNKR-SFHVURJKSA-N 441.528 2.352 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H](C)c1cccnc1 793722967 MBIWDKMHSXWNFQ-PXNSSMCTSA-N 437.544 2.009 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 798431205 DXXVCZVTEAYZMA-HNNXBMFYSA-N 434.514 2.358 10 20 IECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803299502 LRMVLPBGNICWCB-HRAATJIYSA-N 425.533 2.106 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C[C@H](C)O)c3ccccc3)CC2)cc1 804318579 OIBQBRJFNOFXKP-AZUAARDMSA-N 439.556 2.451 10 20 IECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807071931 DWPCZGLBDSJMLF-WBAXXEDZSA-N 425.476 2.447 10 20 IECD C[C@H](OC(=O)C[C@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808689704 GOQGFXIOFHCGPX-UONOGXRCSA-N 434.448 2.391 10 20 IECD O=C(N[C@@H]1CC[C@@H]2SCCS[C@@H]21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809520923 GXFXFKUYPOBSCO-ZAWLATJESA-N 436.599 2.396 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 919661995 COXVIJQFIZYAAO-GOSISDBHSA-N 438.528 2.350 10 20 IECD CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919970479 GGXSKUJTEYJWET-UHFFFAOYSA-N 429.492 2.232 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 1318142088 YDROPIJOZQYBLN-LMMKCTJWSA-N 446.567 2.046 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803978633 ORXUOJBLVQGREL-QYCLIQIRSA-N 441.459 2.276 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)ccn1 1804286429 VXFVWGRSNQXWIM-ZURAMSNBSA-N 439.468 2.172 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)nc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994512 HILUWBOMMKPIJM-XOBRGWDASA-N 437.431 2.055 10 20 IECD COCc1c[nH]c(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810547104 PDJJNUKCUIRXAP-UHFFFAOYSA-N 428.489 2.126 10 20 IECD CCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812613687 GVBSHKVZVCDFJO-MAUKXSAKSA-N 448.614 2.384 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1 1814162238 HOZPJANXSYCKOC-XSCIRMLOSA-N 433.411 2.183 10 20 IECD COCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814289771 BCPNULZGOXXFCT-JTQLQIEISA-N 425.894 2.470 10 20 IECD CCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433200 PDZMTRFBINEAEK-NRFANRHFSA-N 440.924 2.257 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(Cl)c1OC 1841164792 HPXNXHUUSVCIRY-UHFFFAOYSA-N 447.875 2.294 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3ncncc3c2)C1 1844091722 ANNCBEGGWLFEFZ-QPJJXVBHSA-N 446.463 2.277 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@](C)(O)c3cccs3)CC2)cc1 303866222 UNOBGQUWJVVMNI-QFIPXVFZSA-N 432.590 2.476 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ncn(Cc4ccccc4)n3)cc2)C1 726698272 BCPHYYNFSGRDCM-LJQANCHMSA-N 433.516 2.350 10 20 IECD CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 730121194 JTRIAGBJBDXGRU-QZTJIDSGSA-N 445.564 2.197 10 20 IECD Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c1 736622329 SAKJZCBSLUHOJB-FQEVSTJZSA-N 438.572 2.289 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743835224 PCOCBKGSDXBQMN-GFCCVEGCSA-N 443.447 2.473 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)C1 746148251 VZGWZTXQUOAXPY-QFIPXVFZSA-N 449.599 2.217 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2O)cc1 751214013 FDTIQRJEWHNPHR-UHFFFAOYSA-N 428.488 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)CCc3ccccc3)CC2)cc1 753306733 LDONLBGBRYSWMQ-TWLJRWAQSA-N 437.540 2.010 10 20 IECD CCc1nccn1CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 756923595 WYKZLORWAYDPOS-YBEGLDIGSA-N 444.538 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(CS(C)(=O)=O)c(F)c3)CC2)cc1 759164459 YKAPKWQVXULMIA-UHFFFAOYSA-N 435.521 2.140 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc(F)ccc2Br)SC1=S 761181101 NIQVIDSOUWRZIF-YRNVUSSQSA-N 439.353 2.339 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCc4cc(O)ccc4C3)CC2)cc1 768837813 VLJNFDRZURCGFK-CFGKVWFZSA-N 435.524 2.279 10 20 IECD CC(C)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccnc2)no1 769749471 NQCYDBVDZKOONM-MRXNPFEDSA-N 431.474 2.336 10 20 IECD CCc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)co1 772377907 TYAGOJJYZZFADA-UHFFFAOYSA-N 431.470 2.332 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1cn2ccccc2n1 775123586 VFDALORKLMRVLZ-UHFFFAOYSA-N 431.290 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)Cc3c(C)noc3C)CC2)cc1 778286706 CRCKVJVRGIXCSZ-YDZSZYSISA-N 426.517 2.252 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ncccc3Cl)CC2)cc1 778328057 KWBUODWTDLMFHV-HJWRWDBZSA-N 444.919 2.144 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C)c1ccc(N2CCOCC2)cc1 785596920 CAFGLCJMAACPKX-AVRDEDQJSA-N 447.539 2.340 10 20 IECD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 787327746 MVUPNYYDCLSTOG-KDOFPFPSSA-N 429.492 2.436 10 20 IECD COC(=O)c1cncc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 788637510 XUOWCABCDVOCQV-CQSZACIVSA-N 441.456 2.417 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 788909812 HUKJLKVPUAFVAC-IBGZPJMESA-N 440.931 2.478 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](CCC(C)C)(C4CC4)C3=O)CC2)cc1 789667651 KHVDLGZMGCPULL-DEOSSOPVSA-N 442.560 2.481 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3nccs3)cc2F)C[C@H](C)O1 789828738 YFDCGQJPIYCAAN-GJZGRUSLSA-N 434.537 2.213 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OC[C@H]1CCCS(=O)(=O)C1)c2[N+](=O)[O-] 791495241 VAXYIWGBIXNVHA-GFCCVEGCSA-N 443.433 2.352 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCC[C@H]3C[C@H]4CC[C@H]3C4)CC2)cc(OC)c1OC 793581534 WAEVFONKWGUFDG-BZSNNMDCSA-N 445.560 2.304 10 20 IECD C[C@H](NC(=O)C(=O)NCC[C@@](C)(O)c1ccccc1)c1ccc(N2CCOCC2)cc1 803315492 JTLBBXBJUQSDFZ-MHECFPHRSA-N 425.529 2.114 10 20 IECD CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807286913 FFQODSNFGPFEES-GOSISDBHSA-N 428.533 2.052 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385909 UJEJDHCDMLKMPR-NSHDSACASA-N 437.294 2.037 10 20 IECD O=C(NCc1ccc(OC(F)F)cn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807528048 AKNAVDPQZKKMOD-KRWDZBQOSA-N 435.427 2.213 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1=CCN(C)CC1 807771242 TYVQVGANLBOGJJ-WBVHZDCISA-N 436.503 2.140 10 20 IECD Cc1ncc(S(N)(=O)=O)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccccc2)c1C 815273217 NMLWTALPWQQYJR-UHFFFAOYSA-N 427.482 2.485 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC(=O)N1CCOCC1 913360659 NEAHUTHBMYTJSV-KAMYIIQDSA-N 440.568 2.132 10 20 IECD C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 917371640 MNGHMKNEOZRTHQ-DEOSSOPVSA-N 433.464 2.377 10 20 IECD CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 917832520 CJVIVBKCBBIMGJ-IEBWSBKVSA-N 428.558 2.334 10 20 IECD C=C1c2ccccc2C(=O)N1CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644481 ZMCCYOYHZJRDHD-UHFFFAOYSA-N 439.537 2.054 10 20 IECD CNc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 918825207 OYQZQEOQMGXCFR-UHFFFAOYSA-N 446.435 2.085 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)COc1ccc(F)cc1 919908289 WWXOYVPVBIKCIJ-GOSISDBHSA-N 435.471 2.165 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919968323 CTAKIDHRVREREI-UHFFFAOYSA-N 447.557 2.007 10 20 IECD C[C@@H](NC(=O)N1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(N2CCOCC2)cc1 920921524 KORONUBMBITWOZ-GOSISDBHSA-N 438.528 2.457 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 921199855 DVESEESJBGESRT-UHFFFAOYSA-N 449.533 2.219 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H]1C[C@@H]1c1ccccc1 1804336350 QDEOOYJDWUTULJ-ILOCAZANSA-N 443.594 2.289 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CCSCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000591 JROXFUUJMBCTFD-UZLBHIALSA-N 442.541 2.351 10 20 IECD Cn1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)n1 1816321292 SIBSQPWUURSDGQ-CYBMUJFWSA-N 445.867 2.223 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1)C(=O)C1CC1 1823708317 RQSLIPXINIVVPL-JTQLQIEISA-N 435.889 2.413 10 20 IECD O=C1CC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1832818851 PFKFBEJIXVYKGL-WSSFADSRSA-N 442.512 2.415 10 20 IECD O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248978 XYECXGRNQLCYLA-HUUCEWRRSA-N 429.423 2.392 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccc3nc[nH]c23)C1 1843253963 IFZZAVIUDOPRNL-SOFGYWHQSA-N 434.452 2.210 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc[nH]c3nccc2-3)C1 1843272684 SESFPNKBHBHSOK-UHFFFAOYSA-N 442.479 2.124 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)ccc1F 1847388066 WCRRJKIJYRJSNL-KBPBESRZSA-N 441.937 2.155 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nn(-c3ccccc3)c3c2CCC3)c1 115734876 OVEGDFXDFAARNT-UHFFFAOYSA-N 426.498 2.368 10 20 IECD CCn1cc(Br)cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 725887056 CQJPLASZXIIFDI-UHFFFAOYSA-N 440.363 2.435 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C)C(=O)NCc3ccccc3)cc2F)CC1 730120646 SPJCTAIDPGHGHF-GOSISDBHSA-N 441.551 2.472 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)cc1 737008768 KOMAXTJSOGPMNY-UHFFFAOYSA-N 428.537 2.252 10 20 IECD COCCOc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738897971 YGPPIZOUKZWKEL-UHFFFAOYSA-N 433.530 2.268 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1 741096919 IRORDKAHWYVYLB-UHFFFAOYSA-N 444.557 2.164 10 20 IECD CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 742574078 QXOIHFOYFKZYBM-IBGZPJMESA-N 446.573 2.133 10 20 IECD CCOC(=O)[C@@H]1CSCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386600 AZBZYTPCCWZCEF-IBGZPJMESA-N 438.505 2.381 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3nnc(-c4ccccc4)o3)cc2)C1 749176783 UXHIDSBJYKJQNQ-IBGZPJMESA-N 448.527 2.480 10 20 IECD CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405964 LPIWSNVSTTXMOA-QHCPKHFHSA-N 425.504 2.376 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](Oc4cccc(F)c4)C3)CC2)cc1 754268459 COZLARDDYZMLSE-QPPBQGQZSA-N 429.536 2.471 10 20 IECD CC1(C2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)OCCO1 756679797 FMXATXSKIAFIFC-SFHVURJKSA-N 430.549 2.073 10 20 IECD CN1CCCc2ccc(S(=O)(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 757874172 OKJLUOHSIIEESW-IBGZPJMESA-N 442.585 2.249 10 20 IECD C=CC(=O)NCc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759240911 DOBPGNMHQQFJCK-UHFFFAOYSA-N 439.512 2.477 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1 759590832 ATPQGDLXUCFOCC-SOFGYWHQSA-N 430.501 2.295 10 20 IECD CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 765852384 LXJZWKRIKOTJJW-UHFFFAOYSA-N 433.530 2.314 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@@H](COC(C)C)C3)CC2)cc1 771297238 SSLNXVIWWWARRT-JOCHJYFZSA-N 434.581 2.043 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(Cn4cncn4)c3)CC2)cc1 778241689 OCZDMXSUSZARJD-KTKRTIGZSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CCO)C3CCCCC3)CC2)cc1 778376616 DAKLJFINTQBEKS-VDZCTEQFSA-N 429.561 2.348 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 781368758 UEWZMLVTFQZPOG-QUCCMNQESA-N 440.548 2.011 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 785423442 YJLRVCILVIXLQK-UHFFFAOYSA-N 426.483 2.290 10 20 IECD CC(C)CN1C[C@@H]2CN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CCN2C1=O 787066221 UDOHAZOWJPTDNH-RXVVDRJESA-N 429.565 2.372 10 20 IECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccsc1 787613576 AFCLNMJSMYRGBS-NRFANRHFSA-N 444.601 2.400 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1 788933732 XFUMCUNDVRCSQE-FQEVSTJZSA-N 426.561 2.200 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCCC3)C2)cc1 788978435 XKMIRIFYZRNQNX-FQEVSTJZSA-N 428.577 2.446 10 20 IECD CN(CC1(c2ccccc2)CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800215 MHLRXTHCJCAVCA-UHFFFAOYSA-N 425.504 2.469 10 20 IECD CCCN1CCC(N(C)C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789819502 NTUVOTHRDZTTRD-QZTJIDSGSA-N 448.583 2.388 10 20 IECD C[C@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793730020 BMVNCOOHCCFGNF-FNZWTVRRSA-N 448.567 2.195 10 20 IECD C[C@@H](COc1cccc(F)c1)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 793780660 AFVUWCURFCTWMO-IRXDYDNUSA-N 429.492 2.423 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 793860954 DRDDJHDBSQIPAH-UHFFFAOYSA-N 441.528 2.328 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 795111735 CHUIITKLLQTBOH-UHFFFAOYSA-N 435.502 2.291 10 20 IECD CC[C@H](C)[C@H](NC(C)=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 795476833 UBCJUPJHYBRZNA-KKSFZXQISA-N 442.539 2.109 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cc1 804345959 PBNNWAUUIMPKAV-UHFFFAOYSA-N 436.556 2.440 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc1F 804853436 XSEGJMHRAJOKNS-TZIWHRDSSA-N 434.556 2.048 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCCC4)C3)cc2F)CC1 805007117 NWLAFTMWQAGRNF-UHFFFAOYSA-N 446.567 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)c3nc(C)cs3)cc2F)CC1 805007215 HSCYAHIKYOMPCS-OAHLLOKOSA-N 447.580 2.269 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3C[C@@H](OC(C)C)C3(C)C)cc2F)CC1 805010025 RTAPOTSHWYROTC-LEWJYISDSA-N 448.583 2.292 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cnc(Cl)c(F)c3)cc2)CC1 805073336 HHDIWVZWUBJETD-UHFFFAOYSA-N 426.901 2.021 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 805202254 OERPLUADZRLCCF-CYBMUJFWSA-N 438.962 2.317 10 20 IECD CC[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 805773380 QLRXGSWRCKDIFR-CABCVRRESA-N 440.521 2.298 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1COC2(CCCC2)O1 806691418 BFSDTPNDFSDVAP-HNNXBMFYSA-N 441.322 2.305 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1Br 806899843 GBXHNINISQTRTL-UHFFFAOYSA-N 447.333 2.438 10 20 IECD O=C(NCC[C@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807320452 JOEBWWLNOUYDJK-DOTOQJQBSA-N 425.476 2.448 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1ccc(F)cc1 807632379 DMBAWZGVIRIUKP-KRWDZBQOSA-N 429.492 2.204 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@H]3c3cnn(C)c3)CC2)cc(OC)c1OC 808176832 LYRWUICFVMNDKO-OAQYLSRUSA-N 443.548 2.135 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)cc2F)C[C@H](C)O1 808918949 KHMPGXSZENSRHV-KBPBESRZSA-N 441.459 2.365 10 20 IECD CCOC(=O)c1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)nc1C 914877889 JMPKMQSHOKCRHB-UHFFFAOYSA-N 441.484 2.081 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cccc5cccnc45)CC3)nc12 917090939 CEQCCSVFCNXYBK-UHFFFAOYSA-N 446.511 2.478 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1OC 917758435 YCDMZWITNGEAAW-UHFFFAOYSA-N 438.483 2.364 10 20 IECD O=C1CCCc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1 917918493 RPSHUCKGICKCFO-UHFFFAOYSA-N 433.505 2.416 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cnn(C[C@@H]4CCCO4)c3)CC2)cc1 918196855 HLCJFCAMTPOANF-QFIPXVFZSA-N 442.564 2.405 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(-n3cncn3)nc2)c(C)n1-c1ccccc1 918250099 JFRQHQJCTQFNHB-UHFFFAOYSA-N 429.484 2.367 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 918306329 YVGGRDMWGQYIMI-UHFFFAOYSA-N 446.573 2.428 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OC(F)F)c3)cc2)C1 918463195 ILJBEWHMFSOKEA-OAHLLOKOSA-N 446.454 2.245 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)Nc4ccccc4)CC3)nc12 919803021 IJSNMXJDJFLQLF-UHFFFAOYSA-N 438.488 2.398 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C2CC2)nc2c1c(C)nn2C 1320514288 SGJUUKXXEVYTTI-KRWDZBQOSA-N 438.484 2.470 10 20 IECD CN1CCN(c2ccc(CNCCN(C)S(=O)(=O)c3ccc(F)cc3)cc2F)CC1 1322528562 BHKOIULXJWBQGG-UHFFFAOYSA-N 438.544 2.127 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(CCC(N)=O)c3ccccc3OC)CC2)cc1 1335132853 IKYJFSQCPNHICZ-UHFFFAOYSA-N 440.544 2.125 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 1338534412 BZQFTSOJUBLHJA-SYJLOODJSA-N 448.516 2.335 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3csnn3)cc2)CCC1 1786478980 FNJWSGBNHXHTAT-UHFFFAOYSA-N 447.567 2.146 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1 1787294938 FKSKXJZLRFMWKB-IHPCNDPISA-N 439.512 2.027 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1CC(F)(F)C1 1802634651 NOXDZEAQBUQTSJ-FZKQIMNGSA-N 432.427 2.253 10 20 IECD Cc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1803268283 XEOICTONTMIOLC-UZUQRXQVSA-N 447.495 2.154 10 20 IECD C[C@H](CN)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804308 UZFCCWDLONETGC-IAISJRAMSA-N 432.908 2.061 10 20 IECD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825300254 WGTFWDCDANZGGQ-ZDUSSCGKSA-N 440.481 2.123 10 20 IECD COCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714906 BVAGWPYPGZGXLV-HXUWFJFHSA-N 426.517 2.045 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2CNc3ccccc32)C1 1842937670 PIPRDEQSBZDKKG-LKUPDRCFSA-N 435.480 2.229 10 20 IECD CCc1cnc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847038163 CHHFQTFDTMAKFV-FNORWQNLSA-N 429.498 2.353 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1 726719101 FEQGAKRSLBUBCO-UHFFFAOYSA-N 437.504 2.033 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(n3cc(Br)cn3)CC2)c1 731838969 RGWJMBXECGBHHS-UHFFFAOYSA-N 443.323 2.200 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl 734701504 BRHQHJYFSQJVOL-UHFFFAOYSA-N 429.908 2.499 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)c1O 737283984 JGDXCCJTUSFEII-IYBDPMFKSA-N 427.501 2.265 10 20 IECD CN(Cc1ccon1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 740032877 WKURIFMWUJOPTD-UHFFFAOYSA-N 425.468 2.272 10 20 IECD CC[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCCC1=O 745690217 CRWZRPVMGAEWMM-GOSISDBHSA-N 434.448 2.345 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H](C(F)(F)F)O1 745690541 CTANMLRPRICVLV-UNEWFSDZSA-N 428.455 2.250 10 20 IECD Cc1ccc(Cn2nccc2NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 746381490 JWZZVGFXJHPXKD-KRWDZBQOSA-N 437.500 2.485 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@H](C)N3CCCCC3)CC2)cc1 753286517 MZLGFQHTWRDTBB-CTDFXDFQSA-N 428.577 2.281 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCCCSc2nccs2)c(C)c([N+](=O)[O-])c1 753846165 DDMLYNXLZQTFLB-UHFFFAOYSA-N 438.487 2.383 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@](C)(c4ccccc4)C3)CC2)cc1 754062801 WLEWZDIACCSFOK-NOZRDPDXSA-N 425.573 2.426 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 760092029 UZJLXVVDSCZVIJ-OKILXGFUSA-N 430.480 2.406 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 761610997 NCZFCNLBTRBMAE-UHFFFAOYSA-N 442.516 2.135 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3C[S@@](C)=O)CC2)cc1 762641303 SNTPKSHCJFIXSQ-SSEXGKCCSA-N 429.542 2.251 10 20 IECD COc1cccc(CNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c1O 769001224 KDVRMZKWADJGJE-UHFFFAOYSA-N 434.880 2.194 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773859037 USHKFQKSWVGEMG-HNNXBMFYSA-N 432.546 2.257 10 20 IECD CS(=O)(=O)C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 774172131 MERLPCZAIVVZNI-FQEVSTJZSA-N 449.548 2.372 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 774924107 UEIMGJZFJKJIBI-UHFFFAOYSA-N 444.538 2.465 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 778412043 WTDHHLBHFKECQT-SCOAYWHSSA-N 426.521 2.019 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NCc3cc(Cl)cc([N+](=O)[O-])c3O)C2)cc1 779172097 NKHNWGKLGBKQIX-UHFFFAOYSA-N 427.866 2.125 10 20 IECD O=C(COC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc(O)c(O)c1 783543472 RSRITBYNRVJQGV-QGZVFWFLSA-N 433.482 2.066 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nccn1C 785618160 BAJNHOJHNAFFNI-OAQYLSRUSA-N 435.528 2.325 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)cc2)CC1 786259393 NTJQWWFHSGLEDB-IBGZPJMESA-N 438.503 2.164 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CCOc2ccc(F)cc21 789800174 MOXLPDCZXYGGJU-SFHVURJKSA-N 431.439 2.058 10 20 IECD COc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789846664 OKWWNPQNQKVFLI-UHFFFAOYSA-N 443.569 2.402 10 20 IECD C[C@@H](OC(=O)[C@@H]1CCCN(C(N)=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792270568 AXPCVBMUTUQPQD-ZIAGYGMSSA-N 449.463 2.123 10 20 IECD Cc1cc(C)cc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793716269 AGNJHXBVOLBUDK-QUCCMNQESA-N 436.556 2.499 10 20 IECD O=C(NCCCCn1ccnc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793722252 AZUPJYUYEGUGAP-MRXNPFEDSA-N 435.475 2.166 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc4cnn(C)c4c3)CC2)cc1 794351666 CHHKGTDPZYOLIB-KTKRTIGZSA-N 433.512 2.103 10 20 IECD COCCCn1c(S)nc2cc(C(=O)NCc3ccc(OC)cc3O)ccc2c1=O 794376408 FIMFQAJHUXAMNA-UHFFFAOYSA-N 429.498 2.366 10 20 IECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803302628 RZJOHLXHDHTNLZ-QGZVFWFLSA-N 439.512 2.478 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661862 BYFKHZMLIDFDSG-YOEHRIQHSA-N 436.528 2.270 10 20 IECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663569 SRRYDLPNUASMHU-INIZCTEOSA-N 427.524 2.245 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)c3cccnc3)cc2F)CC1 805007707 XZUJUIFGYUCHTA-KRWDZBQOSA-N 427.524 2.198 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@H]1CCO 807768167 DMISUULGHBJIHC-HDMKZQKVSA-N 425.476 2.040 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCO1 807768796 BPQDAOMUPPKSGL-WBAXXEDZSA-N 425.476 2.447 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)C1 808037027 HYUZKLBXAZAAHV-MJGOQNOKSA-N 432.565 2.474 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3C[C@H](c4ccccc4)OC3=O)CC2)cc1 808589889 HLQJDUKYMLABQJ-LEWJYISDSA-N 438.480 2.191 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(CO)C[C@@H]3c3ccccc3)cc2)C1 812011329 ZFEZIIXRBAYFDT-LFAGZIFBSA-N 436.556 2.354 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCNS(=O)(=O)c3ccccc3)cc2F)C[C@H](C)O1 917709426 ICECWLPKCPNHEV-IRXDYDNUSA-N 449.548 2.424 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(=O)n(-c2ccc(F)cc2)n1 917709697 VWNSMLKHVZKTMM-UHFFFAOYSA-N 426.423 2.277 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 920196476 WDCQMGZQEGRMQV-UHFFFAOYSA-N 430.892 2.390 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCSCC1)c1cc(O)c(O)c(Cl)c1 1792541450 DBRWKJMPLVCTGS-QDMKHBRRSA-N 439.965 2.052 10 20 IECD COC(OC)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803355323 NMCDAGLTUOVHDM-DYVFJYSZSA-N 449.891 2.085 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1(O)CCC1 1804282889 GFKQSJVMEHROSX-HSWVFLFASA-N 430.501 2.006 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)ccn1 1810787818 QMZABOBODNIXGF-DYESRHJHSA-N 433.468 2.225 10 20 IECD CCOCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877671 XIZBCTRHGGBAOO-PDFOZTTASA-N 432.517 2.473 10 20 IECD O=C(Cc1ccccc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837706195 FRKKJBKFPNEAFH-UHFFFAOYSA-N 439.512 2.348 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccnc3ncccc23)C1 1845634942 HRADCBRROAWOMI-FNORWQNLSA-N 446.463 2.277 10 20 IECD O=C(CCCn1cccc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037608 USORKYCWPLISSQ-VQHVLOKHSA-N 425.485 2.302 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1 732704141 LQIPMGGHGVABOJ-UHFFFAOYSA-N 440.475 2.044 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1 737132043 UBVQGKWROZAPHQ-UHFFFAOYSA-N 440.504 2.215 10 20 IECD CCn1c(O)nc2cc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc2c1=O 739768370 QUCLIVGSFFRLDB-UHFFFAOYSA-N 435.484 2.076 10 20 IECD CN1CCCN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)CC1 741097864 ZLIPLVVSLBLNJS-UHFFFAOYSA-N 433.556 2.460 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nc(N4CCCC4)ncc3Cl)CC2)cc1 742921129 YKGXKXCMBGVFNS-UHFFFAOYSA-N 444.967 2.291 10 20 IECD Cc1c(C(=O)NCc2ccc(N(C)C)cc2)cc(Br)cc1S(N)(=O)=O 747199834 GCDPLMNWCMDLSM-UHFFFAOYSA-N 426.336 2.401 10 20 IECD COc1ccc(N(C)CC(=O)N(Cc2cccs2)[C@H]2CCS(=O)(=O)C2)c(OC)c1 752126124 XFYBFROQVUFXRZ-HNNXBMFYSA-N 438.571 2.417 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)COc2cc(Br)ccc21 753644871 OSQFKDCGDTXBGH-NSHDSACASA-N 435.274 2.333 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](CC(N)=O)C3CCCCC3)cc2F)C[C@@H](C)O1 754504567 ISVICTAGGIQUAL-CBGDNZLLSA-N 448.583 2.469 10 20 IECD O=C(Nc1ccn(CC(F)F)n1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754937792 QMFPCJDMBPITCI-UHFFFAOYSA-N 443.401 2.473 10 20 IECD CC(C)(O)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 760159605 OHXRGPUWEJJNPI-UHFFFAOYSA-N 444.498 2.140 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc([N+](=O)[O-])c2nsnc2c1 762969886 HTVRMTJBUCZVPF-UHFFFAOYSA-N 429.458 2.481 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CS(=O)(=O)c2ccccc21 763015072 USCWTZVKFMMHOA-SFHVURJKSA-N 433.505 2.115 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@H]1N1CCN(C)CC1 764352246 SOYIDWWEKMLZFB-SIKLNZKXSA-N 431.650 2.407 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1nc(COc2ccccc2)n[nH]1 771301393 IQFFSELYIYXGCB-UHFFFAOYSA-N 440.479 2.359 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(C(F)(F)F)ccn3)cc2)C1 772946447 NADBEVYAHVYKEJ-CQSZACIVSA-N 449.433 2.057 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccco1)N1CCCC1)c1ccc(N2CCOCC2)cc1 774871342 PSOHDOFQCYGXHI-RXVVDRJESA-N 440.544 2.247 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 776493422 DUJFCAPBOSPAJD-UHFFFAOYSA-N 435.477 2.278 10 20 IECD CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(NS(C)(=O)=O)ccc1O 782808612 FTSTXZILJHIQQN-CABCVRRESA-N 439.534 2.378 10 20 IECD CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2ccc(N3CCOCC3)c(F)c2)CC1 783504522 LYMWNUZGSJIGLK-KRWDZBQOSA-N 435.540 2.332 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nn(-c4cccc(F)c4)cc3O)CC2)cc1 785986413 JEPXVJGQNAGDOO-UHFFFAOYSA-N 439.491 2.278 10 20 IECD Cc1ccc([N+](=O)[O-])c(=O)n1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 788048479 SIEBFYVNFCYISZ-HUUCEWRRSA-N 432.452 2.134 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)nc1 788911161 JQKTUDNKVYLKHA-UHFFFAOYSA-N 449.555 2.484 10 20 IECD CN(Cc1ccccc1O)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 789314865 ZPQYEFBOHIFGAF-IBGZPJMESA-N 429.492 2.390 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3(NC(=O)NC(C)C)CCCCC3)CC2)cc1 792097907 USKLRLOGYZUWQH-UHFFFAOYSA-N 445.608 2.344 10 20 IECD C[C@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793728368 YHGBNUMMHOOHMK-FXAWDEMLSA-N 434.540 2.150 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1cccs1 793733019 KFZTXLZSPIWLIO-WMZOPIPTSA-N 442.585 2.061 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](CS(C)(=O)=O)C1 795084849 JIXYBZOXTGUMFU-CABCVRRESA-N 440.521 2.156 10 20 IECD CCOC(=O)c1ccc(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 795806684 VZBDUYYHPUBGBP-UHFFFAOYSA-N 440.468 2.457 10 20 IECD COCCn1c(Cc2ccccn2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802497638 NZPYOJUMKHORCW-UHFFFAOYSA-N 426.496 2.385 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297834 HRNVDYPIZHXIHV-QRWLVFNGSA-N 425.533 2.404 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 804315478 MBZYWBYDZPYOTO-WZONZLPQSA-N 440.588 2.256 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N[C@@H]1CCc2c(O)cccc21 804400100 NJILHDDTMWYYGO-HSZRJFAPSA-N 448.567 2.344 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCc3ccc(F)cc3)cc2F)CC1 805007355 JCEGBKTXDLKKDR-UHFFFAOYSA-N 444.526 2.424 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CC4)C(=O)C3)cc2Cl)C1 807952022 JARCLGWBVXZOHJ-OAHLLOKOSA-N 432.952 2.026 10 20 IECD O=C(NCCC[C@H]1CCCCO1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807995161 VGFOVNOFVCUVFG-HSZRJFAPSA-N 442.604 2.300 10 20 IECD COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 808030166 WYIKIJCAXLICSD-SJLPKXTDSA-N 430.549 2.227 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](NC(C)=O)C4CCCC4)n3)CC2)cc1 809464571 HOPDFJACZHEOTC-JOCHJYFZSA-N 441.532 2.337 10 20 IECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C[C@@H](C)S1(=O)=O 813062904 KEMFYEKSQOAPCO-AEFFLSMTSA-N 440.585 2.075 10 20 IECD CC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(C)(C)O 818584775 XWOFROQWYYEXKY-KRWDZBQOSA-N 437.474 2.381 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)c(=O)n(C)c1=O 913092959 JZEPCFZHSGLDEX-UHFFFAOYSA-N 446.432 2.027 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C(N)=O 917916787 BZHHVSWCFUZKLK-HUUCEWRRSA-N 435.521 2.325 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnccn4)CC3)cc2F)C[C@@H](C)O1 918220208 IEHSZDNWXROFFV-CALCHBBNSA-N 428.512 2.261 10 20 IECD COc1ccc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918441125 WKBSXJGIKNIDLZ-UHFFFAOYSA-N 431.464 2.059 10 20 IECD CS(=O)(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc21 919968482 ALEJDCHLULCUAB-UHFFFAOYSA-N 443.569 2.147 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1CSc1nc[nH]n1 1320397512 IBCXFURWQLCWEP-INIZCTEOSA-N 442.497 2.412 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1)C2)c1cc(O)c(O)c(Cl)c1 1799770837 NCONBCRAEDQCAL-YVWYUNDQSA-N 448.878 2.336 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H]2CCOC2)cc1 1801519087 SQBNTGPIMRGTOM-QXUYBEEESA-N 437.540 2.334 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cnco3)C2)CC1 1806328723 XSWQOLFRKYZXHN-HWKANZROSA-N 427.457 2.350 10 20 IECD O=C(c1cc2cccnn2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810554184 FNQDQIINVBNIKJ-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(=O)C2CC2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811797290 RFRHRKPNAKQUFC-KSSFIOAISA-N 443.887 2.445 10 20 IECD CCC(=O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811808497 CKDIZKQORKAVHJ-FZKQIMNGSA-N 431.876 2.445 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)ncn2)[nH]n1)c1cc(O)nc(O)c1 1817846393 VIYXZUHAYHFHRB-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD COCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1837699081 JXMHQVCIIOIFHI-UHFFFAOYSA-N 426.897 2.010 10 20 IECD CCc1cnc(N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)s1 673315147 MZVPEZKEIRFIMU-UHFFFAOYSA-N 425.558 2.471 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCN3C(=O)c4ccccc4C3=O)cc2F)CC1 730192480 BJCFKQKUTKRDJE-UHFFFAOYSA-N 438.503 2.270 10 20 IECD CC(=O)N(C)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 743046383 FACZDIRSQBRLFK-UHFFFAOYSA-N 430.530 2.172 10 20 IECD COCCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 745692458 VXKPUPQMPZAUCG-IBGZPJMESA-N 432.565 2.115 10 20 IECD CN1CCN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2Cl)CC1 749268846 CIYBZESJAYUHHZ-UHFFFAOYSA-N 438.937 2.421 10 20 IECD CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 749656633 ZPRKMNVCUOCBKN-UHFFFAOYSA-N 427.526 2.500 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(C)c(=O)c4ccccc34)CC2)cc1 759087831 YTBXVNMYZHBBOE-UHFFFAOYSA-N 435.480 2.053 10 20 IECD CCn1c(COC(=O)/C=C\c2ccc(O)c(O)c2)nc2cc(S(=O)(=O)N(C)C)ccc21 759592407 GQUADCRHDWJROF-POHAHGRESA-N 445.497 2.474 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](C)S(=O)(=O)CC1 760000735 XEUCASSCSPSREP-CABCVRRESA-N 440.521 2.298 10 20 IECD CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 765255068 OUSPXALQGBOXOK-QFBILLFUSA-N 430.574 2.147 10 20 IECD CCn1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C 769020292 BYQFSFIEKAXSGM-UHFFFAOYSA-N 438.576 2.307 10 20 IECD NC(=O)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 769647518 NBQVSRFDQHYVSQ-QGZVFWFLSA-N 431.495 2.211 10 20 IECD C[C@@H](NC(=O)N1CCC([C@H](O)c2nccn2C)CC1)c1ccc(N2CCOCC2)cc1 771971311 RLUITIBSVCECKJ-UTKZUKDTSA-N 427.549 2.473 10 20 IECD COc1ccc(OCCNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778222014 SBYIYIMNZXODMN-VAWYXSNFSA-N 439.512 2.104 10 20 IECD COC(=O)Cc1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778223607 LZAIDLCKHZLZRT-QXMHVHEDSA-N 437.496 2.254 10 20 IECD Cn1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C(F)(F)F 782105941 XTPZGPYPKNYEMW-ZDUSSCGKSA-N 426.395 2.291 10 20 IECD COCc1noc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 785412380 IUZDMVDQTYKWSE-UHFFFAOYSA-N 425.444 2.141 10 20 IECD CC(C)CCN1CCC(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788322607 INSXYUVDOAFZLA-UHFFFAOYSA-N 430.593 2.014 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](c2ccsc2)O1 788324885 ZGBZNCXCMXUPDA-OXJNMPFZSA-N 429.542 2.190 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 788963442 IUTSZLJKBLZDAA-SFHVURJKSA-N 438.528 2.079 10 20 IECD Cc1cnc(C2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)s1 789798048 AVBPTVQRNRRTML-UHFFFAOYSA-N 446.548 2.450 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](n4ccnc4)C3)cc2F)C[C@@H](C)O1 789827342 SAPOPRPWHTXJEF-ZIFCJYIRSA-N 443.523 2.116 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)o1 789828147 WPNDVNKTCCRORZ-MDZRGWNJSA-N 447.507 2.461 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H](CCCO)c1ccccc1 789856149 PEIIQZUVUYWGDM-OAQYLSRUSA-N 427.570 2.486 10 20 IECD COc1ccc(-c2noc(CN3CCN(C(=O)c4c(F)ccc(O)c4O)CC3)n2)cc1 789946267 HBKIJYDUKSPANI-UHFFFAOYSA-N 428.420 2.254 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]4[C@H](CCN4C(=O)OC(C)(C)C)C3)nc12 795104005 QYOYENFDLNNQFZ-RHSMWYFYSA-N 445.520 2.443 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1OC 798434779 OKTIMDDYIOABCG-UHFFFAOYSA-N 434.514 2.438 10 20 IECD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800048585 FPBILLWWVIKKRE-YWZLYKJASA-N 434.968 2.320 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1 802610223 WEIOINKGVYLQFW-KRWDZBQOSA-N 448.545 2.024 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c1 803665082 WNKMKPBZJPJTSC-UHFFFAOYSA-N 440.519 2.191 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3C[C@@H](O)c3ccco3)CC2)cc1 804319592 PUVRMZZWBLXXAV-PZJWPPBQSA-N 441.528 2.488 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385769 QIPFAIYCDOGFIB-UHFFFAOYSA-N 445.277 2.083 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccc(NC(C)=O)nc1 807887608 BCZIJBAJASWXAQ-UHFFFAOYSA-N 449.305 2.173 10 20 IECD CCCc1nnc(SCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1N 808052846 YAXFLGTWNYLBCU-ZIAGYGMSSA-N 436.557 2.106 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3COc4ccccc4[C@@H]3O)CC2)cc1 811995763 WUQGSMQSQAJARV-GGAORHGYSA-N 440.544 2.001 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC[C@@]1(C)NC(=O)NC1=O 819518904 KGCFRSSNBMPLFO-JOCHJYFZSA-N 432.521 2.143 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2ccc(Br)cc2O)C1=O 864043090 DMCOGHIOFQYLBL-UHFFFAOYSA-N 447.289 2.260 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C[C@@H]1COc2ccccc2O1 917022347 JDCSNFQZSPLZAR-GOSISDBHSA-N 429.492 2.050 10 20 IECD CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCc1ccc(O)c(O)c1 917356472 UHXFLBGYPMCQGJ-QGZVFWFLSA-N 438.571 2.165 10 20 IECD CN(C)C(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918294844 KSUZHNWNOARAKH-LJQANCHMSA-N 425.485 2.240 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 1320514331 UKGALXVUIREEHH-ZBFHGGJFSA-N 446.887 2.395 10 20 IECD CCc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)nn1C 1320829454 PAGAMTQNTXSPSM-UHFFFAOYSA-N 444.513 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccccc3NS(C)(=O)=O)CC2)cc1F 1323675843 WAOQYWQDDQBWEV-UHFFFAOYSA-N 436.509 2.238 10 20 IECD C[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1802647439 PJVANINMZLGTAK-OWLYRPNTSA-N 445.610 2.364 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnnc(Cl)c2)CC1 1825344005 RHWWZSPBBHNUMI-MRXNPFEDSA-N 445.907 2.483 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2CCOC2=O)cc1 1847692976 YHBWRWDIGBOAMH-SFTDATJTSA-N 436.512 2.362 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ncnc4c3c(Br)nn4C)cc2)CC1 302589731 ASJXVJWEXZVQEG-UHFFFAOYSA-N 444.337 2.406 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)c2sccc2-n2c(C)ccc2C)c1 729417259 JFIOHQZXADDACP-UHFFFAOYSA-N 446.554 2.432 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](O)COc1ccc(F)c(F)c1 729598068 VQMOFSLQRDNSDI-HNNXBMFYSA-N 439.434 2.180 10 20 IECD CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739766937 UMOIDKPEMLDFOI-UHFFFAOYSA-N 444.557 2.327 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)c1 740494317 CIJVFHKZJGKENP-UHFFFAOYSA-N 449.529 2.041 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1 743560910 WPYBOWWKWZPJSK-FQEVSTJZSA-N 438.528 2.002 10 20 IECD COc1cc(N(C)CC(=O)NCC(=O)N[C@@H](C)c2ccc(F)cc2)cc(OC)c1OC 744405830 XRFRQSAGNPWILR-AWEZNQCLSA-N 433.480 2.281 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnn(C4CCOCC4)c3)n2)c[nH]1 749736943 CWWAHQIQISPHOQ-UHFFFAOYSA-N 437.503 2.274 10 20 IECD COC(=O)c1c(CC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)[nH]c(C(C)=O)c1C 753740075 ZLMXFLAJZWGYLT-UHFFFAOYSA-N 431.464 2.351 10 20 IECD CCN1CCN(c2ccc(CN3C(=O)N[C@@H](c4ccc(OC)c(O)c4)C3=O)cc2F)CC1 761277253 HIFLYHWXVISXGE-NRFANRHFSA-N 442.491 2.475 10 20 IECD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761983459 RUZXYELWDMZELC-WBVHZDCISA-N 431.986 2.090 10 20 IECD COC(=O)c1sccc1N1C(=O)C[C@@H](N2CCCN(c3ccc(OC)cc3)CC2)C1=O 762436754 QIFSNLVPHIJXMY-GOSISDBHSA-N 443.525 2.388 10 20 IECD CN(C)c1ccc(CN(C(=O)CCC(=O)N2CCN(c3ncccn3)CC2)C2CC2)cc1 764776227 ZQEWSDROUXNATK-UHFFFAOYSA-N 436.560 2.163 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3COc4cc(OC)ccc4C3)CC2)cc1 768055786 UJESSRHKLVKEQI-LJQANCHMSA-N 440.544 2.129 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)N(Cc2cccs2)[C@H]2CCS(=O)(=O)C2)c1 775371823 UWTGSFYZXHENEL-CABCVRRESA-N 438.571 2.329 10 20 IECD COCC1=CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 776122638 IAGKXQANRLTCIL-UHFFFAOYSA-N 440.523 2.430 10 20 IECD CN(C)C(=O)NCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 777445035 IAANOPLCBIGEMQ-QBFSEMIESA-N 426.589 2.117 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccccc4F)CC3)CC2)cc1 779219270 SQOSTCAITUUXCW-NRFANRHFSA-N 428.552 2.139 10 20 IECD CCCCn1nnnc1COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407650 LWNIPPUNZCGNRB-UHFFFAOYSA-N 437.503 2.398 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)[C@@H]4CCCC[C@@H]43)CC2)cc1 785530038 ZMTGSZQFSSKYLX-VJBMBRPKSA-N 442.604 2.361 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@@H]2CCC[C@H]2[C@@H]1C(N)=O 787333446 ZTCQOWWUDJMSKK-VWEBPMOJSA-N 431.492 2.375 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)C3=Cc4ccccc4OC3)cc2)C1 788885042 HOBFMACEQCTMRW-SFHVURJKSA-N 427.526 2.241 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788912522 URWBIXBZZJZKBT-UYAOXDASSA-N 428.577 2.446 10 20 IECD Cc1c(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)cnn1C 793350726 PGHNOMHTKYTLAJ-CYBMUJFWSA-N 438.575 2.378 10 20 IECD C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793723288 WLDRFIJYAKTTFJ-NQSCKRDGSA-N 449.555 2.009 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCCC1 793725551 QHBRCVJHJLFOCA-CTNGQTDRSA-N 428.577 2.480 10 20 IECD CCn1c(-c2ccc(-n3cnnn3)cc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801829906 OASAWUJIXSKTKU-UHFFFAOYSA-N 445.531 2.414 10 20 IECD CCC[C@]1(C2CC2)NC(=O)N(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 802737813 HDJKQLGHXAONMT-HSZRJFAPSA-N 446.548 2.293 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nn(Cc4ccccc4)c3N)cc2)CC1 803162398 QNDTYVMVWYLHID-UHFFFAOYSA-N 446.555 2.421 10 20 IECD C[C@H](NC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803299388 KBWNAWZBGQJGPQ-INIZCTEOSA-N 448.564 2.120 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCC(=O)N3CCCCCC3)cc2)CC1 804079931 AOINGMDYXBJCEJ-UHFFFAOYSA-N 428.577 2.448 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nccn2CC(F)(F)F)cc1F 804564557 GWJWZYYSXBENQW-UHFFFAOYSA-N 429.418 2.363 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)c3ccccn3)cc2F)CC1 805006975 BNKPDUUEBFGERD-QGZVFWFLSA-N 427.524 2.198 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@](O)(C(F)(F)F)CC3)cc2)C1 806494198 MVYXHQNCYMLRIN-OXJNMPFZSA-N 442.482 2.377 10 20 IECD COc1ccc(O)c(CNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)c1 806810239 ISXYIOXQQTXSDN-UHFFFAOYSA-N 448.328 2.485 10 20 IECD COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NCc1ccccc1O 806880584 VZZJOFFMDXXYIT-UHFFFAOYSA-N 437.246 2.205 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3nncn3-c3ccccc3)CC2)cc1 916196474 IEWMPXWWIWMNHV-UHFFFAOYSA-N 449.559 2.287 10 20 IECD CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCSCC2)cc1 918212892 ACLDQFZCSLPASD-LJQANCHMSA-N 440.635 2.243 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 918303836 LBNUFZDVDRIANQ-UHFFFAOYSA-N 426.517 2.207 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)CN2CCCN(c3ccc(OC)cc3)CC2)ccc1C 918993304 QZFTYFJGESQWGA-UHFFFAOYSA-N 446.573 2.063 10 20 IECD CN(CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1nc2ccccc2s1 919749876 CCFXAGRSWCKRQL-UHFFFAOYSA-N 444.582 2.284 10 20 IECD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 919766837 ZOUAQFMKMGCRQU-UHFFFAOYSA-N 437.949 2.357 10 20 IECD CCN1C(=O)C(=CNC[C@@H](c2cccc(OC)c2)N2CCCC2)C(=O)N(CC)C1=S 920980720 YJFBTDQOKQBGTJ-IBGZPJMESA-N 430.574 2.301 10 20 IECD CC1=CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1802079478 CBBMIVRLNQMQBK-BCHOSZBJSA-N 442.512 2.153 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cnccc1F 1807824741 IGOZNIVKMXOGFD-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C1CC(C(=O)N2CC[C@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1811813586 SLBIYHNYOPSFCV-BFUOFWGJSA-N 443.887 2.445 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817848415 IKTCVWMJAXUILT-CZUORRHYSA-N 439.476 2.288 10 20 IECD O=C(CCCn1ccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822716922 HMHZBEWCYIAYHP-MRXNPFEDSA-N 439.476 2.199 10 20 IECD O=C(Cn1cc(Cl)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426450 WIEZRVSUGSQJLJ-KRWDZBQOSA-N 447.923 2.276 10 20 IECD Cc1cncc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1837498380 JCXBZVFSEAFPGA-UHFFFAOYSA-N 440.500 2.122 10 20 IECD COc1ccc2c(CC(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c[nH]c2c1 1841383041 SPZDAQZIWIAUBQ-UHFFFAOYSA-N 436.468 2.042 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2COc3ccccc3O2)C1 1841898343 AEGLUBKXJSPCPQ-SFHVURJKSA-N 444.871 2.408 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037414 OMQSPSJWLUTIIW-VFADXPBXSA-N 426.469 2.492 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055632 JDRJAWAGKUOPCP-MDWZMJQESA-N 433.555 2.055 10 20 IECD CC[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1)N(CC)CC 1847871426 AMXCUGHSNCKXQA-ACRUOGEOSA-N 439.560 2.102 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)c1 429994897 UTJVXLNZCFLQOT-UHFFFAOYSA-N 446.492 2.369 10 20 IECD Cc1ccc(C(=O)NCCCSc2nccs2)cc1S(=O)(=O)N1CCOCC1 733974081 FKYXANKVDNLPLY-UHFFFAOYSA-N 441.600 2.385 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c1 734015236 BTMNRFTUHFGVAI-CQSZACIVSA-N 449.485 2.026 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CN1CCN(C)CC1 745646748 AFTTVWZGSNPTAV-GBESFXJTSA-N 435.588 2.122 10 20 IECD C[C@@H]1CCCN1CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 746111162 ZLPKWPXPWMOSLM-VGSSETLESA-N 433.555 2.217 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCOc3ncccc3F)CC2)cc1 746796125 NMAWAYUDRQZBKK-UHFFFAOYSA-N 431.512 2.120 10 20 IECD COc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c(Cl)cc1C(=O)O 749142145 JHIGQIZYCRUTLV-UHFFFAOYSA-N 434.879 2.219 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1C 754216081 SRTUUDZZBNREIL-UHFFFAOYSA-N 429.448 2.217 10 20 IECD CC[C@H](C)c1nc([C@@H](C)NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)n[nH]1 754709533 KTJYDCZSEJSRKG-XXFQCFAGSA-N 440.548 2.409 10 20 IECD COc1cc(Cl)cc(CNCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O 761198579 QTYMXUFUFLINOE-UHFFFAOYSA-N 426.922 2.365 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(CC(F)(F)F)nc3C)CC2)cc1 764182366 MFUFZVPUQNSZMA-UHFFFAOYSA-N 440.422 2.268 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 765114817 HQIZYKWYZSFRMM-ZDUSSCGKSA-N 445.950 2.232 10 20 IECD COc1cc(N[C@@H]2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc(OC)c1 769244667 ZXMKMPCVGNRPTG-OAHLLOKOSA-N 449.529 2.498 10 20 IECD Cc1n[nH]c(C)c1C[C@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772087152 JAQPPQDCPXMILM-AWEZNQCLSA-N 432.496 2.040 10 20 IECD COc1cc(O)c(CNCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1OC 777448749 TUEMPLMZZYJMGW-UHFFFAOYSA-N 429.517 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3CCC(C)CC3)CC2)cc1 778221100 IQGFBWXKCKTTSG-CMDGGOBGSA-N 428.577 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)CC2)cc1 778395769 SVQZVIIBEDLAJK-BDTJKRFGSA-N 439.556 2.364 10 20 IECD Cn1cc(-c2nc([C@H]3COCCN3C(=O)NCc3ccc(N4CCCC4)cc3)no2)cn1 780820045 BXVFQCSSIVBAKK-LJQANCHMSA-N 437.504 2.353 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 781536325 QGQGLZXMXGJBOF-UHFFFAOYSA-N 433.411 2.047 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)Cc3ccc(C)cc3)CC2)cc1 785527567 LTQUPKVTYJKCHG-UHFFFAOYSA-N 438.572 2.291 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccccc1Cn1cccn1)c1ccc(N2CCOCC2)cc1 785640185 KOVYAWLFTHOOJQ-IBGZPJMESA-N 447.539 2.262 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1 785872674 YFZKNCJUJAVMOG-KDURUIRLSA-N 432.609 2.495 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 788950905 MESOUTMTNWRFMI-NRFANRHFSA-N 440.519 2.205 10 20 IECD CC(C)C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789847840 WVFGPHCQQSWGMY-HKUYNNGSSA-N 435.540 2.113 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@@H](C)OC4(CCOCC4)C3)cc2F)CC1 790719349 SSQGLJFLCHZXFD-GOSISDBHSA-N 434.556 2.447 10 20 IECD CN(Cc1ccccc1Cl)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793717076 FUOPESRKZKIFPT-GOSISDBHSA-N 442.947 2.317 10 20 IECD CCN(CC)C[C@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793795480 QMQRQGPERDLADW-HOTGVXAUSA-N 426.508 2.220 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC2(CCO2)CC1 800653319 WLFVIPUQNIGBNZ-UHFFFAOYSA-N 447.469 2.496 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OCCN3CCCC3)cc2)cc1F 803663322 NHBOYLOBFVSVGQ-UHFFFAOYSA-N 442.535 2.299 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1F 806545017 GIDOVZCQXUJSJG-UHFFFAOYSA-N 440.472 2.236 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N=c2ccnc3n(C)[nH]cc2-3)cc1 806860877 XVHGBRLWJXYBSD-UHFFFAOYSA-N 432.484 2.168 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O 807135098 KHSTWHJSONNSIX-HXUWFJFHSA-N 439.512 2.057 10 20 IECD CSC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855310 WLXRMGXIGAJFQW-NRFANRHFSA-N 430.618 2.189 10 20 IECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3c(F)cccc3F)CC2)cc1 810318215 SRNQHPYNLSAZKB-UHFFFAOYSA-N 439.484 2.037 10 20 IECD C[C@H](OC(=O)c1cc2n(n1)CCO2)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 811350034 DHJSAILMTRFHPZ-LBPRGKRZSA-N 431.404 2.235 10 20 IECD CCCc1nnc(SCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1N 813488632 ASXBOOAEMZUGJR-HNNXBMFYSA-N 438.985 2.176 10 20 IECD C[C@@H](OC(=O)[C@H]1CCN(C)C(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 912703360 HRAPPYSWINFXTA-KGLIPLIRSA-N 434.448 2.201 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 916229279 YIHXBVUJPRYBKU-FQEVSTJZSA-N 447.557 2.332 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1OC 917758377 TXKMPHRBJGQSEJ-UHFFFAOYSA-N 429.476 2.474 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442266 HKIVWDIBXWMDGD-UHFFFAOYSA-N 442.472 2.067 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(O)cc3O)cc2F)C[C@@H](C)O1 918875845 WYPLUNDISIJEHH-ZIAGYGMSSA-N 432.448 2.324 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 919972776 AZIGZJHWUGJAAI-JOCHJYFZSA-N 441.597 2.450 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)cc1OC 920418931 XHOUUHGAOZXZCZ-QHCPKHFHSA-N 440.500 2.115 10 20 IECD COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)nc1 1817845826 YIHDJGWBVYQEHV-MRXNPFEDSA-N 438.444 2.239 10 20 IECD Cc1cc[nH]c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1825532520 RSPJSCZNRGRGMN-INIZCTEOSA-N 448.614 2.417 10 20 IECD O=C(c1cnn2c1CCC2)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429075 FXNFYESEISRSTB-GOSISDBHSA-N 439.516 2.183 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccc[nH]2)CC1 1829160752 UNSDKHMSEZYLKA-MRXNPFEDSA-N 434.587 2.108 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)ccc2O)CC1 1830761820 RSJHWQZJJPDTPA-SFHVURJKSA-N 441.484 2.451 10 20 IECD Cc1ccc([C@@H](C)C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1846057905 SURZBWPYOACQGZ-OAHLLOKOSA-N 431.583 2.162 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCCc3ccc4c(c3)CC(=O)N4)nc12 729760894 KBPJKKLVUAYXFF-UHFFFAOYSA-N 438.440 2.172 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1 734017460 IVIIIOAMQVXMOE-HUUCEWRRSA-N 434.514 2.129 10 20 IECD CCOC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 743898110 ZTRLVJQJVQXETH-UHFFFAOYSA-N 431.514 2.325 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](N2CCNC2=O)C1 744200962 RSSUWXZXGGLSPW-NVXWUHKLSA-N 446.507 2.279 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 749658764 YSZHMGZMLDFFCU-UHFFFAOYSA-N 431.514 2.288 10 20 IECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1 752151944 POEQRVNNASDNEF-LJQANCHMSA-N 442.472 2.307 10 20 IECD CCN(CCS(C)(=O)=O)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753200855 ACSVNSQBIOYEQR-AWEZNQCLSA-N 428.510 2.156 10 20 IECD CS(=O)(=O)N1CCc2c(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 758295259 GQQIVXQJXYLDFC-UHFFFAOYSA-N 448.520 2.306 10 20 IECD C[C@H]1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCS1(=O)=O 758399884 PLEFUEGWKGSYGJ-OAGGEKHMSA-N 427.542 2.158 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cn1C 760516408 UHASWCUNJNYCBS-UHFFFAOYSA-N 431.518 2.313 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cnn(CC(F)(F)F)c3)cc2)C1 763683930 XFDYNDRLYOQAPC-INIZCTEOSA-N 438.454 2.147 10 20 IECD CC(C)(CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 769036714 HGIMVIWXJDXKRY-KRWDZBQOSA-N 447.580 2.491 10 20 IECD COC(=O)c1cccc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778323656 JHBWYUXPPCLYLW-KHPPLWFESA-N 437.496 2.003 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@@H](CO)c3ccc(Br)cc3)CC2)cc1 782077304 DDIADCVRUAOKPM-FQEVSTJZSA-N 448.361 2.430 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 782261502 NLKDHXLCGJSJJR-UHFFFAOYSA-N 435.477 2.115 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CN(C)C)c(Br)c2)c1 786318659 HASMDQGTQOGYFK-UHFFFAOYSA-N 436.306 2.480 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]1c1ccncc1 789841254 VTASERHRDVKMQT-FQEVSTJZSA-N 426.492 2.162 10 20 IECD C[C@@H](OC(=O)COCc1ccnn1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792505129 YPFYNLSCHWCDSS-CQSZACIVSA-N 447.447 2.283 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCN(CC(F)(F)F)C3)cc2)CC1 803381197 LDDUEQKCRJGIJS-KRWDZBQOSA-N 426.483 2.292 10 20 IECD C[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCOCC1 803448431 RCGZAQRUVNTBDV-CQSZACIVSA-N 425.476 2.304 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC(C)(C)c3ccncc3)cc2F)CC1 805007300 PSVYFXIFMWBYNR-UHFFFAOYSA-N 441.551 2.073 10 20 IECD CCOC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 805023290 RSNZTAIYQVNHFB-UHFFFAOYSA-N 430.549 2.230 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccccn3)cc2F)C[C@@H](C)O1 805691814 LPYBWRLCUYNRBU-CALCHBBNSA-N 445.491 2.211 10 20 IECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 807166110 BQKDJYCJFOEAOS-SJORKVTESA-N 433.549 2.446 10 20 IECD O=C(CN[C@@H](C1CC1)[C@@]1(CO)CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815289054 WHGRSEJDGRJLAT-DQEYMECFSA-N 434.492 2.310 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1 914811128 RXOQMACJOCYEQI-UHFFFAOYSA-N 435.484 2.090 10 20 IECD COCCn1cnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917157639 OMQOFJDVWPIOMS-GASCZTMLSA-N 437.541 2.086 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1)c1ccc(N2CCOCC2)cc1 920923736 TZNDVDIMQAOQQB-INIZCTEOSA-N 438.484 2.296 10 20 IECD CCCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1780836792 PMSJUVGSZSFXAJ-HSZRJFAPSA-N 441.484 2.039 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ccc3F)C[C@@H]21)c1cc(O)nc(O)c1 1787292364 NDCQRHNFAYJACW-KCTSRDHCSA-N 449.866 2.192 10 20 IECD CC(C)O[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934628 MWIOZXPHFHSCQD-DKKFBQAASA-N 426.517 2.231 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccnc(F)c1 1803840101 KPXITWOBBZWHEF-YWZLYKJASA-N 437.431 2.055 10 20 IECD O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813522539 DQGPMQACESZJKD-VGSWGCGISA-N 436.468 2.433 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 303988007 HWLBIBPBNCJLBV-LJQANCHMSA-N 426.492 2.226 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CC(=O)N(C4CCC(C)CC4)C3)nc12 731389755 NYPUDRPADBIXPJ-BBBYJDLNSA-N 444.488 2.082 10 20 IECD NC(=O)[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1)Cc1ccccc1Cl 731757150 UVSVYSSNGLRPJC-GOSISDBHSA-N 430.936 2.320 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc21 734495581 QUNCZPCQQJVWPA-INIZCTEOSA-N 429.542 2.472 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4c(nc3O)CCCCC4)nc12 738754564 JAAPDLBPHNAJFT-UHFFFAOYSA-N 426.429 2.338 10 20 IECD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741083148 LCZGZMYHHNDYOU-UHFFFAOYSA-N 429.565 2.415 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N(C)C)c(F)c3)cn2)C[C@H](C)O1 747097710 XCEKHFZPHRDOIP-GJZGRUSLSA-N 432.500 2.046 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)c1 749269821 QFHVUVQREJUIRW-UHFFFAOYSA-N 440.481 2.341 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(NC(C)=O)c3)CC2)cc1F 754040609 SYCLJIAPXFYNSW-UHFFFAOYSA-N 425.457 2.443 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 766379952 ATUZQXUMKJPEMK-HNNXBMFYSA-N 443.500 2.365 10 20 IECD COc1cc(O)c(CN2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)cc1OC 768437677 CQEKOTJYJKNXBR-UHFFFAOYSA-N 428.457 2.194 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1O 768804250 OSFYNNLKVCGVTM-UHFFFAOYSA-N 436.877 2.221 10 20 IECD CS(=O)(=O)CCOc1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771966156 PNCSEKGGOJHQPM-UHFFFAOYSA-N 438.889 2.438 10 20 IECD CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)nc1 776060996 BRBJAJDEKLOYDE-UHFFFAOYSA-N 447.561 2.317 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CN3CCC[C@H](C)C3)CC2)cc1 778248517 UVLWASADWMDJSJ-RRCSEMEMSA-N 428.577 2.137 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)c2)CC1 782125817 RQCRPIHEGZNAQT-KRWDZBQOSA-N 437.544 2.237 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)cc1 785421205 CFHGLSSJJPKLLI-MOPGFXCFSA-N 430.549 2.369 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cc(F)ccc1N1CCN(C)CC1 785422122 IUCXQLSIZXSAQE-KRWDZBQOSA-N 441.551 2.137 10 20 IECD COc1ccc(C)cc1CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 785525268 UNQZZTYMRTWHLB-SFHVURJKSA-N 425.529 2.376 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)C3=Cc4ccccc4OC3)cc2)C1 788885041 HOBFMACEQCTMRW-GOSISDBHSA-N 427.526 2.241 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)N3CCC[C@@H](C)C3)cc2F)C[C@@H](C)O1 789823696 FCSIPECICMXXOI-MKXGPGLRSA-N 448.583 2.292 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc4c3OCO4)cc2F)C[C@H](C)O1 789825625 NFSQLQZCWQCHCU-GJZGRUSLSA-N 443.475 2.101 10 20 IECD CCOCCN(CC)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789953205 AXHIKGRDGSWRKY-UHFFFAOYSA-N 431.455 2.043 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccsc3)cc2F)CC1 793793369 UCAMTISZZWCGGM-MRXNPFEDSA-N 432.565 2.393 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]4[C@H](CCN4C(=O)OC(C)(C)C)C3)nc12 795104002 QYOYENFDLNNQFZ-PBHICJAKSA-N 445.520 2.443 10 20 IECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797388071 SYNXAGCEGCNXPQ-UHFFFAOYSA-N 427.457 2.043 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3cnc(C(C)C)nc3)CC2)cc1 799742235 YJBWUCVCOIYAEB-MDZDMXLPSA-N 437.544 2.472 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 803297412 UUEDMPXMRJEBNO-KRWDZBQOSA-N 441.528 2.376 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 803448989 KQFGAXHZCFKLPT-RHSMWYFYSA-N 425.476 2.399 10 20 IECD CN(CCCO)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803676574 MSXAPFXQLJHILP-UHFFFAOYSA-N 444.620 2.377 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCOC3(CCOCC3)C2)cc1)C1CCCCC1 803677569 RFPABVSKIRJVAK-UHFFFAOYSA-N 429.561 2.480 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](c3cccnc3)C3CC3)cc2F)CC1 805010124 VAYXEDGTWLINMI-QFIPXVFZSA-N 439.535 2.246 10 20 IECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H](C)C1 806443874 VNNSAKBLHGECHF-CVEARBPZSA-N 444.498 2.139 10 20 IECD Cc1ccc(N2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2=O)cc1 806494669 UEHHKTCPSNKOOC-HXUWFJFHSA-N 449.555 2.255 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2cc(C)nn2C)C1 809871795 MFXSMXOEOQPWHI-IBGZPJMESA-N 427.549 2.348 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 810167422 JAILGRCOXCKNSD-IRXDYDNUSA-N 449.548 2.342 10 20 IECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 813647837 ZHHWLAOZSDJIKD-UHFFFAOYSA-N 448.541 2.277 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(CN4CCCC4=O)cc3)cc2)C1 917833176 NNGHZDVSPKFALD-OAQYLSRUSA-N 434.540 2.441 10 20 IECD CN(C)c1ccc(CN(Cc2nnnn2-c2ccc(S(C)(=O)=O)cc2)C2CC2)cc1 918772086 ZGWPOXYNEJDKNF-UHFFFAOYSA-N 426.546 2.296 10 20 IECD C[C@H](Oc1ccccc1F)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919069457 GSRFBTYVEFGZND-HNNXBMFYSA-N 434.439 2.428 10 20 IECD Cc1nc(CSCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cs1 1328489482 QCORUXWWEXZVFW-UHFFFAOYSA-N 425.601 2.236 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787538866 QUUIORBRDYYNHL-VKRLORBYSA-N 440.544 2.195 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2[C@@H]1O)c1cc(O)nc(O)c1 1793181602 YQFTYKGGDPWEAK-KFFFPCEGSA-N 437.496 2.041 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)N1C[C@H]2C[C@H]2C1 1798325345 WTEAWWOHXODQFH-NSCXZMNLSA-N 433.936 2.343 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1 1804008855 ZXICSFGYEBYQAG-NHYWBVRUSA-N 442.369 2.108 10 20 IECD O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806515395 MURRVCGKQUJNMD-FDDCHVKYSA-N 432.480 2.450 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccccn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994124 RODSMMVMHJZTAG-UZUQRXQVSA-N 447.495 2.235 10 20 IECD Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807994356 UZZISWSAOZIOGA-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CC/C=C(\C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813707759 CUEUBOVXVUJZLJ-JKJSLYJUSA-N 446.598 2.304 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3ccnn3c2)[nH]n1)c1cc(O)nc(O)c1 1817847404 ZQYHCKMIMIWIDG-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1 1836658046 HGTOMUKWOBOVAK-OALUTQOASA-N 429.517 2.151 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cccc3ccoc23)C1 1845680802 YRTGASIAMGKNPV-UHFFFAOYSA-N 429.523 2.110 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccc(F)cc4)n3N)CC2)cc1 23473973 FOHMNXITTBTEFK-UHFFFAOYSA-N 442.520 2.248 10 20 IECD O=C(O)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 210681740 BFWHYLZRWMBDFE-YRNVUSSQSA-N 429.317 2.241 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cc(F)ccc3Cl)cc2)CC1 728586669 DUOCXXDPKRBMSG-UHFFFAOYSA-N 432.926 2.192 10 20 IECD CCN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](C)CS(=O)(=O)CC 733644354 FPCMHNRHXZOHFM-HNNXBMFYSA-N 429.558 2.142 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)c1O 739089208 OVMLSEGDFADSFR-UHFFFAOYSA-N 440.544 2.434 10 20 IECD Cc1cc(CC(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 739696715 PYJRIFAGTAMFHV-MRXNPFEDSA-N 438.981 2.322 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1Cl 740811147 SBNKHFCZDVAWJL-UHFFFAOYSA-N 445.906 2.469 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NCc1ccc(N2CCCCC2)cc1 742058019 YKYARWAHNULYLM-MRXNPFEDSA-N 433.578 2.010 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](N2CCNC2=O)C1 744200478 KRYIVGFPVQMRHW-HZPDHXFCSA-N 446.507 2.279 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1 745465710 YPWKIRYUTYPHIT-UHFFFAOYSA-N 448.936 2.177 10 20 IECD COc1cc(N2CCN(Cn3nc(C(F)(F)F)ccc3=O)CC2)cc(OC)c1OC 758962761 BCZANHWXKXNPSD-UHFFFAOYSA-N 428.411 2.068 10 20 IECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)n1 760211431 HGVKBWBVUYNYOD-UHFFFAOYSA-N 433.516 2.475 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccccc3C[S@@](C)=O)CC2)cc1 762647311 HWARCGNJOOHREG-SSEXGKCCSA-N 429.542 2.297 10 20 IECD CCOc1cccc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1O 768206781 HCVYLCCMJHGEHG-UHFFFAOYSA-N 433.530 2.289 10 20 IECD C[C@@H](NC(=O)N1CCC([C@@H](O)c2nccn2C)CC1)c1ccc(N2CCOCC2)cc1 771971307 RLUITIBSVCECKJ-DYESRHJHSA-N 427.549 2.473 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](c3ccccc3)c3nccn3C)CC2)cc1 785597828 HFXAXXZHBNXSPI-JOCHJYFZSA-N 447.539 2.373 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1ccccc1S(C)(=O)=O 786528140 XMVZZYDTOIJVLH-UHFFFAOYSA-N 425.890 2.193 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)cc2)CC1 786658717 DEMPACKMXNNDTE-SFHVURJKSA-N 426.483 2.246 10 20 IECD Cc1cccc2[nH]cc(CCNC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c12 789814090 XPXJPXJBWFVVMI-UHFFFAOYSA-N 438.503 2.427 10 20 IECD CCc1cc(O)ccc1NS(=O)(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 790415699 ICNKXNLUCLPTHO-UHFFFAOYSA-N 440.543 2.085 10 20 IECD CCOC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2S(=O)(=O)c1cccc2nsnc12 799185305 KQEGRJHLMAGVRY-JTQLQIEISA-N 432.483 2.404 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc1 806720303 ZFVJXJLJCAETSX-OAHLLOKOSA-N 434.443 2.093 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 807671495 PUHWEVPZZGLQPY-HNAYVOBHSA-N 426.492 2.381 10 20 IECD CN1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@@H]1c1ccccc1 808057320 VYQWRVZLMSMGLI-GIWBLDEGSA-N 437.540 2.461 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)c1 815014110 WNMZOLFXWNZCNW-UHFFFAOYSA-N 437.587 2.416 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@]4(CCCN(C)C4)C3)cc2F)C[C@@H](C)O1 815144729 NMALIGMLMJQMFU-IECBHUPTSA-N 432.584 2.473 10 20 IECD C[C@H](OC(=O)[C@H]1CCN(C)C(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 912703355 HRAPPYSWINFXTA-KBPBESRZSA-N 434.448 2.201 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918294038 BRPXZEPXTOXIHG-LJQANCHMSA-N 442.468 2.090 10 20 IECD COc1ccc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442093 CCUPWBMTNNZZMS-UHFFFAOYSA-N 427.501 2.167 10 20 IECD Cc1cc(Cl)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1783713826 ZPRLIJOVHVXISO-KKXDTOCCSA-N 445.903 2.362 10 20 IECD O=C(/C=C/C1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1789900319 RKGISRKYJCJQGJ-YMKQDGHPSA-N 429.517 2.223 10 20 IECD Cc1ccc([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1 1790941779 FKWLRSCTOFQHLN-UHMOLFJZSA-N 439.512 2.198 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc2nncn2c1 1800717963 DMFYRMHKFGYLPS-QDMKHBRRSA-N 441.875 2.360 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994508 HILUWBOMMKPIJM-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)Cc3cnc[nH]3)C2)CC1 1810849750 WZUJYRVQXWFPFG-HWKANZROSA-N 440.500 2.014 10 20 IECD CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813698041 IBNOKKTYIDNQIA-SCBMPYLRSA-N 446.598 2.160 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1coc(Cl)n1 1816175425 WMTGSKHYJLJPSD-LBPRGKRZSA-N 432.824 2.477 10 20 IECD O=C(/C=C/c1ccoc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837107311 AWOGYJKDTVGGFY-OWOJBTEDSA-N 441.484 2.411 10 20 IECD O=Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1843019243 ZDURCDSWRUQAJI-XVNBXDOJSA-N 428.466 2.208 10 20 IECD C[C@H](Cc1ccccn1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846522485 PHVSCGOXDLFWJG-GOSISDBHSA-N 445.523 2.257 10 20 IECD O=C(CCCc1ccc2nc(O)[nH]c2c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 730210637 CDXLVEIBJBGNEW-UHFFFAOYSA-N 442.541 2.142 10 20 IECD O=[N+]([O-])c1cc(CNCCS(=O)(=O)N2CCSCC2)ccc1N1CCCCC1 730578758 NVDGQOPVHBOQQW-UHFFFAOYSA-N 428.580 2.053 10 20 IECD COc1ccc(O)c(CNC(=O)CCCn2cnc3cc(OC)c(OC)cc3c2=O)c1 734016139 BLFRQWPKKLWLRL-UHFFFAOYSA-N 427.457 2.225 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@H](Cc4ccc(F)cc4)C3=O)CC2)cc1 735793617 DXYDOCLSAVRDIV-SFHVURJKSA-N 439.487 2.101 10 20 IECD Cc1cc(C(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)c(C)n1-c1ccccn1 736250325 MRIZFJBRCXFWSO-UHFFFAOYSA-N 446.573 2.192 10 20 IECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 736837510 WWICWBIMHHIMFX-UWJYYQICSA-N 432.565 2.474 10 20 IECD COc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1S(=O)(=O)NC1CC1 746879982 PGZJQBALFBJUNI-UHFFFAOYSA-N 429.542 2.448 10 20 IECD O=C(CN1C2CCC1CC2)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 748814896 IAHJCQHOSKPEPK-VCHYOVAHSA-N 445.566 2.360 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 749502598 ZFZKTGSOUANATK-KRWDZBQOSA-N 432.542 2.434 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 749848267 OXRVLYWASQRSTL-UHFFFAOYSA-N 445.541 2.009 10 20 IECD CCC[C@](C)(CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 754911191 MPFCZGNNCIDSQP-JOCHJYFZSA-N 430.528 2.293 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(CC)nc2[N+](=O)[O-])cc1 756935713 IITBOUNCULZBPS-UHFFFAOYSA-N 431.496 2.154 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3Cc4cccc(O)c4C3)CC2)cc(OC)c1OC 759486538 JRLCNABPPHDFNI-INIZCTEOSA-N 427.501 2.417 10 20 IECD C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 760213375 ODAMYRMSRURJRY-MRXNPFEDSA-N 425.533 2.318 10 20 IECD COc1cccc(OCCN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c1 766159824 CMNCBCIANDMHOM-UHFFFAOYSA-N 440.588 2.416 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 767797632 WXIUIQWIBHDSBU-INIZCTEOSA-N 437.949 2.396 10 20 IECD O=C(CCCS(=O)(=O)N1CCCC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771053142 LSWPHOUTMYDDMV-GOSISDBHSA-N 443.997 2.332 10 20 IECD CN(CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CCSC1 772049492 OVXNVGWJIZDLEO-AWEZNQCLSA-N 438.505 2.381 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2 773739867 GCVLYSVIOLGDBD-CQSZACIVSA-N 435.498 2.170 10 20 IECD O=C1N[C@@H](CC(F)F)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777615609 CXYVEEGQYLMRHC-HNNXBMFYSA-N 434.422 2.018 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 777899740 NVYJKMWDSQRKCY-MRXNPFEDSA-N 446.529 2.045 10 20 IECD CN(CC(C)(CO)CO)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 780994605 UHZVYGFKYPIARQ-ZROIWOOFSA-N 428.601 2.179 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(OC)c1 782105457 SHUUODSUMUQROI-KRWDZBQOSA-N 442.468 2.334 10 20 IECD O=C(NCc1ccc(CN2CCOCC2)cc1)C(=O)NCc1ccc(N2CCCC2)cc1 785478434 CXEBJIILRKHXJR-UHFFFAOYSA-N 436.556 2.052 10 20 IECD NS(=O)(=O)C1CCN(Cc2cc(Br)cc(Br)c2O)CC1 785985604 OQUNYJDYXHNEQB-UHFFFAOYSA-N 428.146 2.170 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCc4occc43)CC2)cc(OC)c1OC 788614760 WNHQTBNPLVGXAR-KRWDZBQOSA-N 443.500 2.148 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 788910435 KSSAQVRERLUJTL-UHFFFAOYSA-N 437.500 2.160 10 20 IECD COc1ccc(N2CCN(Cn3nc(-c4ccccc4[N+](=O)[O-])oc3=O)CC2)cc1F 794633262 VCDHMSCVVVBNBZ-UHFFFAOYSA-N 429.408 2.339 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c(O)c1 797390483 HEKRMCOFURUUQJ-HOTGVXAUSA-N 427.501 2.265 10 20 IECD C[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)NCCF 800183750 HPYUEDVUQQBJQQ-CDDSVFCYSA-N 429.564 2.320 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)N3CCc4ccccc43)CC2)cc1 803910775 LKBAHQGOVMGJII-IBGZPJMESA-N 436.556 2.301 10 20 IECD CN(CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)OC(C)(C)C 804183127 LGBYHUPJEUNPDB-UHFFFAOYSA-N 431.489 2.497 10 20 IECD COc1ccc(N2CCCN(c3nnc(-c4cnn(C)c4)n3C[C@H]3CCOC3)CC2)cc1 812385547 XWMRUFMLEIKTCI-GOSISDBHSA-N 437.548 2.440 10 20 IECD Cn1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C2CC2)n1 812985394 BHIHJGXRCKPSEV-INIZCTEOSA-N 431.924 2.376 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N(CCN(C)C)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 841773609 MGUHJYSUXSRTTN-LJQANCHMSA-N 433.574 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nc(-c4cccs4)no3)CC2)cc1 914530346 JCGOUYAFIWCOAD-SSEXGKCCSA-N 446.554 2.404 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(NC(C)=O)ccc2OC)cc1 917753498 MQXMOYARGYHQKZ-UHFFFAOYSA-N 427.504 2.216 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN(C(=O)c2ccco2)CC1 918199698 OOCCMTLUWOUTIH-UHFFFAOYSA-N 430.480 2.359 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(F)c(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 918632677 BEFRJXPJKBLMGT-CHWSQXEVSA-N 439.484 2.156 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1S(=O)(=O)C(C)C 1320143149 SZDAUCHDOKXFJS-INIZCTEOSA-N 435.498 2.184 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1 1320485949 IGTRSQAOYQIYCB-MAUKXSAKSA-N 441.402 2.311 10 20 IECD O=C(Cc1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795827591 VGEPVUQILHDZDO-IVWMJMPLSA-N 436.917 2.259 10 20 IECD CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c2ccccc21 1796600575 PHIRLFIFRCJVIN-MUJYYYPQSA-N 435.484 2.428 10 20 IECD O=C(CCc1cccnc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807644205 DRTSWMQCHZMXQV-MBSDFSHPSA-N 447.495 2.235 10 20 IECD CN(C)c1ccncc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1807761736 SGTZKFQLDWQRIV-UHFFFAOYSA-N 439.516 2.112 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)CC1 1807779785 KJRIWIRTKHTCHU-UHFFFAOYSA-N 443.479 2.391 10 20 IECD CCc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807883379 LRYYYYDAWUCHRG-VGOFRKELSA-N 447.495 2.479 10 20 IECD Cn1ccc(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)n1 1808440606 CMGLMBBBIVSXHU-GQCTYLIASA-N 440.500 2.095 10 20 IECD Cn1cc(F)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845281 IWBNVSZHGYKELB-CQSZACIVSA-N 428.424 2.313 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1F 1841579316 JCBMLDMSVCHUSB-UHFFFAOYSA-N 449.573 2.130 10 20 IECD O=C(c1ccc(O)c(F)c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442182 CAJRTJADFWQCHN-UHFFFAOYSA-N 436.443 2.141 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(S(=O)(=O)N(C)OC)cc3)CC2)cc1 108433737 KBUXFUPQMXDGHM-UHFFFAOYSA-N 433.530 2.230 10 20 IECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 726712717 ALXLTNOOPAWTMT-MSOLQXFVSA-N 432.565 2.237 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)c1 728983365 YQSOVEPWEZKUME-QGZVFWFLSA-N 447.557 2.038 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc21 743900378 IKGYNRXHHUTCSX-UHFFFAOYSA-N 433.512 2.025 10 20 IECD COc1ccc(N2CCN(CCNc3ccc(C(=O)Nc4nncs4)cn3)CC2)cc1 746389451 YQIZSLXJCDNEHC-UHFFFAOYSA-N 439.545 2.428 10 20 IECD C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 747301918 OBRKXVWINIYGAB-FXAWDEMLSA-N 438.528 2.319 10 20 IECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c([N+](=O)[O-])n1 754791545 ITLFECYSINYTNG-CHWSQXEVSA-N 441.485 2.042 10 20 IECD COc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1F 757852173 XMCYCVNULKWFKY-UHFFFAOYSA-N 434.493 2.380 10 20 IECD COc1cc(N2CCN(CN3C[C@@](C)(c4ccccn4)CC3=O)CC2)cc(OC)c1OC 758965490 QLWQJGNBIYMLEB-DEOSSOPVSA-N 440.544 2.377 10 20 IECD COc1cc(NS(=O)(=O)c2cccc3nonc23)c(C(=O)N2CCCC2)cc1OC 765049466 QOCJMSQPWLNJPQ-UHFFFAOYSA-N 432.458 2.277 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccccc1Cn1cncn1 765904231 QBDAWRRWKMZZAA-UHFFFAOYSA-N 430.262 2.049 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(Br)nc1)c1ccc(N2CCOCC2)cc1 766382658 PAGWQVVJCIYSGY-CYBMUJFWSA-N 433.306 2.497 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)cc2F)C[C@@H](C)O1 770513454 ZBVVXIOLYYSBBR-IYOUNJFTSA-N 429.558 2.019 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(C(=O)N(C)C)cc4)n3)CC2)cc1 771054512 BITYGRAFBJZUSZ-UHFFFAOYSA-N 449.511 2.338 10 20 IECD COC(=O)N1CC(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 771755588 JYGDCEIYTDSVDJ-JYRVWZFOSA-N 425.557 2.296 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)[C@H]3CCCC[C@@H]3C(=O)OC)cc2F)CC1 772648421 CWNKCBJDIMZCRC-PXNSSMCTSA-N 441.569 2.119 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1)c1ccc(N(C)C)cc1 773854019 AIZQNGPZVMSZAE-CQSZACIVSA-N 443.935 2.158 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4ccnn4)cc3)CC2)cc1 778255794 ZPVKYYOIBUOBFZ-KHPPLWFESA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCO[C@@]4(CCSC4)C3)CC2)cc1 778391267 VEJACWWUYNFDAX-KUSROVSMSA-N 445.585 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)CC2)cc1 778395774 SVQZVIIBEDLAJK-XVDSKVFUSA-N 439.556 2.364 10 20 IECD CSCC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nnc2ccccn12 785605042 IBZTVCMNGBBHAK-GOSISDBHSA-N 440.573 2.331 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nc(Br)ccc3C)nc12 786388174 SXKCYPRWXIKAFN-UHFFFAOYSA-N 435.234 2.435 10 20 IECD COc1cc(F)c([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 788323260 KZZGXVDLCVCJFY-HNNXBMFYSA-N 445.491 2.173 10 20 IECD COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)c1 791526817 NBTIKLJLRQPFFT-QFIPXVFZSA-N 443.475 2.489 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(Cl)cc(C(=O)N(C)C)c2OC)c1 792983243 HUWCSOXRQRMKPO-UHFFFAOYSA-N 435.864 2.020 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](c4ccccc4)S3(=O)=O)CC2)cc1 793856968 OBFMFYCECJAFHN-OAQYLSRUSA-N 429.542 2.121 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 796075434 NUDHIBSMBLSSKO-RUYXUALKSA-N 431.533 2.367 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCS(=O)(=O)CC3)cc2Cl)C1 800720595 UZAWVEFHQJPAHJ-OAHLLOKOSA-N 443.997 2.315 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCN(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803298018 MQGCZIYCSADXSP-FQEVSTJZSA-N 436.556 2.439 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccc(F)c3)cc2F)CC1 805007410 LDJXOUPPUSHBEU-UHFFFAOYSA-N 430.499 2.382 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCOC4(CCCC4)C3)cc2F)CC1 805007659 WCNUWIRSKDZIQO-LJQANCHMSA-N 446.567 2.192 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 807458658 GRERVOVOUCERBD-HXUWFJFHSA-N 429.565 2.345 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1 808537182 JQXXQCPYDSRTPC-UHFFFAOYSA-N 441.560 2.033 10 20 IECD CC(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 808852670 WXYVNSGWBYTEFW-UHFFFAOYSA-N 442.604 2.251 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1Cl 918439923 YDEPXRZELKSBGE-UHFFFAOYSA-N 432.933 2.247 10 20 IECD CCCCN(C(=O)CN1CCN(c2ccc(OCC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 1336436237 YCJYQNREZAZROO-FQEVSTJZSA-N 437.606 2.023 10 20 IECD CCc1noc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782006995 FIGRIVOSSCIZIQ-OAQYLSRUSA-N 449.891 2.367 10 20 IECD Cc1ccoc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792218947 FFTRFOKQUJRYNZ-HTERZNMPSA-N 442.468 2.012 10 20 IECD CCc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1Cl 1796599233 HWKIILXSPGMICX-CLLJXQQHSA-N 433.896 2.008 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291663 SNLKDJHNWIWRFN-GMVHGZKUSA-N 440.500 2.221 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805650879 HJNNHSINGDVFQI-WSSFADSRSA-N 432.517 2.065 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990384 HBWWZEFFFKUEBX-BTYIYWSLSA-N 434.452 2.227 10 20 IECD Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1807991570 QCLWAXPLBZOBOW-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cn[nH]c1 1818232678 ZSXNEXKYOMXSLQ-GOSISDBHSA-N 446.471 2.232 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc2[nH]ncc2c1 1818997436 ZAXPMFFUYXXSSD-OAHLLOKOSA-N 448.443 2.107 10 20 IECD CC(C)N1CCC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823020407 JYEVMCRWVORDIA-SJORKVTESA-N 442.520 2.395 10 20 IECD CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCS(=O)(=O)C1 29959137 UMMNNRHHTYEDNG-HLVNSREUSA-N 444.625 2.375 10 20 IECD Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)N1CCOc2cc(N(C)C)ccc21 475940822 RQITYFUIXOOLLT-UHFFFAOYSA-N 426.517 2.095 10 20 IECD COc1ccc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2n1 727612535 LYSBKPRFCIIJON-UHFFFAOYSA-N 438.459 2.474 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(C(=O)NC)cc3)cc2F)CC1 730115006 NYEUSAHHDBDDPE-UHFFFAOYSA-N 427.524 2.327 10 20 IECD CCc1cc(N2CCC[C@H](NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)ncn1 732914841 SPUOREJJNMPKMQ-IBGZPJMESA-N 442.539 2.483 10 20 IECD CNC(=O)c1ccc(OC)c(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743294672 SZDJLFNTOKRDOU-UHFFFAOYSA-N 441.532 2.007 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3sccc3C(=O)OC)cc2F)CC1 743905637 BEAZAVAUJCNABF-UHFFFAOYSA-N 448.520 2.071 10 20 IECD CC[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC1 753010253 SIPZOCJWKSIRQL-QAPCUYQASA-N 440.491 2.193 10 20 IECD COc1ccc(N2CCN(C(=O)NCCNC(=O)Cc3cccc(F)c3)CC2)cc1F 753927639 CLDHFYGHENXTDG-UHFFFAOYSA-N 432.471 2.164 10 20 IECD COc1ccc(C(=O)NCCNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753930815 RAWFBYIHAVOIHI-UHFFFAOYSA-N 430.480 2.105 10 20 IECD CCC(=O)Nc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754213332 RBDQSMZKEKWZTI-UHFFFAOYSA-N 428.464 2.470 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)[C@]12CCCO2 759323078 RUOLGIRPHVJDSK-MQSCRBSSSA-N 434.556 2.493 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(-c4nc(=O)o[nH]4)cc3)CC2)cc(OC)c1OC 760454677 NMGLEESMNNVZBM-UHFFFAOYSA-N 440.456 2.018 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C(=O)OC)cs3)cc2F)CC1 770260796 OLIQVFVFHYBICM-UHFFFAOYSA-N 448.520 2.071 10 20 IECD COC(=O)[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccnc1 771897944 LGFJFBMSPIQZNR-NRFANRHFSA-N 436.491 2.341 10 20 IECD COc1ccc([C@H](CNCc2ccc([N+](=O)[O-])c(OC)c2O)N2CCOCC2)cc1OC 774943602 VVGCMXFHCJUNQB-SFHVURJKSA-N 447.488 2.489 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)c1 775371825 UWTGSFYZXHENEL-HUUCEWRRSA-N 438.571 2.329 10 20 IECD CC(C)CN1CC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777617076 YUYHUZGMZHYQLX-UHFFFAOYSA-N 426.496 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)C(=O)Nc3ccccc3)CC2)cc1 778273828 ZCNOCEXBJOLXIR-MENFKHAKSA-N 436.512 2.043 10 20 IECD Cc1ccc(C(=O)NCCCCCC(=O)N2CCN(C(=O)CC(C)C)CC2)c(O)c1O 780927125 MURBSHRHWNXZLH-UHFFFAOYSA-N 433.549 2.413 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCc3cc(OC)c(OC)cc3C2)cc1 784564170 GTJFZRKJJVBRAU-UHFFFAOYSA-N 428.485 2.277 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 787000794 QRKIWOBAYTWBKG-UHFFFAOYSA-N 432.456 2.314 10 20 IECD C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949517 JJEMOXBTQMYOIN-GJZGRUSLSA-N 443.466 2.090 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(c4cccc(OC)c4)=NO3)CC2)cc1 792096970 NBHLTVRLELICMO-HSZRJFAPSA-N 438.528 2.135 10 20 IECD COc1ccc(CNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c(O)c1 794378539 XYACBGZJHLDSOY-SNVBAGLBSA-N 433.258 2.464 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCc2cccc(C(N)=O)c2)cc1 804270093 KIUHXELZUIAOSR-UHFFFAOYSA-N 448.523 2.332 10 20 IECD CCCNC(=O)OC[C@H]1CCCCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 805775436 FMBQRTSMSRKQAN-HXUWFJFHSA-N 432.565 2.335 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)C(F)(F)F)cc2F)CC1 806810593 XCSHMTKSHABGKB-KRWDZBQOSA-N 430.446 2.137 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C2CC2)cc1 808346365 SHBGNUYYGGKSFO-PKTZIBPZSA-N 442.604 2.128 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 808568617 NMIGAEGVRDVPNO-QGZVFWFLSA-N 431.439 2.331 10 20 IECD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 913305480 SXUJONLDGASQFC-GFCCVEGCSA-N 448.391 2.137 10 20 IECD O=C(CN1CCN(c2ccc(F)cc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 916978680 QKOGGHQWXJHUCP-UHFFFAOYSA-N 430.499 2.240 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1CCN(Cc2ccccc2)CC1 919973468 WHSIFTIGYBBQIT-UHFFFAOYSA-N 441.597 2.450 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCOC3)c2C)c1 921216865 YXVOQMXBVGDUAU-HNNXBMFYSA-N 443.452 2.430 10 20 IECD CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1319815734 MIMVZZIOZVZYMU-UHFFFAOYSA-N 447.643 2.494 10 20 IECD CC[C@H](C)[C@@H](N)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314046 YKZWYFFVCVYKMG-SCLBCKFNSA-N 448.614 2.354 10 20 IECD CC(C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794006744 OZWPNPMEPLQWCZ-VBUUOAMHSA-N 426.517 2.233 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)n(C)n1 1796934463 HGUATHJYDXJNGY-GGPHIMKMSA-N 448.527 2.027 10 20 IECD CC(C)O[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798541915 DOPMIRQDZLATID-ZAWLATJESA-N 426.517 2.231 10 20 IECD Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994355 UZZISWSAOZIOGA-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(=O)C2CC2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811797285 RFRHRKPNAKQUFC-KDOFPFPSSA-N 443.887 2.445 10 20 IECD O=C(Cn1cccn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815719404 NWIGSPLPYKMEKW-NSHDSACASA-N 447.904 2.330 10 20 IECD N[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccnc1 1842978047 YAKSTANQQVODQZ-INIZCTEOSA-N 430.892 2.053 10 20 IECD C[C@H](CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1846045524 QEQLUAWLDVIOBD-OAHLLOKOSA-N 431.583 2.244 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCC(=O)NC2)cc1 1847321171 KOTMBHHYWPZWIQ-HJNYFJLDSA-N 434.540 2.436 10 20 IECD CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)N1CCOc2cc(N(C)C)ccc21 475956308 PWEMZGTUSNWENY-MRXNPFEDSA-N 432.546 2.471 10 20 IECD COc1ccc(N2CCC(NC(=O)NCC(=O)N(C)CCc3ccccn3)CC2)cc1 727480336 NHVXCCZGAGCBOB-UHFFFAOYSA-N 425.533 2.059 10 20 IECD COc1cc2ncn(CCCC(=O)NCc3cccc(OC)c3O)c(=O)c2cc1OC 727763023 YAZXEJZGWKEQNX-UHFFFAOYSA-N 427.457 2.225 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1 731764073 OLWZRKDYYXQVJP-UHFFFAOYSA-N 448.520 2.029 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(CC(=O)N(C)C)nn2)cc1 732115156 UMBMMWKRFVXBQG-UHFFFAOYSA-N 436.516 2.288 10 20 IECD CC[C@@H](C)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)NCCN1CCOCC1 732155937 GMRPNJUNSJXOII-VGOFRKELSA-N 441.576 2.082 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)cc1 737079545 PTBITJZPSMLWMU-UHFFFAOYSA-N 449.555 2.294 10 20 IECD COC[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 740128823 WEOGIRJOGCBHMP-ZDUSSCGKSA-N 435.458 2.210 10 20 IECD Cc1cc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n2)c(C)o1 740758371 FFIWTJKVSPNECL-UHFFFAOYSA-N 433.471 2.168 10 20 IECD C[C@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 742242849 OZZCUQPULSHRDQ-RMLALMNNSA-N 425.529 2.186 10 20 IECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744402389 HIXMVHBPWVHGSX-KBPBESRZSA-N 428.510 2.154 10 20 IECD COC(=O)NC(C)(C)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 744962151 WVBZECGVTVPSTF-GFCCVEGCSA-N 438.436 2.467 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)cc1 747571719 SKUHXWHKBVPHAK-UHFFFAOYSA-N 428.537 2.252 10 20 IECD CCOC(=O)c1c(NC(=O)CN2CCO[C@@H](C(N)=O)C2)sc(C)c1-c1ccccc1 747837718 GYOIJZPMAPTYEW-OAHLLOKOSA-N 431.514 2.025 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C(=O)[C@H]2C1 761091374 NZJOUPNZTRLXLN-QRCPMIHRSA-N 433.480 2.155 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)CC2)cc1 765715816 LGRYSWBIGBDAAY-QFIPXVFZSA-N 443.592 2.050 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c(C)n1-c1ccccc1Br 778855041 HATJFABZBSDMRR-MRXNPFEDSA-N 431.290 2.233 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)cc1 779500259 OBOLXIJCJGTZAP-UWJYYQICSA-N 433.574 2.185 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2F)C[C@@H](C)O1 785439021 KBTUPLFNYVHZOF-IAGOWNOFSA-N 442.535 2.438 10 20 IECD CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 788564910 YVQVEHXWTGXECL-MOPGFXCFSA-N 447.580 2.388 10 20 IECD COc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788940639 YCUZPRUKDURISX-UHFFFAOYSA-N 436.556 2.256 10 20 IECD CCOC1CC(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789823522 DVJGEBDAMDUYHO-XNYRCJLNSA-N 435.540 2.377 10 20 IECD COc1ccccc1-n1nccc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 797466118 OGJIJTQPHMVKFD-UHFFFAOYSA-N 426.542 2.406 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCC2(CCO2)CC1 799888480 HMJXTTTXYKCIDY-UHFFFAOYSA-N 440.523 2.407 10 20 IECD CC1(C)CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCN1CCO 806442761 IUXBLRJUMNEKJO-UHFFFAOYSA-N 444.498 2.140 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC3CCC4(CC3)CC4)CC2)cc(OC)c1OC 807552130 OLWNJAIJQCZVDJ-UHFFFAOYSA-N 431.533 2.200 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3COc4ccccc4[C@H]3O)CC2)cc1 811995765 WUQGSMQSQAJARV-JTHBVZDNSA-N 440.544 2.001 10 20 IECD COc1ccc(C(=O)NCCNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918080840 SRWSFIJHDNNAIK-UHFFFAOYSA-N 426.517 2.356 10 20 IECD COc1ccc2c(=O)c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c[nH]c2c1 918372100 LCJDPAZSDXXCPU-MRXNPFEDSA-N 434.496 2.168 10 20 IECD Cc1noc(CCCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 919115761 RTBVKSTTXQWOJX-GASCZTMLSA-N 448.495 2.313 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 920495870 KJAYDOMNKDPRMJ-LJQANCHMSA-N 446.525 2.081 10 20 IECD C[C@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(N2CCOCC2)cc1 920872510 SXILZSNLQXKPAQ-KRWDZBQOSA-N 440.504 2.419 10 20 IECD Cc1nc[nH]c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781122849 VGCAWFKFKVTUGX-IIBYNOLFSA-N 448.907 2.224 10 20 IECD Cn1cnc(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)c1 1787525738 PTRPVXNNBJNNCB-UHFFFAOYSA-N 443.554 2.028 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469884 RAQKHBKXNJLOGK-ITBLURSFSA-N 449.486 2.238 10 20 IECD CC(C)CCC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812603840 GTHNYRNAYSSOBN-UZLBHIALSA-N 448.614 2.384 10 20 IECD CCOc1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 729785344 YJOYCMAEWDLDAG-UHFFFAOYSA-N 445.491 2.449 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3OCCC(N)=O)cc2)CC1 731131540 MOAFRAAMYLWZNS-UHFFFAOYSA-N 438.528 2.432 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)COC(=O)c2cc(O)cs2)c1 732353930 LZLZCQOFTZGYOU-UHFFFAOYSA-N 442.515 2.288 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCCCCn2nnc(-c3ccccc3)n2)c1 733464730 SNFOZQDRBKNDMM-UHFFFAOYSA-N 445.501 2.445 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 747570755 KHVMCGCYWCZBIT-QZTJIDSGSA-N 438.532 2.217 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)c1 750996946 BFBQZJPAKWVBPZ-UHFFFAOYSA-N 432.498 2.339 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 751015136 ZLACOJPFHYHHHL-UHFFFAOYSA-N 426.441 2.067 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(c4nc[nH]n4)CC3)cc2F)C[C@@H](C)O1 751500325 ZGGIFKIOLKMARK-IYBDPMFKSA-N 430.528 2.053 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NCCCSc2nccs2)CC1 753591003 ZVXDAVXLZASUFU-UHFFFAOYSA-N 449.668 2.319 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1F 754039916 GCMTUPWQKDIVKM-UHFFFAOYSA-N 425.438 2.262 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 755175329 LQECDZNNWPIXMR-UHFFFAOYSA-N 432.468 2.176 10 20 IECD O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 758031749 FGGJCESRHQBNGI-WAYWQWQTSA-N 437.475 2.474 10 20 IECD Cn1ccnc1[C@](O)(CCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)C(F)(F)F 761005955 RHPPTIQNEFBOFG-QGZVFWFLSA-N 446.813 2.384 10 20 IECD O=C(COC(=O)c1cc2n(n1)CCCO2)Nc1cccc2c1C(=O)c1ccccc1C2=O 763360361 WSCVNEMDNAQFPM-UHFFFAOYSA-N 431.404 2.237 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1 768013813 WUNMWDAKULWTQH-UHFFFAOYSA-N 449.598 2.423 10 20 IECD COC(=O)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 769947840 XMELIBONEJUZJC-HNNXBMFYSA-N 426.878 2.451 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(I)cn2)c1 773230952 ROVPFVGLDHSVNK-VIFPVBQESA-N 441.225 2.216 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(CC(=O)O)c2)cc1 774614335 AOQRWCMPIXBYLU-UHFFFAOYSA-N 442.515 2.275 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCOC[C@@H]2c2noc(-c3ccccc3)n2)c1 779698889 DNPBUAYNCJNGBT-MRXNPFEDSA-N 444.469 2.027 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccccc3Cn3cncn3)CC2)cc1 781396504 MRADJMMSRMSKEP-UHFFFAOYSA-N 427.530 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(NC(C)=O)c3C)CC2)cc1 785751588 ANZQXSJLRXGQBP-UHFFFAOYSA-N 425.485 2.468 10 20 IECD CCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812606 NKKOUQSOVISOSA-UHFFFAOYSA-N 429.492 2.302 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Oc1cccc(F)c1 789835761 QPGMKGJHCDESSM-HNNXBMFYSA-N 447.482 2.126 10 20 IECD C[C@@H]1OCC[C@@]1(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 790261390 WVCWOZXBLMSBQJ-DPRSLYIMSA-N 426.585 2.386 10 20 IECD CC(C)(C)OC(=O)N1CCN(CCC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 792081592 KXHYZEKDKRAWTH-UHFFFAOYSA-N 432.565 2.082 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)N3CCCN(c4ccc(OC)cc4)CC3)ccc2[nH]1 792329538 BBUFQQJQKRGICP-UHFFFAOYSA-N 449.511 2.214 10 20 IECD C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734974 WHQKUWNOONENOP-JMUQELJHSA-N 448.567 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)CN3[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)CC2)cc1 795126059 YHMUFCBPVBQCED-RTBURBONSA-N 430.593 2.311 10 20 IECD CN(C)CCNS(=O)(=O)c1cccc(NCc2ccc(N3CCOCC3)c(F)c2)c1 796434672 OGMPTKRDAGCMMV-UHFFFAOYSA-N 436.553 2.114 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(C)(C)C(=O)N3CCCC3)cc2F)C[C@@H](C)O1 796591207 BVIICIJKSKVBRU-IAGOWNOFSA-N 434.556 2.046 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](CO)CC3CCCC3)CC2)cc1 799052819 LAZFILLHBWPYPN-CTDFXDFQSA-N 429.561 2.205 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688803 BMXMZPDMAVFGHG-APWZRJJASA-N 430.549 2.058 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc1F 804853431 XSEGJMHRAJOKNS-FPOVZHCZSA-N 434.556 2.048 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCO)Cc3ccccn3)cc2F)C[C@@H](C)O1 805755236 QUZLVEXKDYOIEL-KDURUIRLSA-N 444.551 2.335 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCCC[C@@H]1N1CCOCC1 806090255 IJSNJBOSZMGJRA-GOTSBHOMSA-N 442.604 2.395 10 20 IECD CC(C)(C)OC(=O)N1CCCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806279060 CUVUMHFJGONARK-UHFFFAOYSA-N 428.580 2.211 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCC2(CC1)NC(=O)NC2=O 807546354 UHQIYVYAEHRDFV-UHFFFAOYSA-N 439.310 2.207 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCc2ncsc2C1 807768428 JJRIFBFYGNWIOR-ZDUSSCGKSA-N 436.484 2.414 10 20 IECD CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 808108107 RVCNPJQIBZLUGZ-UHFFFAOYSA-N 430.483 2.288 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCc3nncn3C2)NC(=O)OC(C)(C)C)cc1 815710897 YNHCPILQTGAOQI-WMZOPIPTSA-N 428.537 2.289 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(O)c4)CC3)cc2)C1 918118221 PIASOVYXGRWDFI-IBGZPJMESA-N 437.544 2.126 10 20 IECD COc1cccc(CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 919029677 QBBYPAMORMBNKI-UHFFFAOYSA-N 430.476 2.463 10 20 IECD C[C@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 920920587 NWVWYHXEKRZPSV-LPHOPBHVSA-N 443.500 2.052 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920925612 KLYMRISTRVYLSG-QGZVFWFLSA-N 438.528 2.397 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCc3ccc(S(=O)(=O)NC)cc3)CC2)cc1 1116345630 COEHSIIGVTZQGT-UHFFFAOYSA-N 431.558 2.275 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCC(=O)N4)c2)CC1 1318651585 RVOUFNWIJUQGKV-UHFFFAOYSA-N 428.514 2.074 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2 1782007469 RZSBACNARSGDDF-JOCHJYFZSA-N 445.903 2.325 10 20 IECD Cc1ccc([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1 1790941778 FKWLRSCTOFQHLN-LQJIQPLVSA-N 439.512 2.198 10 20 IECD Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cccc1=O 1800715571 GCXBNYISKHHUGJ-BTTYYORXSA-N 431.876 2.016 10 20 IECD CN1CCC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1804283244 OBUONCNPNWGDIP-AHAITQMDSA-N 443.544 2.187 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccn2ccnc2c1 1804286370 SAFMTQUSJHYPIY-YBXVHQAYSA-N 448.479 2.416 10 20 IECD CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)nc1 1810543038 NDFVMGZWUYGCPV-UHFFFAOYSA-N 439.516 2.112 10 20 IECD O=C(CCc1cnccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428779 IQNJGDFPIVXGPA-IBGZPJMESA-N 439.516 2.149 10 20 IECD Cc1c[nH]cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902536 QAAFRBDOIDDBAT-KRWDZBQOSA-N 448.614 2.417 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccccc1F 1836217882 ABIUQGLJJVLLFU-UHFFFAOYSA-N 442.491 2.131 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3cnc4ccccc4c3O)CC2)cc1 108576325 TVBMMJJOXLYFHA-UHFFFAOYSA-N 434.496 2.418 10 20 IECD CCc1cc2c(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc(=O)oc2cc1O 728335072 URBDIWDEPMPCPQ-UHFFFAOYSA-N 433.438 2.495 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1 728979114 YFJLQBZRZAIUCC-DOMZBBRYSA-N 436.534 2.019 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 737246565 YTEZPILXZRUIMT-UHFFFAOYSA-N 435.933 2.138 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 742805069 FXTMALQCLHPEIV-CVEARBPZSA-N 445.532 2.435 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4ccccc4C)CC3)CC2)cc1 753996954 ZFSOZFLWGKFGGK-RUZDIDTESA-N 438.616 2.304 10 20 IECD C[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCS1(=O)=O 758381974 NQJCLWDVVVDAFJ-CQSZACIVSA-N 449.495 2.261 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(C)nc4cc(C)nn34)CC2)cc(OC)c1OC 759198810 HTKOCZNVJWFUAX-UHFFFAOYSA-N 425.489 2.334 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccccc1O[C@H]1CCOC1 760091637 PUFDYCHDXRTREZ-KRWDZBQOSA-N 443.475 2.085 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](NC(=O)NC2CC2)C1 760897219 OSHAETLRCRESNP-PBHICJAKSA-N 446.507 2.325 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cnc4c(Cl)c(C)nn4c3)CC2)cc1F 766826619 DHLOSRFUHSFPGT-UHFFFAOYSA-N 439.900 2.350 10 20 IECD CCc1ccc(O[C@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc1 768446459 KJDYAHQRWYAQJU-OPAMFIHVSA-N 426.513 2.492 10 20 IECD O=C(Nc1ccc(-n2nccn2)nc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769704644 DQHMBLFQNVNDAB-UHFFFAOYSA-N 442.482 2.483 10 20 IECD CCOC(=O)N1CCC(NC(=O)CCCNCc2ccc(N3CCN(C)CC3)cc2)CC1 771847861 PWHWOHMWBRJDRF-UHFFFAOYSA-N 445.608 2.045 10 20 IECD O=C(CN1CCC(Cn2cncn2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 778220231 WCJROGBGVBXALK-UHFFFAOYSA-N 429.480 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)N3CCC(C)CC3)CC2)cc1 778249881 FVRXRXCVNMPOEC-GWQNQTGSSA-N 428.577 2.137 10 20 IECD COC(=O)Cc1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778379193 ZTVZJKNKGDESJS-ZHACJKMWSA-N 437.496 2.254 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](N4CCNC4=O)C3)cc2F)C[C@@H](C)O1 782937097 CHEKTDUAPPXNFG-JZXOWHBKSA-N 433.528 2.139 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCN(Cc2ccccn2)C1=O 784222209 LZPUTQHWVWPIRM-HXUWFJFHSA-N 441.507 2.048 10 20 IECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCCCSc3nccs3)cn2)n1 787492362 WGEUGPCCYNTTNL-UHFFFAOYSA-N 430.559 2.255 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnc1Br 788434123 MKGGUUSMEODPPO-CQSZACIVSA-N 447.333 2.484 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)sc1C 789821657 UKPLPRMXRBJUHM-BETUJISGSA-N 434.537 2.445 10 20 IECD CC(C)N(CCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)C 789846030 YWENUOQTFOSHPE-UHFFFAOYSA-N 436.572 2.028 10 20 IECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1ccccc1 789856143 OWPQKMHCFYMBKO-YADHBBJMSA-N 438.597 2.418 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](n4cc(Cl)cn4)C3)CC2)cc1 794246922 NTINITGRVPWZAP-OVKVCFKUSA-N 443.935 2.224 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](Cn3ccccc3=O)c3ccccc3)nc12 800505033 HUCNERCEAPUPDO-IBGZPJMESA-N 433.468 2.304 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N(C)C)c1ccc(N2CCOCC2)cc1 803296779 HEKHKRGERGBHGL-VGOFRKELSA-N 442.535 2.259 10 20 IECD C[C@H](NC(=O)C(=O)N1CCSC[C@H]1c1nccs1)c1ccc(N2CCOCC2)cc1 803298723 DTGZWMAODGIGQN-YJBOKZPZSA-N 446.598 2.474 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803305186 KZKPQARSKMPOLT-GOSISDBHSA-N 429.517 2.277 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1 807921466 WZKRTVWWQBZYNQ-OAQYLSRUSA-N 425.529 2.014 10 20 IECD O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 808198980 TYEJUHCPWCQUEK-HXUWFJFHSA-N 448.479 2.221 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](CO)(Cc4ccc(F)cc4)C3)nc12 808794363 FYJYKPMNUPGCME-JOCHJYFZSA-N 428.464 2.178 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccnc5ccccc45)CC3)nc12 809562444 GUZAVFMVSLSDQF-UHFFFAOYSA-N 432.484 2.482 10 20 IECD C[C@@H](CN1CCCC1=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 918099699 ZPMIMLGDKMGNLA-AWEZNQCLSA-N 428.455 2.352 10 20 IECD CCOC(=O)C1=S=c2nc(/C(Cl)=C\c3ccnn3CCCOC)nc(O)c2=C1C 1256727639 BLKATPZBHIZPSK-JLHYYAGUSA-N 436.921 2.056 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 1320641971 QYJVZMNGLQLBAP-KBMXLJTQSA-N 436.505 2.334 10 20 IECD Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)sc1C 1777851577 ZDCQIFFCXITMHS-QVKFZJNVSA-N 446.529 2.007 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc2ccccc2o1 1787943318 DKGOUWIVOUAHNX-QOKNQOGYSA-N 437.452 2.146 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1 1814191066 GSKGHAIBFFMHEW-JXFKEZNVSA-N 446.598 2.138 10 20 IECD COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)nc1 1818400840 REGNKRSQBWVSKE-INIZCTEOSA-N 438.444 2.239 10 20 IECD CN1CCC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827424828 PGRWNPFAGJMPJD-IBGZPJMESA-N 430.549 2.068 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(F)cc(F)c3)CC2)cc1 24707269 ZHUQDKZDWHHTOK-UHFFFAOYSA-N 425.501 2.464 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 108287581 GKIWZBPPFNMQGW-HUUCEWRRSA-N 434.512 2.166 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)N3CC[C@H](Nc4ccccc4)C3)nnc2n1 110886024 BEDBXPRAEUFAJE-HNNXBMFYSA-N 441.565 2.188 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)n(C)c2ccccc12 525932444 BZNAZYGXONYYEV-UHFFFAOYSA-N 433.468 2.140 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1C(=O)NC2(CCCC2)C1=O 726502534 BCXSASBJKAZGCD-OAGGEKHMSA-N 446.523 2.309 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)NC(=O)CO4)n2)c[nH]1 727247563 CTZOALJYJBDCRJ-UHFFFAOYSA-N 434.455 2.057 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)c1 733047133 FVDDFOKOWJAZBF-ZDUSSCGKSA-N 425.441 2.179 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccccc3[N+](=O)[O-])cc2)C1 743674061 RPTHITMXRLXDPK-GOSISDBHSA-N 425.489 2.338 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc1C 743836199 OOSQGFURVLRMNA-UHFFFAOYSA-N 428.488 2.270 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 750258505 ZMHRRPAVTPOMLI-UHFFFAOYSA-N 436.512 2.418 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](c3ccccc3)N3CCN(C)CC3)CC2)cc1F 753749177 YTMRMVJNNIGTBM-HSZRJFAPSA-N 426.536 2.472 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1 760860298 FDCIIRSVXXQCOH-QFIPXVFZSA-N 435.528 2.458 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 762929982 RWHSUJQLGOWZPI-MUUNZHRXSA-N 435.571 2.122 10 20 IECD CN1CCN(c2ncccc2CNC(=O)NCc2cccc(Br)c2O)CC1 764765497 DUWWYNWGXSBBDD-UHFFFAOYSA-N 434.338 2.301 10 20 IECD Cn1cc([C@@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 766765214 RGODURKRHFMWBB-RXVVDRJESA-N 431.512 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3[C@H]3CCCC3=O)CC2)cc1 778404426 AYMRVEOCLMLTQQ-LKWCPCFXSA-N 425.529 2.260 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2cccn3c(O)nnc23)NC(=O)OC(C)(C)C)cc1 780955707 SWAUZVHVXRZITD-KRWDZBQOSA-N 440.504 2.497 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3=NN(Cc4ccccc4)C(=O)CC3)cc2)CC1 786661012 MFFDRADMSDCYAO-UHFFFAOYSA-N 447.539 2.150 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCCN3CCC[C@@H](C)C3)CC2)cc1 787909184 KWTWAKYZYIIOCC-HXUWFJFHSA-N 430.593 2.362 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855879 ZFDSRJLBSYVJMM-GOSISDBHSA-N 431.558 2.213 10 20 IECD CO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1(C)C 789949719 KHLAUTZHHJMWCG-IAGOWNOFSA-N 443.466 2.088 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CCC(=O)OC(C)C)CC2)cc1 792601570 YIXNIYUWOPBHEY-RXQFDZFGSA-N 431.533 2.137 10 20 IECD CN(C)c1ccc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)c(C(F)(F)F)c1 793063767 UPRMACMPHCUWCF-QGZVFWFLSA-N 435.512 2.398 10 20 IECD CC1=CCCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 797998504 IDAQPEJYFGMUIR-ZDLGFXPLSA-N 445.566 2.385 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1 801527330 JXENCXYIMWDNOB-UPWIVDSGSA-N 437.540 2.367 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2cccc(O)c2)C1)c1ccc(N2CCOCC2)cc1 803301119 ZEVZZBXNQWDWCW-JTSKRJEESA-N 439.512 2.006 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCOc3ccccc3OC)CC2)cc1 804317653 KXSFCNIVPVYQAR-UHFFFAOYSA-N 441.528 2.326 10 20 IECD CCN1CCCC[C@@H]1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804420702 DITDQMOMAVLSSO-FUHWJXTLSA-N 438.519 2.364 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CCOCC4)C[C@H]3C)cc2)CC1 805024029 OGKFIRZSAXSHAV-HXUWFJFHSA-N 442.604 2.251 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C[C@]2(CCOC2)O1 805026730 YRCZVASAPJGZIC-QPPBQGQZSA-N 429.561 2.336 10 20 IECD CC[C@H](NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1nccs1 807257419 NDCHACSNKIEBSD-HNNXBMFYSA-N 448.545 2.085 10 20 IECD CCNC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918091570 YVSYFBDDXVGLIY-UHFFFAOYSA-N 444.507 2.177 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(C(=O)NC4CC4)c3)CC2)cc1 918462608 YHQBENSEARMOHP-UHFFFAOYSA-N 436.512 2.265 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 920195676 ZIWLAJITHPWPSF-UHFFFAOYSA-N 433.892 2.449 10 20 IECD CCOC(=O)C1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 921123851 XSOPKOGQVRBLQF-JLAWEPINSA-N 430.549 2.309 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)s1)C2)c1cc(O)nc(O)c1 1777849524 XDPMUUSTQLZNPU-JLTOFOAXSA-N 435.477 2.135 10 20 IECD Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1793973481 WWXXNSVKVKNZJJ-BCDXTJNWSA-N 445.610 2.426 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnoc1C1CC1 1806136932 QJOXTVRNDLTHDY-MGPUTAFESA-N 449.467 2.387 10 20 IECD CCn1nc(C)cc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1810533972 KXPQJMSEGAFXPI-UHFFFAOYSA-N 427.505 2.176 10 20 IECD COCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1817039736 XHZYDYXENFCLBA-GOSISDBHSA-N 438.488 2.231 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccn3nccc3c2)[nH]n1)c1cc(O)nc(O)c1 1817846314 QRBZORGFXHAMLE-KRWDZBQOSA-N 447.455 2.483 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)c(C)n1C 1821110171 CGLFTMBRLMGKOZ-ZDUSSCGKSA-N 441.513 2.444 10 20 IECD CCN(CC)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821673922 OQZVNCKMSNYPIQ-PBHICJAKSA-N 444.536 2.500 10 20 IECD O=C1CC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)C1 1823713501 NPYBITGCVCSHTI-JTQLQIEISA-N 435.889 2.413 10 20 IECD O=C(Cc1cc[nH]n1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1824734597 BRTHQOXYFKQVID-JTQLQIEISA-N 447.904 2.399 10 20 IECD CN1CCC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1830182314 XGDZDOMCFCBVTC-HKUYNNGSSA-N 430.549 2.068 10 20 IECD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)nc1 1837528705 KSXVADGTLNNQNT-UHFFFAOYSA-N 440.500 2.122 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C1 1841396938 GHRCNEHDWMZCFB-GJZGRUSLSA-N 429.423 2.392 10 20 IECD CC(C)(C)n1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1843441194 CZZQGCCNMQZKDX-UHFFFAOYSA-N 448.527 2.248 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)ccc1O 1843442190 DBVTWZVQEIPGNM-UHFFFAOYSA-N 432.480 2.311 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H]3C(=O)N3CCN(C)CC3)ccc21 482933236 OYXQTVBMQQHHJB-JOCHJYFZSA-N 426.561 2.283 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cc(F)cc(F)c3)cc2F)CC1 730286973 DOJDNMPSSLVJLX-UHFFFAOYSA-N 434.462 2.292 10 20 IECD COC(=O)Cn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)cnc21 731565868 HLOVZLRFVAQWBT-UHFFFAOYSA-N 433.468 2.365 10 20 IECD CNS(=O)(=O)[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1 733311850 WVAYAHOFMQPWHU-LJQANCHMSA-N 447.557 2.077 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 735188940 ODYQFHHHTSCFCL-UHFFFAOYSA-N 449.533 2.171 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(NC(=O)NCc3ccccc3O)CC2)cc1OC 735579081 BSLHLRLXFGMHCC-UHFFFAOYSA-N 449.529 2.062 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3c(O)ccc4c3CCCC4)cn2)C[C@@H](C)O1 747573414 XVNXCGOMTZJIOE-IYBDPMFKSA-N 441.532 2.425 10 20 IECD C[C@@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 753478305 RSMRXVMVPZIMDM-MRXNPFEDSA-N 432.542 2.461 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C4CCC(C)CC4)CC3)CC2)cc1 754042970 GOZZWNXKLQBTIS-UBVWURDFSA-N 430.637 2.374 10 20 IECD CC[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 755994429 HBCZSSRPPLTNHH-FNHQQPGVSA-N 447.582 2.465 10 20 IECD CCC(CC)N1C[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1=O 759238917 DARAKGWEIVQGTM-MRXNPFEDSA-N 433.549 2.398 10 20 IECD CN1CCN(c2ccc(CN3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cn2)CC1 760978265 DCKYZOPLPYOXME-UHFFFAOYSA-N 429.908 2.157 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cc(Cl)ccc1OCC(N)=O 766755876 FZEDHDOGFPEEJG-UHFFFAOYSA-N 425.938 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3OCCc4ccccc43)CC2)cc1 778275045 GTALUYUQIOICSA-BREAQWACSA-N 435.524 2.330 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3C(=O)OC(C)(C)C)CC2)cc1 778311077 VKJABIVYPBOTMH-YVNCXZRQSA-N 443.544 2.233 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1 782425031 NPEOYRXNWVMMJJ-UHFFFAOYSA-N 445.483 2.489 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)nc1 785862583 SAHRHYOZHSKMDM-UHFFFAOYSA-N 439.560 2.038 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1N1CCOCC1 787285705 XXHWCHHVRCNZFG-UHFFFAOYSA-N 439.560 2.038 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccc2c(c1)CCO2 788345257 XHJCCWJESXNFTN-UHFFFAOYSA-N 448.567 2.086 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3nc(F)c(F)cc3F)CC2)cc1 788950973 FFUDWRMQZCVNBQ-UHFFFAOYSA-N 449.477 2.310 10 20 IECD Cc1ccc(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 793732608 JMCJMOYCKNOVMR-MAUKXSAKSA-N 442.585 2.122 10 20 IECD COc1ccc(CNC(=O)Nc2cc(C(=O)N3CCN(C)CC3)ccc2OC)c(O)c1 797619326 UECNEKAZHQTBSA-UHFFFAOYSA-N 428.489 2.119 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1)c1ccc(N2CCOCC2)cc1 803311848 ZDNCCUAPPOPBLH-QGZVFWFLSA-N 425.529 2.244 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H](C)[C@@H](C)O1 803451155 DROSJCGOCIZSIM-RBSFLKMASA-N 425.476 2.397 10 20 IECD Cc1ccc(C(=O)NCC(=O)Nc2ccc(I)cc2)c(O)c1O 803491730 ALDIJUIEMQDAOI-UHFFFAOYSA-N 426.210 2.379 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc4c(c3)OCCCO4)CC2)cc1 803626511 UCHREESYMIZUJV-UHFFFAOYSA-N 439.512 2.258 10 20 IECD CC(=O)N1CCC(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803677988 WCWWHHDVZVPRQE-UHFFFAOYSA-N 428.577 2.446 10 20 IECD COc1cccc2c1OC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2 804674828 MKKNJCCPUCJMNO-RTBURBONSA-N 440.496 2.028 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cnc(Cl)c(F)c3)CC2)cc(OC)c1OC 805062236 AHLLIKZQIAPTDP-UHFFFAOYSA-N 445.900 2.411 10 20 IECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCCCSc2nccs2)CC1 806278981 AZNZCMLOYYAVAA-HNNXBMFYSA-N 433.603 2.478 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(c2cccnn2)CC1 807746732 QRZGEUMUOOBKHF-UHFFFAOYSA-N 436.560 2.211 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C(N)=O 917916786 BZHHVSWCFUZKLK-GJZGRUSLSA-N 435.521 2.325 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cccnc1N1CCOCC1 918204637 ODYLZWOYMZQTCX-UHFFFAOYSA-N 443.523 2.018 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920927347 UWWMDXOUHCYRRU-AWEZNQCLSA-N 429.448 2.265 10 20 IECD COc1cc(N2CCN(C(=O)NCCc3nc(C(C)C)no3)CC2)cc(OC)c1OC 1321049094 QDOIYVWRTMDRNG-UHFFFAOYSA-N 433.509 2.293 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccncc3)cc2F)C[C@@H](C)O1 1326553420 TUCRECKKZLZPSC-CALCHBBNSA-N 445.491 2.211 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C1CCSCC1)CCO2 1782008312 YYZNMDMMSNZFSO-HXUWFJFHSA-N 440.949 2.338 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(OC)c1 1799558011 QYCVEPLNUYJPDN-QDMKHBRRSA-N 427.457 2.076 10 20 IECD CCC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)n1cccc1 1804333719 PRRJYLQUNQPBII-YVSFHVDLSA-N 448.614 2.328 10 20 IECD CCN(CC)c1ccc(CNCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 236960269 WSIWMBMHBYMSRC-UHFFFAOYSA-N 431.606 2.169 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NCCCn3nc4n(c3=O)CCCC4)ccc21 484624133 NKBBOGXCYQDTMJ-UHFFFAOYSA-N 425.533 2.419 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(C(F)(F)F)cnc3O)CC2)cc1 726291547 ILMYGNBCSBUEPH-UHFFFAOYSA-N 438.406 2.492 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCCO1 727489921 NCYYVGXWMVLEKL-ZDUSSCGKSA-N 435.458 2.352 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4ccncc4)CC3)cc2F)CC1 730132229 ABZJANSHOLRKEH-UHFFFAOYSA-N 440.567 2.390 10 20 IECD CC(C)Cn1c(N)c(C(=O)CN(Cc2ccco2)Cc2ccccc2O)c(O)nc1=O 731843899 BKHHDQGALWLUIZ-UHFFFAOYSA-N 426.473 2.371 10 20 IECD O=C(c1cc(O)cs1)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 732265167 NTARNODAMXUQOW-UHFFFAOYSA-N 431.333 2.363 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)[C@H](C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 733341548 AGASSLMAVRODKI-QXSJWSMHSA-N 429.558 2.402 10 20 IECD COc1cc(Br)c(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1OC 737278082 FCPHKBBKMKDKHZ-UHFFFAOYSA-N 439.262 2.435 10 20 IECD C[C@@H]1CS(=O)(=O)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 739744426 HHSARDXXRVVGBY-XTCQQWIJSA-N 444.625 2.375 10 20 IECD CCN(CC)c1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1F 740167652 KBRQPEXYWBMEHQ-PTNGSMBKSA-N 431.580 2.422 10 20 IECD COC(=O)CCOc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958337 ROAVBYSNNGWMRM-UHFFFAOYSA-N 426.469 2.468 10 20 IECD CCCN(CC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)Cc1ccccc1O 750874669 DUVGWSDJBBXERL-UHFFFAOYSA-N 445.585 2.278 10 20 IECD CNC(=O)[C@H](NC(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1)c1ccccc1 751930303 CJWFBYLPSCGUHP-HXUWFJFHSA-N 438.509 2.076 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)c(OC)c1 752111924 OAYAERUOYNAOJC-HSZRJFAPSA-N 440.500 2.115 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)c(OC)c1 752111926 OAYAERUOYNAOJC-QHCPKHFHSA-N 440.500 2.115 10 20 IECD COC(=O)C[C@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 752335319 DOGRBMHHEFXVRB-HOCLYGCPSA-N 436.464 2.053 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)s1 754040621 UKMAIXJZOGAXDA-UHFFFAOYSA-N 444.506 2.202 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccc2c(c1)CCS2(=O)=O 757635454 SNBYYJOGYCBOOI-UHFFFAOYSA-N 443.569 2.225 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H]4[C@H](CCCN4C)C3)cc2F)C[C@@H](C)O1 766121016 FNIJAFBJBZOCEP-RMEPHLEKSA-N 432.584 2.472 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C 766267128 ATPUZFLWNZBUDO-HNNXBMFYSA-N 429.542 2.463 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccn(C)c4c3=O)cc2F)C[C@@H](C)O1 768517997 XJBDFPGMOSSIPI-HZPDHXFCSA-N 426.492 2.409 10 20 IECD CC(C)C[C@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771051022 ROUPMZQHNHDEJG-HNNXBMFYSA-N 437.474 2.238 10 20 IECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 771257534 SUHJKQXGDYJGJY-DEOSSOPVSA-N 436.512 2.161 10 20 IECD CCCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 773205415 CDDIWQWBQMCYLJ-UHFFFAOYSA-N 430.480 2.491 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)NC(C)(C)C)CC3)cc2F)CC1 776134801 IUBFIPSBLJPJMA-UHFFFAOYSA-N 448.587 2.303 10 20 IECD O=C(CN1CCC=C(F)C1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 778962034 YOKIPCIZIBEZTR-MFOYZWKCSA-N 449.529 2.292 10 20 IECD O=C(NCc1cnn(-c2ccccc2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785973265 WVZDEZFFELOWFZ-OAQYLSRUSA-N 434.496 2.402 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCN1C1CCCCC1 788311446 VOYCHDGISLHXBI-QFIPXVFZSA-N 428.577 2.053 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cc2F)C[C@@H](C)O1 789820918 QWPKZCPPLJETIC-JFIYKMOQSA-N 443.523 2.185 10 20 IECD COc1ccc([C@H](CO)N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789860204 JUORZJRTHDHJIN-NRFANRHFSA-N 443.569 2.057 10 20 IECD Cc1cccc(=O)n1C[C@](C)(O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792238302 OSFRTBCEBMTUDA-AVRDEDQJSA-N 433.936 2.048 10 20 IECD Cc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 793722091 JXZAPPGABHJOJF-QUCCMNQESA-N 436.556 2.499 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)CC2)cc1 794256029 WAXYRUNNNLXEQY-AERCQKQUSA-N 444.576 2.046 10 20 IECD C[C@@H]1CCN(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 795250042 XTQKTAMBEAUUPZ-CRAIPNDOSA-N 426.583 2.495 10 20 IECD O=C(COC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1)c1ccc(O)c(O)c1 801881659 SOAWYEUQNKIOHS-IRXDYDNUSA-N 436.420 2.416 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)c1ccc(N2CCOCC2)cc1 803296777 HEKHKRGERGBHGL-JTSKRJEESA-N 442.535 2.259 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(N2CCOCC2)cc1 803302164 INGLLDKOHPLTRF-GOSISDBHSA-N 440.519 2.188 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3cnc(C(C)C)nc3)CC2)cc1 804317042 RBYWPEAGPIXUPA-UHFFFAOYSA-N 425.533 2.352 10 20 IECD CCN(CC)CCO[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805025183 KANNASGMLMKQEQ-HSZRJFAPSA-N 444.620 2.498 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3c(C)cccc3C)CC2)cc(OC)c1OC 805676671 AFURFEGWJSGODZ-UHFFFAOYSA-N 441.528 2.294 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1 806839890 LPKGGIXDJACLNR-UHFFFAOYSA-N 438.459 2.334 10 20 IECD CCCc1nnc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1N 808052845 YAXFLGTWNYLBCU-OKILXGFUSA-N 436.557 2.106 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1 808344515 XBYWSJAXGOASEK-GOTSBHOMSA-N 442.604 2.129 10 20 IECD CON(C)C(=O)C1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 812867306 AISRASYVVXDVSG-UHFFFAOYSA-N 435.480 2.132 10 20 IECD COC(=O)COC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 913360521 DQWCKXDEWYXBKY-IZZDOVSWSA-N 430.301 2.367 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 916383522 KPPUAALABODJRZ-LJQANCHMSA-N 439.578 2.287 10 20 IECD O=C(CN1CCN(Cc2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 916973721 TVLYUVMTYRWZOZ-UHFFFAOYSA-N 426.536 2.096 10 20 IECD COCCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918121856 ILMXKPFXIXIDBE-LJQANCHMSA-N 425.533 2.142 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 920192508 JNXHEKHFZGMXAX-UHFFFAOYSA-N 445.491 2.067 10 20 IECD CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194996 LZHPWPZFNIMIGH-KRWDZBQOSA-N 438.528 2.306 10 20 IECD Cc1cc(C(=O)CN(C[C@H]2CCOC2)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920408209 KYYYBSFSVZVLCR-QGZVFWFLSA-N 431.558 2.425 10 20 IECD O=C1CCc2cc(OC[C@H](O)CNC(=O)NCc3ccc(N4CCCC4)cc3)ccc2N1 920812269 NOEKHHGZVATOAP-HXUWFJFHSA-N 438.528 2.411 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1 1116812573 HERQHSBQYYWMJO-CLCXKQKWSA-N 443.500 2.011 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1c2ccccc2CCN1C(C)=O 1320394077 NMXASWMJKBEFQW-VQTJNVASSA-N 440.496 2.224 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 1339518452 SPOZYQOQQKHARH-UHFFFAOYSA-N 425.457 2.238 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C 1342915939 NJMIPIPDJPPGIS-OAGGEKHMSA-N 436.505 2.382 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1 1795509470 DWXMMYIPIRIDDK-BJWYYQGGSA-N 431.583 2.118 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)C(C)C)C3)cc1 1799620466 XKSWDWMRVAMKHP-IRMYBRCSSA-N 439.556 2.314 10 20 IECD CCOC(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)OCC 1802602425 OFACJRXHCRVETP-NCSHHQJSSA-N 448.516 2.244 10 20 IECD CC[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 1804077839 SIFLDJRKYXLYGQ-FZKCQIBNSA-N 448.520 2.048 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cn2ccccc2n1 1804286469 QJIHVUVSRZOHNL-FJXIAYRNSA-N 448.479 2.416 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2O)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998908 PLSKCDTUYHZFMN-SBUREZEXSA-N 448.479 2.156 10 20 IECD Cc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1808907696 ZKDKYMHVIAUNLC-LIRRHRJNSA-N 439.497 2.286 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)c1ncon1 1811182941 HAVSKLJQWWPEKN-LRDDRELGSA-N 443.847 2.163 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C3CC3)on1)CC2)c1cc(O)nc(O)c1 1816720368 OBYHYJNBYZYXBN-LLVKDONJSA-N 441.469 2.354 10 20 IECD O=C(c1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715805 UHHVYUNDWQKZRD-NRFANRHFSA-N 448.527 2.436 10 20 IECD Cc1nc(C)c(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)o1 1838029679 AJNSNTJMOXFNAB-UHFFFAOYSA-N 444.488 2.024 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nc2nccn12 1845640800 ALELHXGBUKYUSQ-UHFFFAOYSA-N 441.875 2.233 10 20 IECD O=C([C@@H]1Cc2ccccc2N1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039338 ICOYEDMXVVAYQH-KOEDOTQGSA-N 435.480 2.057 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1F 737166129 MJAPPZCQNKXKAS-UHFFFAOYSA-N 432.408 2.216 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(O)nc2cc(F)ccc12 739699347 FSSMAXRKUMXJGW-UHFFFAOYSA-N 429.473 2.244 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nccn3CC(F)(F)F)CC2)cc1 742440983 WMORSFOTIMMWIR-SSEXGKCCSA-N 444.479 2.052 10 20 IECD C[C@@H]([C@@H](C)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)S(C)(=O)=O 744402390 HIXMVHBPWVHGSX-KGLIPLIRSA-N 428.510 2.154 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](Cc4cnn(C)c4)C3)cc2F)CC1 746759958 JUCMZTJFGLEILR-IBGZPJMESA-N 428.556 2.475 10 20 IECD Cc1nnc2n1C[C@H](C(=O)OCC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CC2 750681556 ZSVDWUDCQBHBOZ-CQSZACIVSA-N 444.447 2.106 10 20 IECD COC(=O)c1c(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n[nH]c1C 751455257 AJHKQOFXKHJOTC-LBPRGKRZSA-N 444.460 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3-c3noc(C)n3)CC2)cc1F 754214135 ZLCLCHFPGQDUNW-UHFFFAOYSA-N 439.447 2.480 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)N[C@](C)(C4CCCCC4)C3=O)CC2)cc1 758198263 NFRDZWFGFUYPLB-HYBUGGRVSA-N 444.576 2.069 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(-c4ccco4)n3C)CC2)cc1 758202742 APUSJHFYLWHRDA-KRWDZBQOSA-N 429.546 2.359 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1 761539773 CHHJMXJKRHECDA-ZDUSSCGKSA-N 438.477 2.052 10 20 IECD O=C(Cc1ccc(-n2cnnn2)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912849 RYIZIFMOPSXDKJ-GOSISDBHSA-N 426.908 2.345 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4cn5ccccc5n4)n3)CC2)cc1 771069515 WIPFDUIHXFFFJF-UHFFFAOYSA-N 432.484 2.208 10 20 IECD Cc1n[nH]c(C)c1[C@H](C)CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772028576 NOKYCCQDQGAVKK-CQSZACIVSA-N 432.496 2.355 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1 772777606 WFIIIDPUTLFYCV-VQHVLOKHSA-N 425.441 2.031 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(N)c(OC(F)(F)F)c3)nc12 778351176 BFWMHLUAIUDNHM-UHFFFAOYSA-N 440.334 2.449 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)C3(C)COC3)c2C)c1 782393858 KYAWNBQOJGFLBB-UHFFFAOYSA-N 443.452 2.430 10 20 IECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)c(OC)c1 782779151 JVCNFSMGKUANCA-INIZCTEOSA-N 429.425 2.146 10 20 IECD CN1CCO[C@@H]([C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c2ccc(Cl)cc2)C1 785434865 VRFZUJGGCRXYOO-NHCUHLMSSA-N 444.963 2.210 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCc2cccc(Br)c2O)n1 786740870 RVBYRXXOHUCKMC-UHFFFAOYSA-N 445.339 2.416 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C(C)C)N3C[C@@H](C)O[C@H](C)C3)cc2)CC1 787320153 SJPZHSFCVSQQJU-PWHSHALESA-N 430.593 2.105 10 20 IECD C[C@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 787907674 DAQKYRADMCKUJW-IBGZPJMESA-N 432.634 2.484 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)OCC(C)C)CC2)cc1 788954450 KBOKPJGVUDNFDP-UHFFFAOYSA-N 432.565 2.476 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCSC1 789951246 UWQTVJQUSZXQRP-HNNXBMFYSA-N 431.480 2.122 10 20 IECD CN(C)C[C@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793728380 YHKATTCEUKDUOG-FCHUYYIVSA-N 439.556 2.189 10 20 IECD CC(C)[C@](C)(CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 793779270 HVOXLHUSCWBHEP-IBGZPJMESA-N 437.474 2.238 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cn1 800148717 QRYSWFFIWKXVAM-AWEZNQCLSA-N 440.953 2.424 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H](CN2CCOCC2)C1 800701595 RSLPJERNUAPEGK-IBGZPJMESA-N 434.556 2.041 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 801599722 APMBZDQPJSYFKA-QFIPXVFZSA-N 428.533 2.261 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCCC[C@@H]1N1CCOCC1 806090256 IJSNJBOSZMGJRA-PKTZIBPZSA-N 442.604 2.395 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2ncnc3ccsc23)CC1)c1ccc(N(C)C)cc1 807676418 GBWLSBGQYYUORJ-HNNXBMFYSA-N 438.557 2.283 10 20 IECD Cn1ccnc1[C@@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769543 HHSQLHFNWIBSMA-HZPDHXFCSA-N 447.486 2.123 10 20 IECD CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809659526 QGRSPTYGTTZFGP-UIFIKXQLSA-N 431.577 2.438 10 20 IECD C[C@@H](C(=O)Nc1ccccc1S(C)(=O)=O)N(C)Cc1ccc(N2CCOCC2)cc1 857758629 PCEMNLYLBBKQFL-KRWDZBQOSA-N 431.558 2.386 10 20 IECD COCCSCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 914720775 DWRZWKULQKZODO-OQLLNIDSSA-N 440.568 2.112 10 20 IECD O=C(CCc1cnn(-c2ccccc2)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676367 JILKKODPRDQQRE-UHFFFAOYSA-N 438.553 2.356 10 20 IECD COCCOc1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 918209960 XMLKARCCCZIFOB-UHFFFAOYSA-N 428.533 2.315 10 20 IECD COc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1S(=O)(=O)N(C)C 920970074 HDMOUFOHAWPJKI-SFHVURJKSA-N 448.541 2.473 10 20 IECD CC(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787538985 AHWJSAQQTQJZHP-QRFRQXIXSA-N 440.544 2.195 10 20 IECD Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994357 UZZISWSAOZIOGA-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCO3)sc2C1 1815803427 UROKSEDJDVDIDA-AZOMNODSSA-N 445.497 2.064 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccn2ccnc12 1819107036 SEKYBKATAXIVNS-INIZCTEOSA-N 447.455 2.483 10 20 IECD COc1ccc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1842721669 HOIQWZUHRMPVAQ-UXBLZVDNSA-N 438.480 2.271 10 20 IECD CCS(=O)(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1847787643 VLQFHEJVVJADQA-SFTDATJTSA-N 443.569 2.344 10 20 IECD O=S(=O)(c1ccc(CNCc2cc(Br)ccc2O)cc1)N1CCOCC1 110243897 JWYPEBBUWUDNJD-UHFFFAOYSA-N 441.347 2.465 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ccc(C(N)=O)cn3)CC2)cc1F 731363485 HFCBNRIYDLRRPR-UHFFFAOYSA-N 428.512 2.198 10 20 IECD O=C(O)CCCN1C(=O)/C(=C/c2ccc(OCC(=O)O)c([N+](=O)[O-])c2)SC1=S 731664032 PTGGQBMLAWYROD-GHXNOFRVSA-N 426.428 2.124 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(OC)c(OC)cc2Br)c1 734073499 PYTHRMJRVDHTRB-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCOC(Cn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1)OCC 748551113 MKROXRDJRIUBHO-HOTGVXAUSA-N 449.527 2.360 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CNS(C)(=O)=O)o3)cc2F)C[C@H](C)O1 753586453 XWYZQTKAERUHGW-KBPBESRZSA-N 439.509 2.012 10 20 IECD C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NCc1ccc(N2CCSCC2)cc1 756812296 JBESRYGPWUUULC-HSZRJFAPSA-N 425.554 2.263 10 20 IECD COC(=O)CN(Cc1ccc(Cl)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769743912 HTLJOIMCIRKJAW-UHFFFAOYSA-N 426.878 2.233 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(N(C)C)cc1 773858320 PPQYVXPFXZHPPY-MRXNPFEDSA-N 444.557 2.353 10 20 IECD COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCOc2cc(N(C)C)ccc21 774753814 PYMLQDFRDAFMTK-FQEVSTJZSA-N 436.512 2.333 10 20 IECD C[C@@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N(C)C)cc1 776247877 XGZUCHVPIXRFBO-BEFAXECRSA-N 426.517 2.437 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 782799139 LIQZXGBSDBHACK-UHFFFAOYSA-N 428.445 2.336 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(c4c(F)cccc4F)=NO3)cc2)CC1 786657526 ZDSWEQGTPGEKMS-OAQYLSRUSA-N 442.466 2.443 10 20 IECD O=C(NC1CCN(C2CCCC2)CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787194247 XIUIRXRPAKJNOD-OAQYLSRUSA-N 429.561 2.423 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N2CCOCC2)c1 787611892 IEJVDCGJQOLNLY-XMMPIXPASA-N 448.567 2.177 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1 788330166 BEDHNNPPJBXEAD-UHFFFAOYSA-N 447.539 2.422 10 20 IECD CCOCCOC[C@@H](O)CNCc1cc(Br)cc(Br)c1O 792196157 MJIZNNIOHXAIFP-LBPRGKRZSA-N 427.133 2.421 10 20 IECD COc1c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc(Cl)cc1C(N)=O 792998630 ZRHAKUWGDCYNIG-UHFFFAOYSA-N 431.876 2.287 10 20 IECD CC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCCO1 803450667 NUOLXWQUYUQRQL-ZWKOTPCHSA-N 425.476 2.447 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)cc1F 804852955 JJFGIELDROEVKO-YLJYHZDGSA-N 447.507 2.232 10 20 IECD CCOc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1OC 805743679 MZKZCLAYOHAKMG-UHFFFAOYSA-N 441.528 2.205 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1 806275648 OSFYUIASDHVCBB-UHFFFAOYSA-N 448.570 2.223 10 20 IECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCCN(c2ccccc2)C1=O 806279824 ATMNPZQDGSNUQS-INIZCTEOSA-N 432.571 2.396 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 806899360 DNNORBSQKGORKQ-UHFFFAOYSA-N 432.471 2.431 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 807096027 RNHLUQGBXJYCCB-KRWDZBQOSA-N 432.565 2.393 10 20 IECD CCN(C[C@H]1CCCO1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769395 UDQZZSDSQXUTGQ-CRAIPNDOSA-N 425.476 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1F 810490951 XMVGPGBEHZODGX-UHFFFAOYSA-N 441.912 2.115 10 20 IECD CO[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 818540609 VXZRKNNJKWHDMR-GOSISDBHSA-N 435.458 2.256 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)s1 916232647 LEXSNJXAUJUMER-UHFFFAOYSA-N 440.616 2.209 10 20 IECD CS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918027723 CLDMLYQTNDVYQV-INIZCTEOSA-N 430.530 2.114 10 20 IECD COC[C@H](C)n1c(C)cc(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 920636400 TWKGNPOQLXEUKN-ZDUSSCGKSA-N 438.502 2.429 10 20 IECD CC(C)[C@@H](CNC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 920638188 QGHWBCYDSFWBRF-GOSISDBHSA-N 434.514 2.477 10 20 IECD C[C@@H](NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 920881990 UGDCCFKYSUIMGZ-NSYGIPOTSA-N 448.523 2.094 10 20 IECD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)on1 1780198896 RWTKHAQGXYHPFP-VGOFRKELSA-N 444.488 2.046 10 20 IECD CC(C)O[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007286 OUOSUGDWHQKCMG-RBZFPXEDSA-N 426.897 2.008 10 20 IECD O=C(CCc1ccoc1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784682283 KDXLMYBDWRLDCE-OAQYLSRUSA-N 434.876 2.421 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCC(F)(F)F 1793983450 GZASUSPKIUBRJU-ZSBIGDGJSA-N 437.509 2.218 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cccs1 1796207336 ZMLBLPZAPAUWKE-FBKAWLDUSA-N 435.596 2.260 10 20 IECD CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821973297 KSKHTAMNBUSRFN-BMIGLBTASA-N 449.895 2.305 10 20 IECD O=C(CCCc1ccccc1F)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847050545 BVIRBEGIYNCCQO-UHFFFAOYSA-N 449.573 2.212 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCS(=O)(=O)C1 16021904 SSMKPQLSFORPGG-NASPGAHYSA-N 430.598 2.033 10 20 IECD COC(=O)CN(CC(=O)NC(=O)N[C@@H]1CCCC[C@H]1C)Cc1cc(Cl)ccc1O 731845752 FFDLAJQQTDTIPS-CZUORRHYSA-N 425.913 2.425 10 20 IECD COC(=O)C[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 752335320 DOGRBMHHEFXVRB-ZBFHGGJFSA-N 436.464 2.053 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCOCC4(CCOCC4)C3)cc2F)CC1 753176114 ZMMGPHLOTLAGNO-UHFFFAOYSA-N 434.556 2.306 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc4c3O[C@@H](C)C(=O)N4)CC2)cc(OC)c1OC 759223977 YBMWAMPQNCWNSF-AWEZNQCLSA-N 441.484 2.394 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cc(C(N)=O)ccc3F)CC2)cc(OC)c1OC 759955623 VKNCUBJQILEKMF-UHFFFAOYSA-N 432.452 2.305 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnc2[nH]cnc2c1 763984721 WIMRUSSGZIWGGT-UHFFFAOYSA-N 432.463 2.144 10 20 IECD CCOc1ccnc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)n1 767939795 RPHBSKULRNUKLT-UHFFFAOYSA-N 440.548 2.134 10 20 IECD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1ccn(C)n1 774166185 JKRDUMFEHKDYND-UHFFFAOYSA-N 431.430 2.111 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-c4nncn4C)c3)CC2)cc1 778233988 IEOAIINHLMXPHX-ZHACJKMWSA-N 446.511 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccnc3OC(C)C)CC2)cc1 778236629 YTEPCIATHBRDAH-KHPPLWFESA-N 438.528 2.399 10 20 IECD COC(=O)c1cnc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1 779669721 IUQYOROJOSOEGD-INIZCTEOSA-N 443.504 2.325 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@@H]3C3CCC3)CC2)cc1 785526070 BBPWYQGYSLPBLS-JOCHJYFZSA-N 428.577 2.115 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc([N+](=O)[O-])cc3S(C)(=O)=O)cc2)CC1 786803304 HRWSJGWTPXVYCB-UHFFFAOYSA-N 432.502 2.279 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(CCCn2ccnc2)CC1 788324354 URXOGSQYMXJEPC-UHFFFAOYSA-N 439.560 2.055 10 20 IECD C[C@H](COc1cccc(F)c1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798024 AJVPDKBJCCKFFX-OAHLLOKOSA-N 433.455 2.001 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2c(F)cc(F)cc2C1 789813244 QOCRNWIOXHXMRC-UHFFFAOYSA-N 433.430 2.142 10 20 IECD COc1ccccc1CONC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789827370 SFEVLIVRXFARAZ-IYBDPMFKSA-N 445.491 2.312 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](C(F)(F)F)O1 789864810 RXZKVEDWEIWHNX-CJNGLKHVSA-N 431.480 2.034 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ncccn2)C1 790259230 GYQMEPRFUAFTPY-HXUWFJFHSA-N 436.560 2.211 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCOc2ccc(F)cc21)c1ccc(N2CCOCC2)cc1 803300251 RICFDCKRTNFSKV-MGPUTAFESA-N 427.476 2.480 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C12CCC2 805010070 SZCLCZLOGZOUAV-NHCUHLMSSA-N 446.567 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)n3ccc4ccccc4c3=O)CC2)cc1 805631055 ZTESHYWQFPAVPQ-GOSISDBHSA-N 449.507 2.463 10 20 IECD CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C(C)(C)O1 806951275 DVQOYVGAOMQEIJ-NRFANRHFSA-N 442.604 2.297 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@H]3[C@H]3CCCO3)CC2)cc(OC)c1OC 811764085 NZNGIHCOTWTGDS-DYESRHJHSA-N 433.549 2.208 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)N(C)C)c(C)n1-c1ccc(Br)cc1 812391558 JRLOLWBPWLJJII-UHFFFAOYSA-N 428.352 2.478 10 20 IECD CCCCN(C)C(=O)C1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 917067766 XZSICEAVWXKNIT-UHFFFAOYSA-N 430.593 2.314 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 917411210 FHSZJRAOMSBUFE-UHFFFAOYSA-N 432.565 2.287 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 917525100 YOXRTHYQLHLGKM-UHFFFAOYSA-N 437.587 2.036 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1OC 918306976 JNHJJQYMJIZLST-UHFFFAOYSA-N 426.517 2.450 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)c(C(=O)N2CCCC2)cc1OC 918443975 IFQGODKAODMCAD-UHFFFAOYSA-N 441.484 2.243 10 20 IECD Cc1cccc(OC[C@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 920043058 FJOHMOYYOFCHJU-LJQANCHMSA-N 431.508 2.334 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785704104 WYJAZAJDXWUGPB-DDJHWDJXSA-N 449.507 2.058 10 20 IECD CC[S@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789420268 PGAGPDPXNNZDNA-PMERELPUSA-N 431.514 2.399 10 20 IECD Cc1noc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795045556 UECIBESMOYQIDB-VBUUOAMHSA-N 435.484 2.336 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1F 1796456574 KRFLHOXEPAEOGR-BPQKRJORSA-N 427.432 2.303 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F 1799535399 YZRAJMMAXLNNIK-ZSBIGDGJSA-N 439.509 2.077 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sccc1F)C2)c1cc(O)c(O)c(Cl)c1 1799766920 HSFJBTNNCFNTQH-QHBPRCKVSA-N 440.880 2.469 10 20 IECD C[C@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816013866 BAHBBOUBSUSCIN-CZUORRHYSA-N 439.476 2.055 10 20 IECD O=C(c1ccc(O)nc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427872 KEGLAZVPCIBXLQ-QGZVFWFLSA-N 426.473 2.141 10 20 IECD CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1841407579 LIQBJLUYMLXUSF-IBGZPJMESA-N 445.610 2.490 10 20 IECD Cc1ccc(COCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1C 1843435263 HUQRCLSPOYMRRD-UHFFFAOYSA-N 425.485 2.143 10 20 IECD Cc1cccc(/C=C/C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1843440744 HNXRBAAHYORCKI-VAWYXSNFSA-N 443.507 2.400 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 108806675 ARUHWWGINNOONW-UHFFFAOYSA-N 431.558 2.484 10 20 IECD COc1cccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c1O 727762508 NJMLSDMVIFQDOJ-QGZVFWFLSA-N 438.571 2.426 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccccc3OCC(=O)N(C)C)cc2F)CC1 730193150 XKFRIEWPOBDAGH-UHFFFAOYSA-N 442.535 2.365 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCCc4ccccc43)cc2)C1 731403163 DYXFTVAIAVMGTN-CJFMBICVSA-N 436.556 2.412 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](Cc1ccccc1)CN1CCOCC1 732453623 YZQRKILMZSBJPD-HSZRJFAPSA-N 438.572 2.266 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 735520070 ZAQSHVBQEWTXGR-UHFFFAOYSA-N 434.562 2.019 10 20 IECD O=C(Nc1cc(-n2cnnn2)ccc1F)C(=O)N(Cc1ccco1)Cc1ccccc1O 737110926 NNKHPAJHJHDCDE-UHFFFAOYSA-N 436.403 2.268 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc21 746038855 KHYCNSDECFAOCC-ZDUSSCGKSA-N 426.473 2.309 10 20 IECD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751212053 BDVNQBMJLAIYKS-UHFFFAOYSA-N 439.515 2.193 10 20 IECD COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751932025 RNERBNCWKYGUAH-CYBMUJFWSA-N 431.514 2.273 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccc(N(C)C)n3)CC2)cc1 755055195 XGMWFFBHAQQKAC-UHFFFAOYSA-N 426.565 2.168 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1OC 768240062 ZVANQODTHJTCOG-UHFFFAOYSA-N 425.529 2.498 10 20 IECD C[C@@H](NC(=O)N(CCO)CCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 768273775 BMCFHPPUZPMVHB-QGZVFWFLSA-N 436.553 2.113 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc5nc(O)oc5c4)n3)CC2)cc1 771068036 QJMMTCSDXNNYDH-UHFFFAOYSA-N 435.440 2.483 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 773741805 YMRHUTXUJGZERS-IBSYWUHOSA-N 439.512 2.059 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(NC(=O)C4CC4)nc3)CC2)cc1 778265371 FFDIKUWQFJHCTI-KHPPLWFESA-N 449.511 2.282 10 20 IECD Cc1cc(C(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c(C)n1-c1ccccc1Br 778855040 HATJFABZBSDMRR-INIZCTEOSA-N 431.290 2.233 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(OC2COC2)cc1)c1ccc(N2CCOCC2)cc1 782106000 GKTOPZXLTMAJON-INIZCTEOSA-N 425.485 2.117 10 20 IECD CN1CCC(n2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)n2)CC1 786708102 VGBNHSVQRUALQJ-GOSISDBHSA-N 439.564 2.173 10 20 IECD Cc1nn(C)c(C)c1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788359211 YIGRMHXNDWWYCM-HNNXBMFYSA-N 435.475 2.040 10 20 IECD Cc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800823 PPTULLIEHPKAJD-UHFFFAOYSA-N 429.492 2.124 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC1CCN(C2CCCCC2)CC1 789814154 ZIWWAUXYMOZJFN-UHFFFAOYSA-N 446.567 2.192 10 20 IECD CSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949717 KGJQALJMXRERGM-ZDUSSCGKSA-N 433.496 2.416 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2CCCN(C(=O)c3cccc(O)c3O)C2)CC1 790557135 AMLZUQNCUXCPCH-HNNXBMFYSA-N 433.505 2.029 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 790906270 WGVYMRYBPHPKAH-WBVHZDCISA-N 447.532 2.466 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC(=O)NCC(F)F 797360061 HWPXXEITQSVKBI-YRNVUSSQSA-N 433.527 2.227 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCS[C@@H](C(C)C)C3)cc2F)CC1 805006900 JQCNZYWDCUYOMY-HXUWFJFHSA-N 436.597 2.184 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCO[C@H](C)C3)cc2)CC1 805023878 MOKXGALLXMZRKS-HXUWFJFHSA-N 430.593 2.156 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1)c1ccc(N(C)C)cc1 807678756 ZNHLRWALMQWMAJ-IPELMVKDSA-N 431.558 2.342 10 20 IECD CN(CCCN1CCCC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768059 BAHBVDMSPJBRAF-KRWDZBQOSA-N 438.519 2.317 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(N(C)C)cc1 808568415 KGDIMINVFMXXRU-ACJLOTCBSA-N 430.455 2.130 10 20 IECD CNC(=O)Oc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 815361000 FGZOJUKRLLFIQU-SFHVURJKSA-N 427.457 2.257 10 20 IECD CCCNC(=O)CN1CCC(NC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916519015 YENRFWXDMKSMJZ-UHFFFAOYSA-N 433.622 2.030 10 20 IECD CN(Cc1cnn(-c2ccccc2)n1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918122448 KYQUUKKOFGNNLR-IBGZPJMESA-N 447.543 2.311 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3OC(F)F)cc2)C1 918463930 PIIWDTMQPCWIMP-OAHLLOKOSA-N 446.454 2.245 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2)C1 919780505 DLVHYVFMOXFMDE-GOSISDBHSA-N 425.489 2.338 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320089325 VGIVWZJGNXGGNJ-UKILVPOCSA-N 435.572 2.291 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1O)CCO2 1782004793 NBQHLOOQPUYHQJ-OAQYLSRUSA-N 432.860 2.214 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ncon2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806334 KNDJVKHRMLNKFM-BLLLJJGKSA-N 443.847 2.163 10 20 IECD C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CC1(F)F 1814073818 JESGIXGXUOTLJA-YXKFXFPPSA-N 432.427 2.253 10 20 IECD Cc1onc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1C 1815450643 QCAFSSWELHNSCM-AWEZNQCLSA-N 426.433 2.440 10 20 IECD CCC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823475950 MKAKIKIEPVFOPW-KGXGESDWSA-N 428.445 2.211 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnco1)CC2 1828195274 KHBCGDBCGOOHPD-GSQGTZRGSA-N 442.453 2.187 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726563157 XOPTTXTVZVJUSL-UHFFFAOYSA-N 447.557 2.019 10 20 IECD COc1ccnc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 734913686 KGJBGCNMHOYAOR-GJZGRUSLSA-N 431.464 2.316 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 735518680 ZNIBWTDEOYLQGH-HXUWFJFHSA-N 432.542 2.305 10 20 IECD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)C1 740919533 ZXSGSLFYWNLBKB-OYRHEFFESA-N 439.604 2.395 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1N1CCNC1=O 742051553 WKKLQUGETUFPTE-UHFFFAOYSA-N 428.464 2.131 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4ccc(Cl)cc4)nn3)CC2)cc1 742919982 NJMWKUJURWYZDA-UHFFFAOYSA-N 440.935 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Oc3cccc(C=O)c3)CC2)cc1 746755235 WYVOSKCAPJHGIQ-KRWDZBQOSA-N 426.469 2.167 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)Nc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1 748867437 ZEYIDTSHOASPSW-UHFFFAOYSA-N 426.545 2.365 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)C1 750875980 XDIMIRNFSHWQGB-TZIWHRDSSA-N 437.606 2.322 10 20 IECD COc1cc(N2CCN(CC(=O)NCCc3c(F)cccc3F)CC2)cc(OC)c1OC 759886136 IKCSEXKYRHVLIO-UHFFFAOYSA-N 449.498 2.472 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H](C)CN1C 770165823 STEQFDKUGGEWTN-UONOGXRCSA-N 448.501 2.266 10 20 IECD Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc(Br)c1=O 774100168 CMVRDCXNWDMLHY-UHFFFAOYSA-N 433.306 2.003 10 20 IECD CCOc1ccc(NC(=O)CN2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)cc1 774911444 GPDMCUVKEVPBJI-UHFFFAOYSA-N 444.488 2.464 10 20 IECD O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 777458553 GGEZMDTZIQAJEM-HNNXBMFYSA-N 430.496 2.450 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)cc2)C1 778245581 JSVYFJPGNCYEHV-ZDUSSCGKSA-N 440.485 2.231 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-n4ccnc4O)c3)CC2)cc1 778248835 ZGEZPTBMUDFTRM-KTKRTIGZSA-N 447.495 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@@H](O)c3ccc(F)cc3)CC2)cc1 778389290 GCRRBYCNSDFWEI-INASZKQGSA-N 441.503 2.277 10 20 IECD Nc1ccc(N(C(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)C2CCCCC2)cc1 784059528 MBBXGTIXGHYBJL-UHFFFAOYSA-N 434.493 2.360 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCc4occc43)CC2)cc1 785528222 OQQUOVHUOVPUTA-NRFANRHFSA-N 440.544 2.110 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccccc3Cn3cccn3)CC2)cc1 785642685 YRFGMMHWGICYGA-UHFFFAOYSA-N 447.539 2.341 10 20 IECD CCn1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 789820355 PXWPZPPFDNPGBE-GJZGRUSLSA-N 445.539 2.205 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)C3CCCC3)cc2F)C[C@@H](C)O1 789828757 YIYOJJXMYWFXEV-CALCHBBNSA-N 434.556 2.046 10 20 IECD O=C(NCCN1CCCc2ccccc21)C(=O)NCc1ccc(N2CCSCC2)cc1 789855657 VMLIUIMNDHFDRR-UHFFFAOYSA-N 438.597 2.425 10 20 IECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803975617 JRBMMWILSICYHN-WIYYLYMNSA-N 437.540 2.467 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 806275535 KCVCOPDCHZLRLI-GFCCVEGCSA-N 425.967 2.185 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c4c(F)cc(F)cc4c3=O)cc2)C1 806539969 ZUSGSLBAVAHKNM-CQSZACIVSA-N 440.450 2.438 10 20 IECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2=O)cc1 807291219 UWKOTALFXJKGMU-QFIPXVFZSA-N 432.524 2.299 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN4c5ccccc5C[C@H]4C3)CC2)cc1 810050677 LLHWNUBBKZUNKF-BJKOFHAPSA-N 436.600 2.315 10 20 IECD COCc1nc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cs1 811945304 ASSLOSABKDHYSI-UHFFFAOYSA-N 436.534 2.347 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(C4CCC4)C[C@H](C)C3)CC2)cc1 813609199 BWEPAOJJANKNQK-FQEVSTJZSA-N 429.609 2.333 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)n1-c1ccccc1 915748591 KGESNLKXJCVBLV-UHFFFAOYSA-N 429.484 2.367 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 917832607 DDSNUADNDGIKQP-HNNXBMFYSA-N 441.444 2.443 10 20 IECD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 917929960 KWJUHXDQVAWDHJ-QGZVFWFLSA-N 446.529 2.392 10 20 IECD Cc1ccc(C)n1-c1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnn1C 919849689 BCAZDPLWCFUUPO-LJQANCHMSA-N 434.544 2.459 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccc(S(=O)(=O)C(F)F)cc2)c1 920637039 XGLXOUSVGGVFHO-UHFFFAOYSA-N 435.426 2.117 10 20 IECD CC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783220317 XKPXGHCYLUVZRN-MXHNLXGJSA-N 432.517 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1[C@H]2C=CS[C@H]21 1796934723 HCVWMHROGRVWRZ-VTYLBBACSA-N 436.537 2.293 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccncc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995596 GYKDENBOIWPWNC-VBKZILBWSA-N 437.431 2.055 10 20 IECD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)n1cccc1 1813311402 MQDYTSZORRURQT-KUDFPVQQSA-N 435.484 2.270 10 20 IECD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CCC1 1823497195 SJTCZAUNVHMPFJ-ZDUSSCGKSA-N 435.575 2.452 10 20 IECD Cn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823709107 ZBYBHFKDXURLOS-SNVBAGLBSA-N 447.904 2.481 10 20 IECD CO/C=C(\C)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199168 OARJCNOOKTUNFM-NKZAKNJKSA-N 445.497 2.436 10 20 IECD CC/C=C(\C)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828250497 UDYCVFZWQHOSRF-INJWIWPUSA-N 438.600 2.272 10 20 IECD CN(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1Cl 1845849521 PLFGYZUVPLUXKS-IBGZPJMESA-N 444.919 2.266 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])cc2F)CC1 730269532 ZKDZMLANTLIROY-UHFFFAOYSA-N 440.472 2.493 10 20 IECD CN(CC(=O)NCc1c(O)ccc2c1CCCC2)S(=O)(=O)c1cccc([N+](=O)[O-])c1 743717970 XKQMAFKFUKWGSQ-UHFFFAOYSA-N 433.486 2.116 10 20 IECD CS(=O)(=O)CC1(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 746835364 XILUQAPFMOTDOF-UHFFFAOYSA-N 434.480 2.373 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](c4nncn4C(C)C)C3)CC2)cc1 754072370 UISDCZHPNMTEJY-UNMCSNQZSA-N 442.608 2.230 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](C)S(=O)(=O)CC1 759986829 CZFYHAXEYGLZCO-GJZGRUSLSA-N 440.521 2.298 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)CCNS(=O)(=O)c1ccccc1 763322523 DSXKHHSJAZGSMQ-UHFFFAOYSA-N 439.603 2.271 10 20 IECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 768320320 FVQBEHQPDAVNAT-MRXNPFEDSA-N 434.514 2.170 10 20 IECD Cc1ccc(C(=O)OCC(=O)N(c2ccc(F)cc2)[C@@H]2C=CS(=O)(=O)C2)c(O)c1O 770005685 IKMVSPRCIZAKQY-OAHLLOKOSA-N 435.429 2.046 10 20 IECD COC(=O)c1cncc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 773598248 ADPHJGIIJMLYIK-UHFFFAOYSA-N 444.399 2.439 10 20 IECD COC(=O)[C@@H]1C[C@@H](C)CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 775805460 BYIDNSNESOXKLO-OPOADAIRSA-N 435.540 2.329 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 778235391 PZQYIZSJYHKFMR-KNQAVFIVSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 778288467 DOAZKMHTLAFOMJ-GHYICZDASA-N 437.540 2.310 10 20 IECD C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 778552606 PDELUFLHIFXWHN-INIZCTEOSA-N 425.533 2.318 10 20 IECD COCCCN(C(=O)/C=C\c1cnccc1C)c1c(O)nc(=O)n(Cc2ccccc2)c1N 783707741 RCEVLCMRLYPCSL-KTKRTIGZSA-N 449.511 2.366 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)cc2)C1 785538204 SYRPJYDETSDHSE-JVNHZCFISA-N 425.451 2.360 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)ccc21 788296245 HLPBQLUXKKCJBP-UHFFFAOYSA-N 444.576 2.449 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 788929031 FLHIUZOELNJIBT-UHFFFAOYSA-N 437.500 2.160 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nc(C)cs1 789833720 IWRDENWRVCJWEO-QGZVFWFLSA-N 434.537 2.435 10 20 IECD C[C@@H]1CCC[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793725699 RLTYBPIQFOQWJJ-GGPKGHCWSA-N 428.577 2.337 10 20 IECD CSCCONC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794187064 BRQLJFSLHRFMDH-UHFFFAOYSA-N 427.460 2.126 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1OC 794581436 IOLOXIGBBYPIRO-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665020 RSLOBSPXNUQJPM-FQEVSTJZSA-N 426.536 2.488 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H](SC)C3)cc2F)CC1 805007103 NJHPVIMWVMWAMY-SFHVURJKSA-N 436.597 2.328 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)nc1 807290781 OFEMTYHOAYQOKF-HXUWFJFHSA-N 447.539 2.260 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(Cn2cncn2)cc1 807385647 OMDNRNSCYJKDLH-UHFFFAOYSA-N 430.262 2.049 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)S1(=O)=O 811864539 CMTGVKLOHGPDSK-FPCVCCKLSA-N 427.542 2.156 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc2c(=O)n3ccccc3nc21 917708392 GZUSQWNMAMTAHV-UHFFFAOYSA-N 435.459 2.092 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1C 917758428 XNVBGQAWRGJBFX-UHFFFAOYSA-N 437.543 2.466 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 917759286 LZHHMACSYQVSNM-UHFFFAOYSA-N 434.514 2.148 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nc(-c4ccco4)oc3=O)cc2F)C[C@@H](C)O1 918699190 BBXAOQHGRREQEM-ZIAGYGMSSA-N 430.436 2.165 10 20 IECD Cn1c(=O)n(CCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc21 919971385 UFYSFKXMABRWKS-UHFFFAOYSA-N 426.492 2.147 10 20 IECD C[C@H](NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)c1ccc(N2CCOCC2)cc1 920882151 UBVWMLGTLQMGPU-HNNXBMFYSA-N 440.456 2.034 10 20 IECD CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1116450292 YRPYIDFMHHGXFQ-SFHVURJKSA-N 446.571 2.376 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 1319368312 IXQJNGBOHNTQDV-ZIAGYGMSSA-N 448.447 2.292 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1 1795686819 TUKDWEFLRNCQDL-QDMKHBRRSA-N 449.623 2.277 10 20 IECD CC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811797950 XNWHCMSWQFTGTD-OWQGQXMQSA-N 433.892 2.237 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn(C(F)F)n1 1819824310 GDBHTXGMBRLUEB-ZDUSSCGKSA-N 447.402 2.427 10 20 IECD O=C([C@@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248979 XYECXGRNQLCYLA-LSDHHAIUSA-N 429.423 2.392 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H](C)N3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 726502536 BCXSASBJKAZGCD-OWCLPIDISA-N 446.523 2.309 10 20 IECD CNC(=O)COc1cccc(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726609819 FQCUYXLTBMDEKC-UHFFFAOYSA-N 426.517 2.288 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2F)C[C@@H](C)O1 728746065 POIILLSWKXJHLS-XQTRSNPVSA-N 434.556 2.180 10 20 IECD Cc1cc(C(=O)CN2CCCN(C(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 728928348 SBNMGAIJBMZHPA-UHFFFAOYSA-N 432.590 2.340 10 20 IECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 732595108 MRFCZEQGKRNCKR-RBUKOAKNSA-N 438.528 2.461 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@H](C)N3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2)CC1 746237560 OVDLUVUQUSXHIE-FYIGHOIKSA-N 425.529 2.090 10 20 IECD CN(C[C@H]1CCOC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 749541379 BOAIXMCJDCIDGW-CYBMUJFWSA-N 435.458 2.210 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751240626 UTEKIABSXZKOBS-UHFFFAOYSA-N 436.505 2.300 10 20 IECD O=C(N[C@H](CCO)C1CCOCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 764397072 FKGXXQWRVBMXFH-MRXNPFEDSA-N 440.543 2.162 10 20 IECD O=S(=O)(c1ccc(F)cc1F)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768199160 CQIHXUSMMAUPIA-UHFFFAOYSA-N 437.512 2.308 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CCN3CCN(C)CC3)cc2F)C[C@@H](C)O1 770345647 QVLQUEFUAMIFFO-QRVBRYPASA-N 435.588 2.265 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1 771291919 YGUCPYZJCRVUPP-FQEVSTJZSA-N 446.573 2.219 10 20 IECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 772776211 OVJIRGXFWFASRE-WXGCRTCVSA-N 438.358 2.215 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCCCC3=O)cc2)CC1 775098544 ZEZGROJZYLNSIA-UHFFFAOYSA-N 428.577 2.448 10 20 IECD CCCCN1CCC(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778269945 WYZZHKBLEZMMSW-MDZDMXLPSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc(OC)cc3OC)CC2)cc1 779217362 FYJJUODAYSZRQM-NRFANRHFSA-N 429.561 2.327 10 20 IECD CCO[C@H]1C[C@@](CO)(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 780189136 WBYOOGIIEAIATD-URXFXBBRSA-N 448.608 2.073 10 20 IECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 787155846 GRJXJSKRAXQQPI-IRXDYDNUSA-N 443.519 2.423 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 787706968 PQNGIVUHKRGWEM-PMACEKPBSA-N 430.593 2.218 10 20 IECD COCCOc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 787994501 NDKRFTMZAKJTCJ-GOSISDBHSA-N 441.528 2.042 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@H](N2CCCC2)CC1 789856759 XYZAPIWWRYFWMO-FQEVSTJZSA-N 430.618 2.333 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N2CCOCC2)cc1 793739795 DOVXFDVGZNJZEL-HSZRJFAPSA-N 438.572 2.175 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(S(C)(=O)=O)CC3)cc2Cl)C1 799994499 BOWAPDGVMWDZHC-OAHLLOKOSA-N 428.986 2.363 10 20 IECD Cc1cc(C(=O)COC(=O)CS(=O)(=O)C(C)C)c(C)n1-c1ccc2c(c1)OCCO2 919603035 SBDUQXGHGLROHN-UHFFFAOYSA-N 435.498 2.414 10 20 IECD CCOCCO[C@H](C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919620400 GRGZYOKURHGYQH-CQSZACIVSA-N 425.437 2.385 10 20 IECD COCCN1C(=O)/C(=C/Nc2ccccc2C(=O)Nc2cccc(C)c2)C(=O)NC1=S 920978916 OLVTZIDOVKIUAS-GHRIWEEISA-N 438.509 2.433 10 20 IECD CC[C@@H](C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786405758 CXDLSTWFWHGWAC-FZKQIMNGSA-N 449.598 2.388 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1coc(Cl)n1 1805013890 MQCRWCIKPGLODW-SJKOYZFVSA-N 443.847 2.163 10 20 IECD COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817846144 IYPMWKTXECEAFG-MRXNPFEDSA-N 438.444 2.239 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 117528490 CQPHJLUEZPAXNW-UHFFFAOYSA-N 449.548 2.264 10 20 IECD CC(C)N(C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726235800 GXFPWDXZKCQSEW-UHFFFAOYSA-N 429.544 2.082 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)N2CCSCC2)c(C)n1-c1ccc(F)cc1 730550702 DWRNRYGNPAGPEY-UHFFFAOYSA-N 425.551 2.342 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1C 736329998 PVRQZGIDJPQUOB-SFHVURJKSA-N 444.557 2.134 10 20 IECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CCO1 737146462 PZYNKHDOJPNJFR-GOSISDBHSA-N 438.528 2.003 10 20 IECD COCCOCc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738902324 ZCQRZDFTWVVYGH-UHFFFAOYSA-N 447.557 2.406 10 20 IECD COCCn1cc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 742367879 MINVBGMQLQGVLE-UHFFFAOYSA-N 425.512 2.075 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(N4CCNC4=O)c(C)c3)CC2)cc1 742917239 UVFJKCRDNHXRRS-UHFFFAOYSA-N 437.544 2.085 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCCn3c(=O)oc4ccccc43)CC2)cc1 742927125 JISHZYAOKIHTQM-UHFFFAOYSA-N 438.528 2.322 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](S(=O)(=O)N(C)CCOC)C2)cc1 753400152 ZGWOTXSKIOOSSG-HXUWFJFHSA-N 440.610 2.115 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(Cn2ccnn2)CC1 753846966 UTRMOKYARMDNAE-UHFFFAOYSA-N 447.542 2.398 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccccc1O[C@@H]1CCOC1 760064488 JQCHGLLQIDIWMT-LJQANCHMSA-N 445.541 2.411 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccc(Cl)cn3)cc2)C1 760831105 KSPXCTAHWDJFBW-MRXNPFEDSA-N 431.924 2.315 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccc(-n4cnnn4)c3)cc2F)C[C@H](C)O1 768510797 FCIBCQQCXCROIG-HOTGVXAUSA-N 440.479 2.110 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772375166 QEXIMOCGMLZOCT-SFHVURJKSA-N 435.540 2.190 10 20 IECD CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 776118707 SMENNMKZSLHYLZ-LEWJYISDSA-N 435.540 2.248 10 20 IECD CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1cnn(C)c1 776338215 GTCWLYGTKXAXKP-HXUWFJFHSA-N 443.548 2.481 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCS(=O)(=O)c2ccccc21 792822824 XNJXWQAXSDKPPX-IBGZPJMESA-N 430.526 2.215 10 20 IECD CCC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCCC1 793734705 VXBMEKKIYAZFBU-IBGZPJMESA-N 428.577 2.481 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)c3cc(C)cc(C)c3)CC2)cc1 803753478 ZLSDCNPFKZKTBF-HXUWFJFHSA-N 438.572 2.428 10 20 IECD CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 804713625 ZBZJVOMSNUXQEJ-IBGZPJMESA-N 442.560 2.442 10 20 IECD CC(C)n1cc2c(n1)[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)CCC2 806301642 YTJKURQKXRYUOX-NRFANRHFSA-N 439.560 2.453 10 20 IECD O=C(Nc1cccc2c1CNC2=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 807009702 PFEKNGMWSPAMII-HNNXBMFYSA-N 442.903 2.008 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)[C@@H]1Oc1ccccc1 807097562 PPIRPRUXQVKZHA-VSKRKVRLSA-N 425.529 2.418 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1S(N)(=O)=O 807511808 WHPIDXLHLWDPJQ-UHFFFAOYSA-N 446.312 2.164 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCO[C@]4(CCOC4)C3)cc2Cl)C1 807954419 RDVRYAYYWBCONS-KSFYIVLOSA-N 435.952 2.210 10 20 IECD NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 810348860 XOIWGKHSGWQPGY-UHFFFAOYSA-N 446.454 2.285 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1F 810354403 VPZSMQCZPRJZQH-UHFFFAOYSA-N 447.438 2.437 10 20 IECD NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 813685547 KFKHXAQJJAYYKH-HNNXBMFYSA-N 440.283 2.486 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)cc2F)C[C@@H](C)O1 814327695 PVJDRDTUSIROPL-OKILXGFUSA-N 440.475 2.051 10 20 IECD CS(=O)(=O)C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 816891263 NGVXYVUIQRHQGV-IBGZPJMESA-N 434.533 2.231 10 20 IECD CCOc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918287613 QUNCSJMGUDAPTE-HUUCEWRRSA-N 430.480 2.488 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1 918306741 FPIHMILZMULHOA-UHFFFAOYSA-N 437.500 2.138 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccn(-c2ccccc2)n1 918764023 SIUVISDUWFZYBQ-UHFFFAOYSA-N 433.512 2.336 10 20 IECD CC(C)=CCCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1781125258 KYTMNOAUJCCWNG-WCYCAPIHSA-N 430.501 2.393 10 20 IECD Cc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c1 1785041006 BTKDCJCXHDROPB-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(Cc1ccc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1795152666 DBRWXZJKWIFXTP-IRJINJETSA-N 447.491 2.092 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccccc1=O 1800718268 SCVHAUZNMLVYJS-HNKHHVNMSA-N 445.903 2.426 10 20 IECD CCc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1805330197 CGJXAVGKQCVRND-AOMKIAJQSA-N 447.495 2.479 10 20 IECD CCc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1807994924 LRRJLTWYBWHKSI-JLTOFOAXSA-N 437.456 2.072 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807996133 YRDWHYNNETZAGU-AKCHCHLHSA-N 428.489 2.021 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccncc1F 1808883649 JVCCNRNZISQJPL-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1c(F)cncc1F)CC2)c1cc(O)nc(O)c1 1816724964 FGQMEZUWZDMVKN-VIFPVBQESA-N 447.423 2.162 10 20 IECD CC1(C)CC(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)C1 1834988088 CRANTNZOOQTMJZ-UHFFFAOYSA-N 430.549 2.114 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H](O)Cc2ccccc2)C1 1846066934 NOHBBHNLPHLZGB-GOSISDBHSA-N 430.888 2.172 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nn1C(F)F 1847038838 RMFXECFYTCGTBQ-GQCTYLIASA-N 448.426 2.234 10 20 IECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc1 301284094 YTLRDOZGZGAZTE-UHFFFAOYSA-N 430.452 2.457 10 20 IECD CC(C)C(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 726234676 JDTGVBDMHPMLRE-UXHICEINSA-N 443.592 2.082 10 20 IECD CCc1noc2ncc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc12 728101330 MSRDETDEOKQSQG-UHFFFAOYSA-N 442.447 2.234 10 20 IECD O=C(CSc1ccccc1C(=O)N1CCS(=O)(=O)CC1)Nc1ccc2c(c1)OCO2 728717776 XSQNYRZGVIIFRW-UHFFFAOYSA-N 448.522 2.017 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 733342304 JAYULIVCXVZSBP-HUUCEWRRSA-N 429.558 2.452 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c2)n[nH]1 737130665 GROJMFKEEWMQLG-UHFFFAOYSA-N 448.527 2.244 10 20 IECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)cc1 739922926 RKXVLZMNUVJKAI-QFIPXVFZSA-N 426.473 2.029 10 20 IECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 741087368 WPHJMBUWXJYQMK-QFIPXVFZSA-N 430.512 2.402 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 741411583 NRDLGNMVXVVZMQ-HXUWFJFHSA-N 426.561 2.410 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 743955017 FVKIQIDJKWEPOH-UHFFFAOYSA-N 435.480 2.175 10 20 IECD COCCN(CC(=O)N1Cc2ccccc2C[C@H]1C(=O)OC)c1ccc(OC)c(OC)c1 749352617 LIPATGSOQXCTJP-FQEVSTJZSA-N 442.512 2.283 10 20 IECD COCCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 751011121 MWIWNCCJTMNEOW-UHFFFAOYSA-N 445.491 2.333 10 20 IECD CC1([C@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)OCCO1 753121961 PGIDZEGDQNLSTL-MOPGFXCFSA-N 430.549 2.073 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1 753635700 HROWTICRNQQCNE-HRCADAONSA-N 448.541 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(OC)c(OC)cc3F)CC2)cc1F 754213247 PWHCUBPCIUPFFF-UHFFFAOYSA-N 435.427 2.278 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCCCSc3nccs3)cn2)C[C@@H](C)O1 758618039 JENDUHKQEFGQHT-OKILXGFUSA-N 438.579 2.279 10 20 IECD COC(=O)CN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CCCC1 761953075 HSDMACIJHDHFIZ-UHFFFAOYSA-N 447.557 2.342 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCc1ccc(F)cn1 764356170 FNHSYSBQKNSIRB-UHFFFAOYSA-N 439.470 2.476 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1ccc(F)nc1 766324281 CPILQWPOBQYSCZ-UHFFFAOYSA-N 426.370 2.331 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1Cl 771217158 XLOMYSMWNCJRNR-NSHDSACASA-N 436.848 2.422 10 20 IECD CN1CCN(c2ccc([C@H]3NC(=N)Nc4nc5cc6c(cc5n43)OCCCO6)cc2)CC1 771520297 IUUCCBQKKHPGFQ-NRFANRHFSA-N 433.516 2.446 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)cc2)CC1 786120154 JGOPGHZTJMRSSJ-UHFFFAOYSA-N 432.502 2.050 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 789822352 WCYUXZOXBVDCAZ-CALCHBBNSA-N 448.583 2.435 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCC[C@H](N2CCCC2)C1 789864165 MOTNDSNHRNLSDF-NRFANRHFSA-N 430.618 2.333 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCOc2cccc(F)c2C1)c1ccc(N2CCOCC2)cc1 803302495 PZQIDFNBAKEJNP-MRXNPFEDSA-N 427.476 2.261 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CCCC2)CC1 803661699 KHDMJZQWBPLLSS-UHFFFAOYSA-N 434.556 2.048 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 806843097 LMQZXIZXSTURNF-UHFFFAOYSA-N 442.491 2.009 10 20 IECD CC(C)CN1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807769537 HFRCFWYAGHFNNW-KRWDZBQOSA-N 438.519 2.173 10 20 IECD O=C(NCc1cccc(N2CCOCC2)c1)NCc1ccc(N2CCOCC2)c(F)c1 814363467 MRYOVBKCVILNRX-UHFFFAOYSA-N 428.508 2.498 10 20 IECD CCNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918122070 KAHOUPMQUSGBCQ-HXUWFJFHSA-N 437.544 2.137 10 20 IECD COCCOc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918310575 MRKHOFYHPAITLJ-UHFFFAOYSA-N 427.501 2.146 10 20 IECD CCOC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918777210 GBALNKFYTCSWHF-UHFFFAOYSA-N 431.514 2.420 10 20 IECD COc1ccc(Br)c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 919817353 RLFPGBZDXFOHOB-UHFFFAOYSA-N 429.292 2.465 10 20 IECD CN(C)C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 920195515 NIOOZYNMPNSETO-UHFFFAOYSA-N 444.919 2.133 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O 1342915630 JIIXTYAZDWTKAQ-IRXDYDNUSA-N 446.887 2.395 10 20 IECD Cn1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c1=O 1793786635 RTRUSWLDGSEVIP-BTTYYORXSA-N 431.876 2.016 10 20 IECD Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807989767 CMDBCPOSSHSOEH-KKSFZXQISA-N 433.468 2.225 10 20 IECD Cc1cc[nH]c1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837299261 UBSBNFRZNNQTMC-UHFFFAOYSA-N 428.489 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3c[nH]nc3c2)C1 1843268571 FEMVBHPOEKHYNF-FNORWQNLSA-N 434.452 2.210 10 20 IECD O=C(CCc1ccccn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441248 HFSWNHVZZXRMKC-UHFFFAOYSA-N 431.496 2.011 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3ncoc3c2)C1 1843791581 DAGUGPCUZQEOIQ-UHFFFAOYSA-N 443.463 2.438 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc3cn[nH]c3cn2)C1 1844155070 ZTMMPGWUEYKNOW-UHFFFAOYSA-N 427.848 2.153 10 20 IECD O=C(c1csc2c1CCCC2)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056332 KUEJPGYKTSAYSO-UHFFFAOYSA-N 449.623 2.304 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)n(C)c2ccccc12 576811462 GHRRXLATBSJMTA-SCTDSRPQSA-N 426.561 2.203 10 20 IECD Cc1ccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1F 727978163 ICLNJIMWZZMQRI-UHFFFAOYSA-N 437.566 2.384 10 20 IECD CCC[C@@](C)(O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732886198 ULVPUYXMYWXNIL-JOCHJYFZSA-N 430.528 2.293 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c([N+](=O)[O-])cc1OCC 734072667 MTANQHBVZZVNJJ-UHFFFAOYSA-N 433.417 2.361 10 20 IECD CS(=O)(=O)NCc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 735577992 VETBYAWSWBIQKT-UHFFFAOYSA-N 446.573 2.266 10 20 IECD O=C(CN1CC[C@H](CN2CCOCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 741809203 QYFBWWGUPBJMCZ-QGZVFWFLSA-N 433.508 2.055 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N(CCS(C)(=O)=O)C3CC3)cc2F)C[C@@H](C)O1 753572330 NIMJVWMJRVVVDI-HUUCEWRRSA-N 427.542 2.158 10 20 IECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 755207118 TUXIZDIGQWWCQS-UHFFFAOYSA-N 434.500 2.057 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC)c(Cl)c3)C2=O)cc1 757857109 KIXKHMOUEUCSCX-OAQYLSRUSA-N 446.891 2.292 10 20 IECD CN1CCc2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2C1=O 761724348 OVIAOFPDPIBFQB-SFHVURJKSA-N 435.528 2.338 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnn(CC(F)(F)F)c3)CC2)cc1 762428568 ZBFPOYMSAUGVAT-UHFFFAOYSA-N 425.411 2.131 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)nc2)c(C)n1-c1cccc(F)c1 762877031 XIACGEXPBUUURQ-UHFFFAOYSA-N 431.445 2.315 10 20 IECD CCc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768447049 LRNJQECXGVESEI-IERDGZPVSA-N 426.513 2.492 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4nc(C)cn4c3)cc2F)CC1 774221106 QKHNFQXAURRWBN-UHFFFAOYSA-N 438.507 2.179 10 20 IECD COc1ncc(/C=C/C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)cn1 776306725 OAIPTDRJUKAOLP-RMKNXTFCSA-N 428.514 2.262 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC[C@@H](OCCO)C1 780306916 UUOHKOLTAVHMPA-QGZVFWFLSA-N 431.455 2.225 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(F)c1 784765581 AYBQWWHMLOGVJT-HNNXBMFYSA-N 448.882 2.003 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1O 787303563 HURAOWITXYXDRX-HNNXBMFYSA-N 449.454 2.404 10 20 IECD Cn1ncc2c1CCC[C@@H]2NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789595655 LHHGEQOEFQIQEX-KDOFPFPSSA-N 447.486 2.300 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(Br)c2)cc1 797431280 KZKVHCCPGPDZIH-UHFFFAOYSA-N 434.337 2.434 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cc(S(N)(=O)=O)cn3)cc2Cl)C1 800570621 AZOREFARPKHSCB-CQSZACIVSA-N 439.969 2.127 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nccn1-c1ccccc1 801758733 SCIJNNOXMANQPK-UHFFFAOYSA-N 425.514 2.429 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)CC2)cc1 804315284 JQDCCDWQZIERGW-GOTSBHOMSA-N 436.556 2.342 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3nc(C4CC4)cs3)CC2)cc(OC)c1OC 806971473 NNZMFCRQRFYJMK-UHFFFAOYSA-N 446.529 2.334 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 807771573 VXYGRNLRNKEYHI-JTDSTZFVSA-N 437.487 2.447 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 807912803 PAUACOCTTOIRJC-GOSISDBHSA-N 427.524 2.419 10 20 IECD CC(=O)C(=O)COC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 808543166 BOWMIVAWDTUAOV-UHFFFAOYSA-N 440.817 2.364 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN4c5ccccc5C[C@@H]4C3)CC2)cc1 810050679 LLHWNUBBKZUNKF-RPWUZVMVSA-N 436.600 2.315 10 20 IECD CN1CCN(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 914445151 IGLXZBRRKNVOEL-JQIJEIRASA-N 438.644 2.093 10 20 IECD CN(CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)CC(=O)N[C@@H]1CCS(=O)(=O)C1 917107149 WAVQORAVXQZXKP-LJQANCHMSA-N 443.529 2.276 10 20 IECD Cc1occc1C(=O)NCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 917381032 SDSZTTXRZIGMHK-UHFFFAOYSA-N 425.407 2.490 10 20 IECD CCNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918117862 RISMEAFECNFTNU-HXUWFJFHSA-N 437.544 2.137 10 20 IECD O[C@H](CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)COc1ccccc1 920091980 AWCPYHXBBLUHHK-HXUWFJFHSA-N 437.519 2.472 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1 920189754 ZQXYBNURFGJLGA-UHFFFAOYSA-N 437.588 2.487 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccccc3OC)CC2)cc1 920254607 LIGCUYNUCVOHSX-VAWYXSNFSA-N 439.512 2.104 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 1116510314 RJBFRMRQOHBTHU-VQTJNVASSA-N 427.526 2.438 10 20 IECD CC(C)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n[nH]1 1780295976 CMGATYTURJXHFW-NRFANRHFSA-N 448.907 2.355 10 20 IECD CC(C)C1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCC1 1785510563 PRGUDIXZZBOZTQ-NKOINVLESA-N 444.528 2.473 10 20 IECD O=C(Cc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795250334 WWNQXRQSZAYOSV-YVWYUNDQSA-N 448.878 2.336 10 20 IECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)=Cc2ccccc2N1 1799126525 CRTHQTXOIFVLAI-BCDXTJNWSA-N 448.479 2.170 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc2nn[nH]c2c1 1804289742 RIFSWWZBMMLNFT-AKNOBNDCSA-N 449.467 2.040 10 20 IECD O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804588250 SNQRKCLDWHVYSE-OPAMFIHVSA-N 436.468 2.433 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990388 HBWWZEFFFKUEBX-QVKFZJNVSA-N 434.452 2.227 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cncc(F)c1)CC2)c1cc(O)nc(O)c1 1816722649 TUUUOAVYMQOHAS-LBPRGKRZSA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817843542 QUXCOOABYSMZFS-GOEBONIOSA-N 429.477 2.481 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1825895134 YELWPJWHKJMNRQ-SFHVURJKSA-N 427.505 2.082 10 20 IECD COc1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847037415 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COC(=O)c1ccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)o1 1339208595 DNPVSYHQTTWOLU-UHFFFAOYSA-N 426.429 2.016 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccn2)cc1 1794645499 OROYTRGFIOWZFP-JHDGKUDLSA-N 445.523 2.401 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc(O)n1 1796819310 AFUYSIVGDDVVIQ-GGPHIMKMSA-N 447.495 2.140 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccccc1 1802211555 SKUMVKFGSDQVKX-ADHGMGHFSA-N 443.594 2.289 10 20 IECD COc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427031 MYSFTXWEPQMZCW-GOSISDBHSA-N 440.500 2.444 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429052 ODPDQSKCWZNXLT-DNVCBOLYSA-N 441.532 2.492 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1 1831682868 ZWMYAOSQSLJHOO-YRXWBPOGSA-N 429.517 2.294 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832845826 MRHWXRSNHHVQHF-RBUKOAKNSA-N 446.548 2.031 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)o3)CC2)CC1)c1cc(O)nc(O)c1 1834987612 POZDGAHEXGZQIN-UHFFFAOYSA-N 448.907 2.238 10 20 IECD CC1=CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1 1834987692 WMWGCEHKZISFDA-KRWDZBQOSA-N 442.560 2.424 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc(S(N)(=O)=O)cn2C)c(C)n1-c1cccc(F)c1 26267942 UCMRECXXWLPXOV-UHFFFAOYSA-N 433.461 2.259 10 20 IECD CCOC(=O)c1sc2ncn(CC(=O)NCc3ccc(N(C)C)cc3)c(=O)c2c1C 27317819 LYTDCECPJAKUIO-UHFFFAOYSA-N 428.514 2.326 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](C4OCCO4)C3)CC2)cc1 729587067 NHUWBJGEUOYDBA-LJQANCHMSA-N 432.565 2.002 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2cc(Br)ccc2O)c1 730017762 MKRCTDWLYDSAIU-LLVKDONJSA-N 442.335 2.180 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3cc(OC)ccc3O)CC2)cc1 734014946 NVXBSNZEGQIZOV-UHFFFAOYSA-N 434.514 2.127 10 20 IECD CN(C)C(=O)Cn1ccc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 743136644 NUILNYASBGPIIZ-CQSZACIVSA-N 436.463 2.363 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 747402361 AVSJBWWVIZKRQC-XXBNENTESA-N 426.561 2.109 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 749553597 JBSRDDXABJFUTA-GGPKGHCWSA-N 434.556 2.303 10 20 IECD COc1cc(N2CCN([C@H]3CC(=O)N(c4ccccc4F)C3=O)CC2)cc(OC)c1OC 758820175 MXXSQOOQBADPLR-SFHVURJKSA-N 443.475 2.306 10 20 IECD CS(=O)(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 768013887 ZFJHTXFMCWWZEN-UHFFFAOYSA-N 449.598 2.423 10 20 IECD O=S(=O)(c1ccc(Cl)s1)N1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768445299 RHOREOKORTURJB-HNNXBMFYSA-N 444.962 2.430 10 20 IECD COc1ccccc1NC(=O)CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 769528535 RIVZWWBDCOGZAJ-UHFFFAOYSA-N 442.535 2.427 10 20 IECD C[C@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1cccc(S(=O)(=O)N(C)C)c1 775334538 ODXJVZXIJYJNMZ-KRWDZBQOSA-N 432.590 2.312 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCCCC4)O3)cc2)C1 775758281 BLIZWTLXLRJCSO-UYAOXDASSA-N 430.549 2.263 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778301460 IQHJROZJTKDYBH-IWGBCORSSA-N 437.540 2.274 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)cc1 778394768 BTNMJCMUTWTXTC-RGPPVUSESA-N 434.540 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)Cc3ccccc3Cl)CC2)cc1 785730208 NQMBPJCYVCSKQB-HXUWFJFHSA-N 432.904 2.144 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cs1 786497237 NGBRRGXOHYGHTN-ZIAGYGMSSA-N 434.537 2.179 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1F 786650997 QXZUZIFYDVLGCK-UHFFFAOYSA-N 444.507 2.302 10 20 IECD C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787323846 ZVRSCWXAEWEOJC-GOSISDBHSA-N 432.524 2.487 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 787736818 MEVHFSALMUDCNF-QFIPXVFZSA-N 432.524 2.159 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1 788955459 WMKTVUXJBXSQEU-HSZRJFAPSA-N 438.572 2.032 10 20 IECD CCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 789799121 JDHXWTXGPXZQBX-UHFFFAOYSA-N 433.455 2.133 10 20 IECD Cc1cc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 789845951 XLBLJTYJUQAISK-HXUWFJFHSA-N 430.480 2.063 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1CC(F)F 789861593 QFFGTECWPCBMOL-QGZVFWFLSA-N 440.560 2.044 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@@]4(CCO[C@H]4C)C3)CC2)cc1 790643036 LKDFNDFRMDRBGZ-SKPFHBQLSA-N 446.592 2.185 10 20 IECD C[C@@H]1CCC[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793725703 RLTYBPIQFOQWJJ-QWFCFKBJSA-N 428.577 2.337 10 20 IECD C[C@@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793728373 YHGBNUMMHOOHMK-XLIONFOSSA-N 434.540 2.150 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1F 796734969 XNTJSMWYKXJUCU-CYBMUJFWSA-N 447.438 2.404 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCOc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803310598 MBEQOMXCCVAYNC-QGZVFWFLSA-N 429.492 2.425 10 20 IECD CC[C@@]1(C)CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451345 KNMOEZSCLIBIQB-NRFANRHFSA-N 425.476 2.401 10 20 IECD O=C(NCc1nccn1C(F)F)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 803800473 ZKGOWNILSMZSGK-LBPRGKRZSA-N 443.401 2.281 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCC2([S@@](C)=O)CCC2)cc1 809895423 RQRVDVNJRHDHDU-SSEXGKCCSA-N 431.558 2.292 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCNC4=O)cc2F)C[C@@H](C)O1 809982148 JSTQESPJEOTXIU-IYBDPMFKSA-N 441.503 2.420 10 20 IECD CC(C)Oc1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(N)=O 811767666 MGZACBYYJBRJCU-UHFFFAOYSA-N 444.507 2.277 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1[N+](=O)[O-])NCc1cc(Cl)cc(Cl)c1O 813685002 AGULZEMWOWBDIP-UHFFFAOYSA-N 434.257 2.202 10 20 IECD Cc1cc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)n([C@H]2CCS(=O)(=O)C2)n1 917075191 SCLDWZGDBCNDOG-FQEVSTJZSA-N 447.605 2.466 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC(=O)Nc3ccc(F)c(F)c3)cc2)C1 918117444 KUTIGQLDPFZBLH-HNNXBMFYSA-N 445.470 2.104 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)Cc3ccccc3)cc2)C1 920222470 UTVPOEOMTJMEHW-GGAORHGYSA-N 448.567 2.238 10 20 IECD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(Cl)cc1 1792735232 GPQHAHGSFSMPRB-ZIKOISBGSA-N 445.903 2.153 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1sccc1F 1793560000 GFUAHZZHACWORY-QHBPRCKVSA-N 440.880 2.469 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2CCNC2=N)cc1 1796025591 ZSHANQNCJWYSDU-QQFNCUIESA-N 448.571 2.186 10 20 IECD O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804588247 SNQRKCLDWHVYSE-AOMKIAJQSA-N 436.468 2.433 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncon2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821291845 HEZOQXIVNLPBGV-GFCCVEGCSA-N 432.824 2.477 10 20 IECD Cc1nccn1[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822879134 DQVGOOLYNKJNNM-MLGOLLRUSA-N 439.476 2.288 10 20 IECD CNC(=O)COc1ccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1OC 108852227 DCKHEINLYWTTGI-UHFFFAOYSA-N 427.501 2.181 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccccc1OCC(=O)N1CCOCC1 541094637 RHVZYTFQEVTQNZ-UHFFFAOYSA-N 440.500 2.421 10 20 IECD CC[C@H](OC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(N)=O 726996201 FWXHROYWOSKWDZ-WBOGTDJTSA-N 443.344 2.457 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)c2)CC1 739768980 YQNLFXJRUUXRBQ-UHFFFAOYSA-N 426.429 2.320 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nc21 742801577 RBIMDBRTBYBMSK-CYBMUJFWSA-N 446.458 2.388 10 20 IECD COCCNC(=O)CN1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 745783842 FILKXKHSTVCHSN-UHFFFAOYSA-N 445.608 2.045 10 20 IECD CC(C)OCCN1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 746494455 HOGLPOFSBKFPCD-UHFFFAOYSA-N 435.524 2.443 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751294233 LCPQFVSKKRHHEU-LJQANCHMSA-N 432.542 2.441 10 20 IECD NC(=O)c1ccc(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 753492050 OQVXWDCTOQFXOT-UHFFFAOYSA-N 442.427 2.285 10 20 IECD Cc1cc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n2)ccc1F 753977606 GQJYRQNGTCCYRD-UHFFFAOYSA-N 447.473 2.406 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 755125326 BYVOXZMEFSWPEZ-UHFFFAOYSA-N 434.484 2.400 10 20 IECD CCc1cc2c(=O)n(C[C@@H](O)CN3CCN(c4ccc(OC)cc4)CC3)cnc2s1 758196014 CSTGMDXKZYHZBE-KRWDZBQOSA-N 428.558 2.212 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)N1CC[C@@H](CO)C1 759700605 DDELZWRPGIGPNT-CWZJEYLYSA-N 441.372 2.491 10 20 IECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 772776203 OVJIRGXFWFASRE-KFEJWOFMSA-N 438.358 2.215 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(CN4CCN(C)CC4)c3)c2)CC1 781270262 HTEKRVPFCSJJRX-UHFFFAOYSA-N 435.572 2.355 10 20 IECD CN(C)CCn1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 782423757 KAKLHRNBDDBPLX-UHFFFAOYSA-N 438.532 2.271 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1 787849638 BTVLTHDQRNLYTQ-UHFFFAOYSA-N 437.588 2.006 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 788309766 HDWBYQRJKZXTMI-UHFFFAOYSA-N 445.523 2.332 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](c2ccc(F)cc2)O1 788324876 ZBSICTFNZLUCPL-VGSWGCGISA-N 441.503 2.267 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 789369668 ACCNWOBPXYFVQM-QFBILLFUSA-N 428.489 2.124 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC([C@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 789824548 IUPSUGPYDAUNEL-HYFFOGBASA-N 447.551 2.473 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC2(CCCC2)O1 789844456 HZMCVXSQYKLWFD-UHFFFAOYSA-N 447.551 2.353 10 20 IECD Cc1nnc([C@@H](C)NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 803448629 DELSDWALJHOMKV-LLVKDONJSA-N 439.488 2.410 10 20 IECD CC[C@@H](CN1CCCC1)NC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 806330263 LNMBPQCVSCXPGE-INIZCTEOSA-N 426.355 2.494 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](c2nc(O)n[nH]2)C1 808777828 XADIPXVSKOTUEG-KBPBESRZSA-N 445.479 2.492 10 20 IECD CNC(=O)c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 917228092 XOYQUJFKMDWVHZ-HOTGVXAUSA-N 429.492 2.494 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(C(=O)N2CCCCC2)CC1 918220310 APPMQOXNUWDJJG-UHFFFAOYSA-N 447.555 2.220 10 20 IECD COc1cccc(CO[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337850 PNLBZHYYBGSMEP-KRWDZBQOSA-N 432.542 2.152 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 918632664 ARBFRWWWECGTJS-JZXOWHBKSA-N 441.569 2.117 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(-c4ccco4)oc3=O)cc2F)C[C@H](C)O1 918699188 BBXAOQHGRREQEM-KBPBESRZSA-N 430.436 2.165 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3cc(-n4cnnn4)ccc3Cl)CC2)cc1 1336436150 UFMKQYUJMQDIMC-UHFFFAOYSA-N 441.923 2.475 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)CN3CCCC3)CCC2)cc1 1792314436 BQBITAJILQRXBE-UHFFFAOYSA-N 446.598 2.077 10 20 IECD O=C(/C=C/c1cccnc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804634920 LJHRHAWVDPGVPW-UEFYJELNSA-N 445.479 2.316 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992817 DJXKBAHFQOMDJR-KSFYIVLOSA-N 435.484 2.168 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnccc1F 1817732820 KSYJWJNLFGEDOY-HNNXBMFYSA-N 426.408 2.370 10 20 IECD Cc1cc(C)n(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844163 RYBFNYKBCSBXBX-MRXNPFEDSA-N 439.476 2.035 10 20 IECD CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827428268 LNLSEZQYCRDUEX-LJQANCHMSA-N 441.532 2.336 10 20 IECD CC/C=C(\C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840631519 IFHVGYNLGZHNKI-JTJFFURRSA-N 438.908 2.178 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2CNc3ccccc32)C1 1842937671 PIPRDEQSBZDKKG-UGAXZCSASA-N 435.480 2.229 10 20 IECD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250260 CNOCSLUGNKMOHX-UHFFFAOYSA-N 441.875 2.082 10 20 IECD O=C(c1snnc1C1CC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039039 LYMYARMQKCIRDB-FNORWQNLSA-N 442.497 2.063 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCCCSc3nccs3)cc2)[nH]1 733973965 ATLAHLTXAJWJEJ-UHFFFAOYSA-N 432.527 2.250 10 20 IECD O=C(CNC(=O)NCc1ccc(F)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 735828350 PXDFZARZAVTYKK-UHFFFAOYSA-N 428.508 2.150 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742800265 PVHSQCWTCQAPRU-MRXNPFEDSA-N 439.484 2.475 10 20 IECD CCN1CCCC[C@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 745084961 XEDBOAWVHDUJHH-FQEVSTJZSA-N 447.557 2.342 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3noc(-c4cccc(F)c4)n3)CC2)cc1 746174024 ISQYEKKOGHWISR-UHFFFAOYSA-N 425.464 2.436 10 20 IECD COc1ccc(N2CCN(C(=O)c3cnn(CC(=O)NC4CCCCC4)c3)CC2)cc1 746580220 RJRPQYGGTVGXEX-UHFFFAOYSA-N 425.533 2.303 10 20 IECD Cc1cc(C(=O)CN(CCO)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 746601341 BCLNNBRMZRNKDR-UHFFFAOYSA-N 427.526 2.423 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1csc(-c2ccccn2)n1 747209624 PYORAJBVUZQSJU-UHFFFAOYSA-N 428.539 2.370 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C4CCOCC4)CC3)cc2F)C[C@@H](C)O1 747496198 TVHKSAMFCWXGDG-HDICACEKSA-N 434.556 2.446 10 20 IECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC(F)F)cc3)C2=O)cc1 748198613 BYVGQPRULMDJSU-JOCHJYFZSA-N 446.454 2.437 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](c1ccccc1)N1CCOCC1 749131848 NJMGFYFJBHYDHA-GBXCKJPGSA-N 443.613 2.473 10 20 IECD O=C(CN1CCN(C[C@@H]2CCOC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 749852884 QIRUFTAOTQWGAC-KRWDZBQOSA-N 433.508 2.055 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Br)cc3N)nc12 751774736 AGDQTCVNMCAKMA-UHFFFAOYSA-N 435.234 2.313 10 20 IECD CCOC(=O)c1ccsc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754214118 YWHLTJYMMGPMCT-UHFFFAOYSA-N 435.477 2.360 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)C[C@@H](O)c1ccccc1 754569801 LZBKPGFUXAQFMU-XMSQKQJNSA-N 431.508 2.071 10 20 IECD CCOC(=O)c1sc([C@@H](C)NCc2cc(O)n3ncc(C(=O)OCC)c3n2)nc1C 755024133 YDKWSUZJQNPLED-LLVKDONJSA-N 433.490 2.404 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCCc4c3cnn4C)CC2)cc(OC)c1OC 759222583 UXCMRMUMJIKEQE-KRWDZBQOSA-N 429.521 2.355 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H](O)C(F)(F)F)CC3)cc2)C1 766880053 IVJXNPAYUMHSMH-AEFFLSMTSA-N 442.482 2.233 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773201326 VLKWAZFUOZANNE-MRXNPFEDSA-N 434.562 2.238 10 20 IECD COc1cc(N2CCN(CN3C(=O)N[C@@](C)(C(C)(C)C)C3=O)CC2)cc(OC)c1OC 773322902 SUKXIKFWYHMNDU-JOCHJYFZSA-N 434.537 2.149 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](c3ccccc3)C3CC3)cc2)C1 774388252 LWDFEJSNVZRGGG-RBBKRZOGSA-N 434.540 2.272 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 778236283 WUGDHXQLORCORK-ZBTGYSDGSA-N 449.511 2.359 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 778326417 PEHGWFQCAODQTF-GJCOWUBNSA-N 445.560 2.383 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc2c1OCCC2=O 780045659 BOQTUKJEBYUBID-UHFFFAOYSA-N 441.459 2.007 10 20 IECD Cc1cc(C(=O)CN2CCC(CCCO)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782542941 VKPCOCXCMZNDPL-UHFFFAOYSA-N 433.574 2.409 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1 785421091 AWSJBFFAKPFXHC-UHFFFAOYSA-N 430.549 2.442 10 20 IECD COc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 786763512 WPVYCVYESFATKH-HNNXBMFYSA-N 429.492 2.289 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cn1cccn1 790218465 YMZLUGCWQIAXHP-HOTGVXAUSA-N 435.475 2.022 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NC3CC(NS(C)(=O)=O)C3)cc2Cl)C1 801061025 ABIFSVCGOBXLAP-JEYLPNPQSA-N 428.986 2.456 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297835 HRNVDYPIZHXIHV-YWZLYKJASA-N 425.533 2.404 10 20 IECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 804082890 FUJBQTJJNSMLFY-FQEVSTJZSA-N 434.540 2.330 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@@]4(CCc5ccccc54)C3)CC2)cc1 804317566 HTCFAOQHLAFVDV-SANMLTNESA-N 449.551 2.481 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N3CCCC3)CCOCC2)cc1F 804735626 BMFVZNLDPOYIAP-UHFFFAOYSA-N 434.556 2.049 10 20 IECD O=C(CN1CCC[C@@H](c2nc(O)n[nH]2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808777513 PFZVLPDLKDSUER-CYBMUJFWSA-N 431.452 2.104 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)O[C@](C)(c4ccccc4)C3=O)CC2)cc1 809210189 SBPYFZSEVCWICD-GBXCKJPGSA-N 439.512 2.072 10 20 IECD CC(C)OCc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)ccc1O 811704718 FPPNJYYJGSYQBI-UHFFFAOYSA-N 428.532 2.368 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC3(SC)CCN(C)CC3)CC2)cc1 811942663 BQVYWVOYTMMLPN-UHFFFAOYSA-N 449.665 2.334 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 813589476 AEOKHZLMCZBJAW-IYBDPMFKSA-N 441.569 2.406 10 20 IECD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 912557498 BTYOSSBFHUGEQX-UHFFFAOYSA-N 433.471 2.005 10 20 IECD O=C(COC(=O)CC1CC1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 914952025 YZXQAOHMHOCNSV-LZYBPNLTSA-N 448.522 2.076 10 20 IECD COc1cc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1OCC(N)=O 918080068 UQWSJFJVYSJFAS-UHFFFAOYSA-N 426.517 2.500 10 20 IECD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968341 FHMDZOAIVMGEMF-OYRHEFFESA-N 427.545 2.077 10 20 IECD COc1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 920194067 OIVOEYOQKRGEKP-OAHLLOKOSA-N 444.919 2.305 10 20 IECD CN1CCC2(CC1)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1O2 920972372 FLHLLAFZNBATPW-SFHVURJKSA-N 445.541 2.482 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1 1319368307 IXQJNGBOHNTQDV-KBPBESRZSA-N 448.447 2.292 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc4c(cc3Cl)NC(=O)C4)CC2)cc1 1323408283 ZBHFJGJQQNNJOY-UHFFFAOYSA-N 428.920 2.395 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1c(C)nc(SC)nc1C 1342435986 YRYMLKRUOCPDEX-INIZCTEOSA-N 433.530 2.450 10 20 IECD O=C(CCc1ccoc1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784682282 KDXLMYBDWRLDCE-NRFANRHFSA-N 434.876 2.421 10 20 IECD Cc1cscc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505548 LCMVQUMTEGFLTO-YXMLYAQVSA-N 444.509 2.330 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccccc1=O 1798606500 BSIPFEODILYPIF-DMRZNYOFSA-N 445.903 2.426 10 20 IECD O=C(CCc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285664 MRSJJCCBJKTZCE-BZBLDOMBSA-N 437.496 2.483 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993255 TWSUEILZUFGKDA-FZKQIMNGSA-N 432.427 2.253 10 20 IECD Cn1cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1825763544 LTRGSKQGVASRQD-INIZCTEOSA-N 448.614 2.119 10 20 IECD C[C@@H](NC=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830330932 FNHNSKPJXGYDKY-CXAGYDPISA-N 437.924 2.119 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 732213206 ZDYPBXUXDNLANH-WSTZPKSXSA-N 446.567 2.142 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3ccc(C)c(C(N)=O)c3)ccc21 732619113 LYOQUSQEMBBIIT-UHFFFAOYSA-N 443.525 2.431 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1 734017458 IVIIIOAMQVXMOE-GJZGRUSLSA-N 434.514 2.129 10 20 IECD COc1ccc(O)c(CNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)c1 734066337 RYULXPOHJFSBNI-UHFFFAOYSA-N 442.516 2.061 10 20 IECD COC(=O)c1ccc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)o1 734170537 NUOJSQDCJOKWKY-UHFFFAOYSA-N 430.505 2.086 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1C 737165595 HHXUGFZDAGGZAO-UHFFFAOYSA-N 436.509 2.217 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)ccc3O)cc2F)C[C@@H](C)O1 745072014 KXADHKQYCHTCJD-ZIAGYGMSSA-N 432.448 2.324 10 20 IECD CCN(CC(=O)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1)c1ccc(OC)cc1 746109500 RBHDPCJPUDFDGC-JOCHJYFZSA-N 439.512 2.032 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@](C)(O)[C@H](C)c3ccccc3)CC2)cc1 748483060 FXIOGRXPEOESJA-HOYKHHGWSA-N 426.513 2.442 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3cccs3)cc2)C1 749019257 XURLRVZSELUNTF-KRWDZBQOSA-N 443.573 2.069 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](C2OCCO2)C1 751060222 HNGCDWOGJYKYFK-CYBMUJFWSA-N 438.527 2.480 10 20 IECD CCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 756145572 AYZYIZYAROIVOU-UHFFFAOYSA-N 427.574 2.492 10 20 IECD CC(C)[C@@H](CCO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 756786588 KYWHASJGFROOGN-QGZVFWFLSA-N 437.474 2.238 10 20 IECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1 759299164 ZFXDOEZIPYPSIL-GAJHUEQPSA-N 428.508 2.234 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 763659610 VZDHVWAUGVIBRJ-UHFFFAOYSA-N 446.573 2.462 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1)c1ccc(N(C)C)cc1 773858923 RSFGJPZAPVKYDV-JKSUJKDBSA-N 449.515 2.360 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1-c1ccc(F)cc1 777361760 HPITZODXNZGQSN-UHFFFAOYSA-N 442.516 2.485 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCN(C(C)C)C3)CC2)cc1 778251919 HBFRPSOQGHYDGU-PISNEZEASA-N 428.577 2.137 10 20 IECD COC(=O)c1c(C)cccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407565 LMXPTEBLOPCGJS-UHFFFAOYSA-N 431.514 2.251 10 20 IECD CC(=O)N1CCCCC[C@H]1C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785427258 BPBQNWAIQKGSKW-QFIPXVFZSA-N 428.577 2.399 10 20 IECD CN1CCN(CCCCNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 787912983 TXYUDWJQQVIJOT-UHFFFAOYSA-N 430.593 2.197 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 787916637 XSKPXEVJTYDVCT-BGYRXZFFSA-N 430.593 2.014 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(-n4cccn4)cc3)CC2)cc1 788379811 NVGMGMLXFWXZKZ-UHFFFAOYSA-N 433.512 2.236 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Oc1ccc(F)cc1 789843827 DDKWQWYDTFTDBA-HNNXBMFYSA-N 447.482 2.126 10 20 IECD CN(C)CCN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789862520 UWRSBVNKAPICKH-UHFFFAOYSA-N 430.574 2.039 10 20 IECD O=C(CN1CCC[C@@](O)(C(F)(F)F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 796447496 GWYUREOTSUTUGE-IBGZPJMESA-N 433.446 2.058 10 20 IECD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@@H]1CCCOC1 804286912 PXKVFHIMHUTBOW-OAHLLOKOSA-N 435.458 2.352 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 804315176 GJNCWPZVPUDCDX-QHCPKHFHSA-N 437.540 2.250 10 20 IECD CN(CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCCC1 804820353 HXACCJOLIQOWPG-MRXNPFEDSA-N 438.519 2.364 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)c4ccsc4)CC3)nc12 917409660 XZROYTCMUJECLK-UHFFFAOYSA-N 429.502 2.021 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1OC 918309282 VQWKSKYGCRWZCE-UHFFFAOYSA-N 443.500 2.146 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@H](CC)N=c3nn[nH]n3-c3ccccc3)CC2)cc1 1319624732 WQDVIKUGHDESRF-NRFANRHFSA-N 435.532 2.022 10 20 IECD CC(=O)c1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n[nH]1 1787222173 USKMTSZHXNMUSA-UHFFFAOYSA-N 435.440 2.480 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc(C)c1O 1804339906 BSDZQEUOFODEFA-MUJYYYPQSA-N 447.582 2.121 10 20 IECD CNCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814965631 TUHRRUFVBIUAGB-LLVKDONJSA-N 438.937 2.433 10 20 IECD O=Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1843017422 UAWQRLNROIFAQU-UHFFFAOYSA-N 436.493 2.171 10 20 IECD C[C@@H]1CCCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 12946961 ZAOYRMCZDKJOSQ-YFEUJDIGSA-N 447.582 2.465 10 20 IECD CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 733642700 RTWKAXLMAHBHNH-ZDUSSCGKSA-N 437.484 2.164 10 20 IECD CCOc1cc(/C=C2\SC(N3CCOCC3)=NC2=O)ccc1O[C@@H](C)C(=O)N(C)C 747147950 JKAPPZLKUCSUMR-RVAQLADHSA-N 433.530 2.243 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc4c(c3)CCCN4C)cn2)C[C@@H](C)O1 747571257 MOJDXSVQVQDUNE-CALCHBBNSA-N 440.548 2.223 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1CS(C)(=O)=O 749588493 VXZHLRMASQHZAZ-UHFFFAOYSA-N 431.558 2.409 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3C[C@H](O)c3ccco3)CC2)cc1 754063009 YRIAUKHLSGSUBC-GIWBLDEGSA-N 429.561 2.359 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 756570911 CEOSRBLVMSFDHJ-GOSISDBHSA-N 436.599 2.182 10 20 IECD CC[C@H]1CC[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)O1 757126777 ANILRDKNEFEFEY-JXFKEZNVSA-N 434.514 2.425 10 20 IECD O=C1CN(C(=O)/C=C/c2cccnc2)c2ccc(S(=O)(=O)N3CCCCC3)cc2N1 759763347 HRKAVLIMKLFOBD-RMKNXTFCSA-N 426.498 2.255 10 20 IECD COc1ccccc1CCNC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759885242 BJSNEBYYVJXUKG-UHFFFAOYSA-N 443.544 2.202 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(NS(C)(=O)=O)c1 765981564 WTBRIKSFSDGZMI-MRXNPFEDSA-N 437.587 2.144 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1 768145197 OESMWKLHGVYMPI-HNNXBMFYSA-N 442.516 2.415 10 20 IECD O=C(c1ccc2c(c1)OCO2)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768237166 LBYIENHSLKIWDS-UHFFFAOYSA-N 427.476 2.349 10 20 IECD CCc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768447052 LRNJQECXGVESEI-IIBYNOLFSA-N 426.513 2.492 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 772446322 MMGGKABMKZOWIJ-RTBURBONSA-N 441.576 2.121 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1 782423725 GSNMWTPEFBTKOT-UHFFFAOYSA-N 445.483 2.489 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F 784028050 SKFISLFWEUGZAR-UHFFFAOYSA-N 449.504 2.449 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCCc3ccccc3)cc2)C1 785662054 JRUPEIZZUYIFQK-OAQYLSRUSA-N 436.556 2.144 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1 787120751 CKEPWVHCAVSTAX-QHCPKHFHSA-N 442.604 2.395 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1O 787306121 SKRSTVLQADKERF-GJZGRUSLSA-N 445.491 2.086 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@@H](c2ccccc2)C1 789836576 SWBYSBIIDRPIJR-JOCHJYFZSA-N 441.503 2.003 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(I)cc2)c(O)c1 797388893 FDUAXVKHYPGSHA-UHFFFAOYSA-N 426.210 2.260 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2OC)cc1 801687955 MOLCFCXZNYXZBI-UHFFFAOYSA-N 426.560 2.423 10 20 IECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803298745 DYKRXEFTEFBPJY-LAUBAEHRSA-N 441.528 2.456 10 20 IECD COC(=O)C(C)(C)C(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 803484469 UPGAGEVVMVQXFS-UHFFFAOYSA-N 441.483 2.180 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3[C@H]4CCCC[C@H]4C[C@H]3C)CC2)cc1 803747681 TYXYEINXVCXHFO-DXIQSLLYSA-N 428.577 2.113 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1C 804990945 AZRAAHCRKLCCLF-UHFFFAOYSA-N 447.557 2.486 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 810400489 KAWWFRYBBQKJDJ-SECBINFHSA-N 438.234 2.454 10 20 IECD O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCSCC2)cc1 916293990 QYGZQJVQSNYZBY-UHFFFAOYSA-N 434.587 2.018 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(n4cc(Cl)cn4)CC3)CC2)cc1 1325303950 WPPIIQHLEPOXBY-OAQYLSRUSA-N 433.984 2.365 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c(C(F)(F)F)c3)cc2)C1 1343403732 FQJUZHGGWMKQSJ-CYBMUJFWSA-N 430.452 2.214 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(F)(F)C1)C2)c1cc(O)nc(O)c1 1777846562 OOEJBMFPBUEDJW-WAWZGNHOSA-N 439.459 2.056 10 20 IECD Cc1ccn(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007174 LHKUWVCIDMNFLN-OAQYLSRUSA-N 433.892 2.155 10 20 IECD COc1cc(OC)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1799246682 IOQYGRLRXDHIJE-BTTYYORXSA-N 445.447 2.215 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2)c1cc(O)c(O)c(Cl)c1 1799766979 KPOFGICQQDGRSJ-IVWMJMPLSA-N 447.875 2.134 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1[nH]nc2ncccc12 1804286452 PJEPHIHGSNFIIF-RRJKNOHSSA-N 449.467 2.040 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998211 JMDYXFPGVLJHMX-VGSWGCGISA-N 436.468 2.433 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1 1823476715 IXWYDQMSGZBAKD-LOWQCSRCSA-N 440.456 2.211 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3CCC(=O)NC3)C2)cc1 1841114564 ZWXAWTUXXUVHNJ-HXUWFJFHSA-N 434.540 2.437 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCCc2ccncc2)=NN1c1ccccc1 1848227487 LTZOEJQNLWUPES-VXKWHMMOSA-N 445.523 2.399 10 20 IECD COC(=O)[C@H](CC(C)C)NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 18195222 ZNYPWJDESAJUNU-SFHVURJKSA-N 437.448 2.323 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cccc4cccnc34)CC2)cc1 38598328 VEUQGAPRQBAURX-UHFFFAOYSA-N 426.542 2.344 10 20 IECD O=C1C[C@@H](N(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C2CC2)C(=O)N1 726942375 DYPLKSBMGHADQE-OZYJXZHSSA-N 449.579 2.136 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1Cl 728014779 GAMXNUVDTXHYAA-UHFFFAOYSA-N 434.879 2.219 10 20 IECD O=C(C1CCN(c2ccc3nncn3n2)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 731858427 LCJIBGSPEBODFZ-LJQANCHMSA-N 436.516 2.254 10 20 IECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 732572724 YCKGSDUKWPKMST-SFHVURJKSA-N 439.585 2.417 10 20 IECD C[C@@H](CS(C)(=O)=O)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 733311220 PCPLZQVDBZDUOF-AWEZNQCLSA-N 440.521 2.298 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 735195917 SPRUOPHBYREGTF-HKBQPEDESA-N 443.569 2.219 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C(C)(C)S(C)(=O)=O)NC(=O)OC(C)(C)C)cc1 742755915 ZJIBONVFHIJADE-INIZCTEOSA-N 427.567 2.258 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cc1csc(N2CCCC2=O)n1 749985007 FHQUKUZDBXHTEQ-UHFFFAOYSA-N 430.530 2.080 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc([S@@](C)=O)cc3)CC2)cc1 752830225 CVVNQQZCDGLTAN-WJOKGBTCSA-N 444.601 2.444 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3C[C@H](O)c3cccs3)CC2)cc1 753865944 ILLCGPIGNVALFF-CTNGQTDRSA-N 445.585 2.230 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)NC4(CCCCCCC4)C3=O)CC2)cc1 758196456 CVWRKUBHBAJCFI-FQEVSTJZSA-N 444.576 2.213 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 759588939 PXULWFGPKCYETA-HWKANZROSA-N 430.369 2.362 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)NC(=O)OC(C)(C)C)cc1 767048927 HGBZHZIWKXEXJV-OAHLLOKOSA-N 432.481 2.390 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)cc2F)CC1 769156812 UFEKBIQCARFRLO-GOTSBHOMSA-N 447.599 2.145 10 20 IECD O=C(NC1(CO)CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 778942479 GHAZRBYOIDTZQJ-UHFFFAOYSA-N 435.458 2.136 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1 785293847 CDAFTTWBIARIBS-YESZJQIVSA-N 441.528 2.393 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3c(C)nc4ccnn4c3C)cc2)CC1 786259094 JUZHFOGVIMPJPL-UHFFFAOYSA-N 434.544 2.264 10 20 IECD Cc1cccnc1C(F)(F)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 787206570 BUYNJWYMCWEJGY-UHFFFAOYSA-N 437.418 2.317 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 788937917 OSQFTROKCWGZBN-VQTJNVASSA-N 443.569 2.316 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(Cl)nc3C)CC2)cc(OC)c1OC 789726870 DCNVHVQPBUGHSS-UHFFFAOYSA-N 448.907 2.357 10 20 IECD COc1ccc(CNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c(O)c1 794383962 UQFRAPBHESRURG-UHFFFAOYSA-N 428.557 2.130 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCc4ccccc4OC3)CC2)cc1 801442534 XKBKNKXTVCPDGL-SJFMBGHLSA-N 435.524 2.410 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H](SC)C3)cc2F)CC1 805007004 CKUSFECFXHALSF-QZTJIDSGSA-N 436.597 2.374 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)n3ccc4ccccc4c3=O)nc12 805630166 RZCZNAVULRBVRF-CYBMUJFWSA-N 436.424 2.231 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1c(F)cccc1F 806853959 XUDNUJPSOPRFRI-FQEVSTJZSA-N 428.483 2.376 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3nccnc3c2Br)c1 806898251 ZQMHHNKQHLJOBJ-UHFFFAOYSA-N 431.246 2.361 10 20 IECD O=C(N[C@@H]1CCOC2(CCSCC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809459449 YBUWFAKUZZMTLI-MOPGFXCFSA-N 448.585 2.461 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc5c4OCCO5)n3)CC2)cc1 809465777 ZCCRZLHAUQFEKH-UHFFFAOYSA-N 436.468 2.408 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 810374989 MZEKMNTVBLEDIG-UHFFFAOYSA-N 447.438 2.356 10 20 IECD Cc1c(NC(=O)C(=O)NCCCSc2nccs2)nnn1Cc1ccccc1F 815537857 MVAXHXBUPNTYHO-UHFFFAOYSA-N 434.522 2.468 10 20 IECD COc1cc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1OCC(N)=O 916640915 OSCHAUAPOMCIGF-SFHVURJKSA-N 443.500 2.156 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCCO4)cc2F)C[C@H](C)O1 918286278 GNAMFQKJAVDECH-GJZGRUSLSA-N 443.475 2.465 10 20 IECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918295628 RPLAXDNYBKNKPN-GOSISDBHSA-N 425.485 2.207 10 20 IECD Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n[nH]1 918671639 GMUQFTXFSNYYTA-QGZVFWFLSA-N 435.532 2.059 10 20 IECD COCCOc1cc(C)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 919663830 PWARLUHPSQDMCD-UHFFFAOYSA-N 441.528 2.454 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc2c(cc1Cl)OCCO2 920195212 MIOIHOGKPMIKLC-UHFFFAOYSA-N 431.876 2.203 10 20 IECD C/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1781708478 JNOCKKHWQXIOKM-RFRWANLJSA-N 438.528 2.259 10 20 IECD Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1807991565 QCLWAXPLBZOBOW-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1[C@H]2C=CS[C@H]21 1812384968 VPLZXSAIAIILNE-CWYSQHEVSA-N 438.509 2.083 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1cc(O)nc(O)c1 1817844267 WAESRZIPVLIZLO-GFCCVEGCSA-N 432.824 2.477 10 20 IECD Cc1[nH]ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902795 VZUONRSGZLSBKT-QGZVFWFLSA-N 448.614 2.417 10 20 IECD CC(C)(C)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839431744 KOAJPMQWQKJLRP-OAQYLSRUSA-N 440.924 2.257 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2CCc3ccoc3C2)C1 1841453187 WPTFZJFTNIQXRH-UABRLCRWSA-N 438.480 2.418 10 20 IECD O=C(CCCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)Nc1ccccc1 1843248941 WCFNFHJDGCCJBF-UHFFFAOYSA-N 438.484 2.119 10 20 IECD Cc1cc(S(=O)(=O)N(C)C)cc(NS(=O)(=O)c2cccc3nsnc23)c1C 19095914 LWZAGRTYQUMXCX-UHFFFAOYSA-N 426.545 2.359 10 20 IECD CN(C)CCn1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 726505368 ZWJDSZYDALZOFP-UHFFFAOYSA-N 433.424 2.381 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](N3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 727159675 QFAWXJQIZWFIMM-IBGZPJMESA-N 430.574 2.094 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1 729038431 RZKVPGDTOKAJFH-HNNXBMFYSA-N 448.545 2.220 10 20 IECD CCOC(=O)N[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730132851 HACPFRHVPAEMGS-SFHVURJKSA-N 435.544 2.388 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(OC)c(C(=O)N(C)C)c3)CC2)cc1 734495048 LQHMAMMAGRFUQZ-UHFFFAOYSA-N 447.557 2.353 10 20 IECD COC(=O)CCCc1nnc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 740464784 MCEYMZKPGYBJHJ-UHFFFAOYSA-N 437.497 2.331 10 20 IECD COCCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 745692461 VXKPUPQMPZAUCG-LJQANCHMSA-N 432.565 2.115 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2O)c(C)n1-c1ccccc1 747343560 NKNJAGPLZDOKLB-UHFFFAOYSA-N 428.466 2.487 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](CNC(=O)OC(C)(C)C)C[C@H]3C)nc12 752068956 NBNNGMVYVRGDPS-KGLIPLIRSA-N 433.509 2.347 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2nccn2C)CC1 760876806 UMMRDEJAAPUBBI-INIZCTEOSA-N 443.507 2.345 10 20 IECD C[C@@]1(c2ccc(CN3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc2)NC(=O)NC1=O 761223028 NHTZLLVWCRIYIS-NRFANRHFSA-N 442.859 2.065 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)cc(Cl)c3)cc2)C1 764249337 OXSQRKKEOPHYLZ-AWEZNQCLSA-N 432.883 2.436 10 20 IECD C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765981495 VJMCORPAPYUEGG-AUSIDOKSSA-N 428.602 2.317 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770096079 GUJMFQKNVSUXMQ-UHFFFAOYSA-N 446.572 2.150 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)cc1 772361091 SSPWAWMVSMNACK-UHFFFAOYSA-N 437.587 2.358 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773615622 FQYIAUCPOZZDMV-CQSZACIVSA-N 435.550 2.135 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccnc1Br 774104343 HCJNLTBNXQQTLC-UHFFFAOYSA-N 437.269 2.075 10 20 IECD O=C(NCCc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774713613 PBHQISOIQNCXSL-UHFFFAOYSA-N 438.547 2.333 10 20 IECD COc1c([N+](=O)[O-])ccc(CNc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)c1O 775106616 IUIHLWFJUAOCSG-UHFFFAOYSA-N 437.474 2.067 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN[C@@H](C)c1ccc(N3CCOCC3)cc1)n2C 775254453 JJMYVAZJUIVOJP-INIZCTEOSA-N 440.548 2.323 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCCC[C@@H]1CCO 776043785 YPASBKXHOUCIJR-LJQANCHMSA-N 442.539 2.389 10 20 IECD COC(=O)C1CCN(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 779194192 LBAWFNSRIJTGBA-UHFFFAOYSA-N 433.530 2.262 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1 779581764 ABDMWGCHKMAKNZ-QGZVFWFLSA-N 437.587 2.422 10 20 IECD CCc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780408714 LTYKVEUQTRMQLK-UHFFFAOYSA-N 431.514 2.417 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nc(Br)ccc3F)nc12 795856104 NCLKXASPJOGYLC-UHFFFAOYSA-N 439.197 2.265 10 20 IECD C[C@H](O)C[C@@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448580 CLQQVSTVDJXFTA-YOEHRIQHSA-N 425.476 2.135 10 20 IECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803975614 JRBMMWILSICYHN-GHTZIAJQSA-N 437.540 2.467 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)cc1 808542850 VEGNVGODWDAVJQ-LJQANCHMSA-N 438.528 2.079 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808854580 DFPAFIIWCDRXBM-UHFFFAOYSA-N 430.618 2.189 10 20 IECD COc1cc(N2CCN(C(=O)/C=C\CN(C)CC(F)(F)F)CC2)cc(OC)c1OC 816100669 OVXBROBOQNWMRG-WAYWQWQTSA-N 431.455 2.411 10 20 IECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2cc(Cl)c(F)cc2O)CC1 816550181 KKJFPLIGZZKLLB-UHFFFAOYSA-N 427.929 2.411 10 20 IECD CN(Cc1ccccc1O)C(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 916649903 WOTKTIVKUZGPHG-SFHVURJKSA-N 433.530 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4ccc(OCC)cc4)CC3)nc12 917076495 MBAVLPNJTQWWEX-UHFFFAOYSA-N 439.516 2.328 10 20 IECD Cc1nn[nH]c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753618 LHKRPCGPJHLEID-XMMPIXPASA-N 448.527 2.278 10 20 IECD Cc1nn[nH]c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620349 GIHYVRGUQDKNDU-HATOLVCRSA-N 448.527 2.038 10 20 IECD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)ccc1O 1799768991 IRJPUJGTAZZYDH-CCWDJLKJSA-N 446.887 2.282 10 20 IECD CC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803007165 VARXVLIPWLAZEV-OWQGQXMQSA-N 433.892 2.237 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC=CCC3)CC2)CC1)c1cc(O)nc(O)c1 1834986041 WIGJCPIHCUNSLJ-MRXNPFEDSA-N 428.533 2.034 10 20 IECD O=C(c1ccc2n[nH]cc2c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441851 WVCSQNHHIBVSFS-UHFFFAOYSA-N 442.479 2.173 10 20 IECD C[C@H](Nc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1844391792 GZUXYVCYVODFDM-ZDUSSCGKSA-N 430.892 2.464 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 11193298 KXXIANZZJCEFSA-HSZRJFAPSA-N 437.540 2.082 10 20 IECD CCOC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)NC(=O)N[C@@H]1c1ccccc1 109996810 JGXSWSAKSAYGAQ-QGZVFWFLSA-N 426.425 2.434 10 20 IECD COc1ccc([N+](=O)[O-])c(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1 525193921 DJMYIQUKAPDEBH-UHFFFAOYSA-N 435.487 2.119 10 20 IECD O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1ccc(N2CCCS2(=O)=O)cc1 726794338 BDQYRIBSKAZPFN-UHFFFAOYSA-N 435.571 2.305 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1 740813099 SGMVYNPJMLIHNI-UHFFFAOYSA-N 436.519 2.005 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@@H](S(C)(=O)=O)C3)cc2F)CC1 741086037 CIRIXFZSYSNSJV-ZWKOTPCHSA-N 440.585 2.123 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1cncc(Br)c1 744244086 QWLGDVBMAQCJKZ-UHFFFAOYSA-N 430.299 2.298 10 20 IECD C[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)cc(Cl)c1O 756739058 QYSRKCKSULTICY-GXTWGEPZSA-N 446.773 2.392 10 20 IECD CN(CC(=O)Nc1cc(-n2cnnn2)ccc1Cl)Cc1ccc(N2CCOCC2)cc1 760804189 FAIMNVWRIQOCIX-UHFFFAOYSA-N 441.923 2.223 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCS(=O)(=O)C1 764228224 MURYEPXCKBZEBT-BZUAXINKSA-N 427.542 2.015 10 20 IECD CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 767662854 JGNXGSUJCUVAIS-INIZCTEOSA-N 425.501 2.208 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 768511432 IXXDUOKSDHQUJP-IYBDPMFKSA-N 440.479 2.110 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](O)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 768646866 NNAUJXDQZMZPII-OAQYLSRUSA-N 442.493 2.201 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(Br)c(=O)n(C)c2)cc1 774146033 SCYFACHOALVVPW-UHFFFAOYSA-N 435.322 2.249 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc2o1 774153210 MZSUUZATPVHTIX-MRXNPFEDSA-N 435.484 2.093 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)cc1 778256276 JNVJEUWOPVNXLG-SREVYHEPSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H]3C3CCOCC3)CC2)cc1 778423271 QALPELWMSYZZPJ-BVGULUMVSA-N 427.545 2.318 10 20 IECD COc1ccc(C2(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)CCOCC2)cc1 785438204 ADZAIETVGGQOJB-UHFFFAOYSA-N 425.529 2.242 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCS(=O)(=O)c1ccccc1 788739643 NHJXYFBVCKUDEB-UHFFFAOYSA-N 443.569 2.225 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OCCN3CCCC3)CC2)cc1 788966077 IZXXCTGXNIWKKT-UHFFFAOYSA-N 430.593 2.252 10 20 IECD Cc1ncc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789822092 VRGPKONTQASQPY-KBPBESRZSA-N 434.537 2.179 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)cc1 795363669 XRSZQDJAVLNPBM-UHFFFAOYSA-N 438.846 2.064 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2cccs2)CC1)c1ccc(N2CCOCC2)cc1 803298758 DJKBYDWRRRZWOS-GOSISDBHSA-N 442.585 2.106 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 803306470 RASQQIIDNVPWTQ-IAGOWNOFSA-N 429.492 2.423 10 20 IECD COCCCN1CCC(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 804353612 MARCFIPUMOKXKN-UHFFFAOYSA-N 430.593 2.252 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccncc1OC[C@H]1CCOC1 806456980 BDSFJSICGPSKNU-SFHVURJKSA-N 444.507 2.472 10 20 IECD COc1ccc(N2CCC(NC(=O)NC3C[C@@H]4CC[C@H](C3)N4CC(=O)N(C)C)CC2)cc1 806684145 RDRSWEJXMKQBEW-VCSGRIEYSA-N 443.592 2.047 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCC(C)(C)C3)CC2)cc(OC)c1OC 806759330 XVRSQFAVYIUZKO-MRXNPFEDSA-N 433.549 2.446 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc(C4OCCO4)s3)CC2)cc(OC)c1OC 807246208 KUHOIMPKVMCPOQ-UHFFFAOYSA-N 435.502 2.177 10 20 IECD CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914903916 UVTZHQZHBQWOQS-KRWDZBQOSA-N 428.489 2.335 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)c(OC)cc2F)cc1OC 917758241 MQDFHIBZVZOAEF-UHFFFAOYSA-N 448.494 2.414 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1 917917395 PZEHAFDSZCNCIX-UHFFFAOYSA-N 437.587 2.452 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)CC2)cc1 1342614859 MORLQKWLSLUQKH-UHFFFAOYSA-N 441.553 2.432 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2cccc(OC)c2)[nH]n1 1342917572 XYEFFITVAOJHCV-SFHVURJKSA-N 425.441 2.401 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H]4[C@H]5COC[C@H]54)C3)C2)cc1 1784852816 HSUCSNCEKWRMFV-JTKRFKOTSA-N 449.551 2.430 10 20 IECD COCc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715002 TZQNQXRADBOIPT-CLLJXQQHSA-N 435.864 2.451 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816728010 FKNCYBSFUCTUQP-GFCCVEGCSA-N 428.470 2.319 10 20 IECD CC(C)(C)n1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1842207647 QCFFGBRTIPHESZ-SOFGYWHQSA-N 440.500 2.285 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2Cc3ccccc3CN2)C1 1843369529 NZEKARIOYUOAGC-GOSISDBHSA-N 441.915 2.283 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(C)n1C 1847038703 NMPMMMWOUUUNAS-SOFGYWHQSA-N 425.485 2.289 10 20 IECD Cc1cccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)cc12 1847056576 REGOYXMPWWVRQD-UHFFFAOYSA-N 442.566 2.154 10 20 IECD COc1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)cc1F 1848348811 SJPNBRXLUDEIMZ-GJZGRUSLSA-N 435.839 2.423 10 20 IECD COc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1OCC(N)=O 108458385 CZZBKWWWGPTWHX-HUUCEWRRSA-N 445.491 2.242 10 20 IECD CN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCN(CC(F)(F)F)C1=O 732888329 MGXAIKPNZZOSHH-KRWDZBQOSA-N 446.445 2.091 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCCS(=O)(=O)C1 733959269 UUGNIVPWWKDVHI-XTCQQWIJSA-N 444.625 2.423 10 20 IECD CCc1nsc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 743554049 WENMSKXNYVAHPB-UHFFFAOYSA-N 434.541 2.108 10 20 IECD CC(C)c1nnnn1CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747031483 UFRQSQRHRUIXCM-CYBMUJFWSA-N 447.451 2.142 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 754180284 SYERWSSBBVMIGX-OAQYLSRUSA-N 441.503 2.083 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(Br)n1 755586874 NQHDCNGMCDTFCJ-UHFFFAOYSA-N 438.347 2.317 10 20 IECD Cc1cc(C(=O)COC(=O)c2cccc(O)c2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 758583579 YZJAKZQPRBVQHH-UHFFFAOYSA-N 444.465 2.192 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cc(-n4cnnn4)ccc3Cl)CC2)cc1F 760893392 SPIIXXMCLLKUMC-UHFFFAOYSA-N 445.886 2.224 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN1CC(F)(F)F 763014157 ZYRYEXBKDZOWAV-DOTOQJQBSA-N 441.498 2.166 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCc1cccc(Br)c1O 765737754 YYLBPRCPKFABDB-UHFFFAOYSA-N 431.283 2.279 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773847754 OPCXCTWWNSSJOA-BEIWTESXSA-N 431.558 2.464 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1Br 781624604 LCKUDLJIARGLGZ-AWEZNQCLSA-N 447.333 2.484 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@@H](C)O3)cc1 797431761 XUDNORDZOJAMEB-SNVBAGLBSA-N 431.923 2.340 10 20 IECD CC(=O)N[C@](C)(C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(S(C)(=O)=O)cc1 797441459 HLJMGHUHHKZIJI-QHCPKHFHSA-N 443.569 2.140 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](C)(CNC(=O)OC(C)(C)C)C3)nc12 801574816 XZBNRKURUCOFAU-OAQYLSRUSA-N 433.509 2.348 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1)C1CCCCC1 803677030 DGTSKXXYFRJFPU-IBGZPJMESA-N 441.576 2.134 10 20 IECD CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 803747654 SKQDIVBGTUKDKX-WIYYLYMNSA-N 448.633 2.114 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCOc4cc(OC)ccc43)CC2)cc1 804318635 QLTADQFNRYZALR-OAQYLSRUSA-N 439.512 2.429 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2c1=O 807385196 DUWOEQFLBNFWSN-UHFFFAOYSA-N 430.258 2.262 10 20 IECD CCCCCn1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1 809203454 ISYMZXUSJQKHFT-UHFFFAOYSA-N 441.576 2.493 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](NC(C)=O)C4CCCC4)n3)CC2)cc1 809464572 HOPDFJACZHEOTC-QFIPXVFZSA-N 441.532 2.337 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1C[C@H](C)S(=O)(=O)[C@H](C)C1 810109725 FKVICUIVNPKWSO-ZNMIVQPWSA-N 440.521 2.296 10 20 IECD COc1ccc(N2CCN(CCN[C@@H]3CCCc4ccc(S(N)(=O)=O)cc43)CC2)cc1 810212850 ZQVYTJDXYBHDEV-HSZRJFAPSA-N 444.601 2.132 10 20 IECD Cc1cc(C(=O)CN2CCN(S(N)(=O)=O)CC2)c(C)n1-c1cccc(C(F)(F)F)c1 914788131 VLYFSNKAJYKRTO-UHFFFAOYSA-N 444.479 2.117 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O 920569073 MJMHBQGGVDFCMY-FQEVSTJZSA-N 427.476 2.446 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)CC2)cc1 1253863604 LFBWAXZSUWKSCR-XMMPIXPASA-N 436.512 2.201 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3cc(CNC(=O)OC(C)(C)C)cn3)CC2)cc1 1339509830 OECHFNODQRFBSH-UHFFFAOYSA-N 429.521 2.265 10 20 IECD Cn1ccnc1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314072 PMCXGLKZHRXGHJ-UHFFFAOYSA-N 443.554 2.028 10 20 IECD O=C(C[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804099522 OJKYXRCDQRYLID-ZJBJCVSYSA-N 440.500 2.167 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2cccnc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995038 WXTVHBFRGFBUHN-JPYJTQIMSA-N 447.495 2.235 10 20 IECD C[C@@H](Nc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547451 XTXXMOUQBGBNGU-MRXNPFEDSA-N 439.516 2.233 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cn[nH]c1)CC2)c1cc(O)c(O)c(Cl)c1 1823710753 KMOVCLQDUJAMHV-JTQLQIEISA-N 433.877 2.470 10 20 IECD CN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824199411 RLNNXMZZPZIIEK-RTBURBONSA-N 430.549 2.210 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831133993 PVJHKUXETVHIAA-PBHICJAKSA-N 449.504 2.288 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cnc(Cl)s2)C1 1844535907 WOVQBSAHZUQVRC-UHFFFAOYSA-N 443.916 2.406 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 727363700 ZNUARIRSEUKXHX-UHFFFAOYSA-N 427.486 2.243 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N(C)[C@H]3CCS(=O)(=O)C3)c2C)cc1 729793514 QYNRCXCORLKFHQ-WMZOPIPTSA-N 448.541 2.294 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCCNC(=O)c3ccsc3)CC2)cc1 742927391 QCTOKDJUBPKFMX-UHFFFAOYSA-N 430.574 2.205 10 20 IECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)o1 743886754 AVGRNIZYKBCFKP-UHFFFAOYSA-N 439.447 2.276 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 748568343 PUFJLJUSZJDYGX-IBGZPJMESA-N 428.533 2.125 10 20 IECD C[C@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCCO1 755860935 YSPKTUWSENJHIY-LJQANCHMSA-N 435.458 2.400 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 761984161 XIDUGOYDAMXKOQ-CYBMUJFWSA-N 429.951 2.149 10 20 IECD C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)S(=O)(=O)C1CCOCC1 765344566 PSGDPKYQSJYOPR-YLJYHZDGSA-N 438.590 2.243 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769021343 GXUHKDGZARMDNA-UHFFFAOYSA-N 449.555 2.432 10 20 IECD CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362642 BQCCGLSEASUBMK-UHFFFAOYSA-N 434.514 2.109 10 20 IECD C[C@H](NCC(=O)NN1C(=O)N[C@](C)(CCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 775832347 ZHRNYROBFUXULP-BXKMTCNYSA-N 437.544 2.378 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 785231699 GAKDNGRBQINJMQ-HNNXBMFYSA-N 446.403 2.036 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc(OC)c1OC 786257041 LFQXIFTZMOOUHW-UHFFFAOYSA-N 427.501 2.311 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 787703295 AQAGEVBXIUPLOT-ZVDOUQERSA-N 431.577 2.384 10 20 IECD O=C(NCc1ccc(Cn2cccn2)cc1)C(=O)NCc1ccc(N2CCSCC2)cc1 788461812 KSJBXGOGLXBEGM-UHFFFAOYSA-N 449.580 2.417 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 789825753 OLFCMXSTNNJHKC-NSHGMRRFSA-N 446.567 2.142 10 20 IECD C[C@H](c1ccc(F)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735831 ZALOVPQXIFXNRA-APWZRJJASA-N 440.519 2.363 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21 803133630 BJEZFPZMMYERFH-SFHVURJKSA-N 444.576 2.449 10 20 IECD CC(C)N1[C@H]2CC[C@@H]1CCN(C(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)C2 803303398 MOWROPRHOXOHTH-BWAGFHJFSA-N 428.577 2.174 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803309183 QWBCOOAGABHHHX-PZJWPPBQSA-N 428.577 2.177 10 20 IECD CCN(CC)[C@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448288 NQEQGXPTBAXHGZ-SFHVURJKSA-N 438.519 2.316 10 20 IECD C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1nncn1C 805540343 OWOFSXSZMRUWPX-NSHDSACASA-N 447.429 2.148 10 20 IECD O=C(NC[C@@H]1COC2(CCCCC2)O1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806691289 AOUQSWYQLNBANT-RTBURBONSA-N 432.517 2.092 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 807102722 IAXHFUTYKDAXRY-LJQANCHMSA-N 441.507 2.239 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(c2cc(C)nc(C)n2)CC1 808412722 ZUHCZMSOSKOALX-UHFFFAOYSA-N 425.533 2.323 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1nnc2ccccc2n1 810192852 POWLPFUBVTXENQ-UHFFFAOYSA-N 444.474 2.211 10 20 IECD COc1cc(N2CCN(C(=O)c3nn(C)cc3Br)CC2)cc(OC)c1OC 816100597 LUAGWAAZTFCEHW-UHFFFAOYSA-N 439.310 2.171 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 920195488 TZZGSXMIHKRUTH-JOCHJYFZSA-N 439.512 2.336 10 20 IECD CCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787540156 KMJCIVJTYUUCSI-QRFRQXIXSA-N 440.544 2.195 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1occc1Br 1796601354 XJMAPUBIBZFNMM-ZSBIGDGJSA-N 436.262 2.414 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cncn2c1 1798196913 MBPALGXTROMUGE-KJZRSFJVSA-N 448.479 2.416 10 20 IECD CCc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1 1799729765 HMDGDAKINYXVCJ-BJWYYQGGSA-N 431.583 2.361 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccccc1 1804340493 RWXSADRBHPTCOK-LLLHUVSDSA-N 431.583 2.289 10 20 IECD Cc1nscc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991736 SNTBEJAAHUGXEC-IFXJQAMLSA-N 439.497 2.286 10 20 IECD CSC[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)N1C(=O)[C@H]2CCCC[C@H]2C1=O 475945845 IKBYHHKCSGCSJR-SOLBZPMBSA-N 431.558 2.385 10 20 IECD COCCN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729594636 RGCSXXIRLUKLIN-UHFFFAOYSA-N 432.487 2.262 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4c(F)cccc4F)=NO3)cc2)C1 736005091 BMBNYZIRCGAFPJ-MGPUTAFESA-N 442.466 2.476 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)OC)c2)cc1 739668858 VEPJEGMHOHVHDZ-UHFFFAOYSA-N 442.515 2.434 10 20 IECD CC(C)[C@@H](CCO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738846 YXPHPQSOTKRLIK-LJQANCHMSA-N 430.528 2.149 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccc(C(=O)Nc4nncs4)cn3)cc2)C1 746389118 CLPRIJYEDHSUEG-MRXNPFEDSA-N 437.529 2.499 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 749646621 GFWYLHXMIPRTRZ-UHFFFAOYSA-N 432.546 2.468 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnn(-c2ccccc2)c1 751228363 PVYPXAOJVHBRKY-UHFFFAOYSA-N 430.505 2.451 10 20 IECD CCc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1CC(C)C 757163408 HATDYNPTJHOLGX-UHFFFAOYSA-N 431.512 2.332 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(N(C)C)ccc3[N+](=O)[O-])CC2)cc1 758233578 VFBUDRHFLXWVRY-LJQANCHMSA-N 430.505 2.231 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](N2CCCC2=O)C1 761115538 SZFFNAKRGMXKNL-DOTOQJQBSA-N 431.492 2.486 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)NCc2cccc(Br)c2O)cc1 764796463 DTZWSGNHYQIWIV-UHFFFAOYSA-N 442.335 2.452 10 20 IECD O=C1CCc2cc(F)c(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2N1 765926317 LCWGBSCRAJCUJU-UHFFFAOYSA-N 436.237 2.433 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 768871745 KZECVIVUZYAWTQ-NRFANRHFSA-N 429.586 2.448 10 20 IECD CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 773679227 WKVLMLVLNNDQJX-OAQYLSRUSA-N 441.528 2.231 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccs1)N(C)C)c1ccc(N2CCOCC2)cc1 774853088 GMDIZGVBDOXAHV-VQIMIIECSA-N 430.574 2.181 10 20 IECD C[C@H](NCC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 775832360 ZQCQVGOJNNCTDM-SFHVURJKSA-N 441.551 2.325 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]3C)nc12 776607777 WUKLETIWXCLICQ-ZIAGYGMSSA-N 433.509 2.441 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CCO)c3cccs3)CC2)cc1 778370698 GZHBOLCQXNRGCA-QWUACUGRSA-N 429.542 2.201 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(OC)c1 782106455 JKGNNMAMCSFHPE-UHFFFAOYSA-N 441.484 2.168 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 785303706 KPMFUNVYFWGONA-CQSZACIVSA-N 425.485 2.456 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)nc3)cc2F)C[C@H](C)O1 786614194 LUGPPOKXFVIIFX-KBPBESRZSA-N 434.899 2.420 10 20 IECD CCN(CC)C(=O)N1CCC(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1 786659069 HLJGYVAPOOYENA-UHFFFAOYSA-N 443.592 2.145 10 20 IECD C[C@@]1(c2ccc(F)cc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313409 SXTRCDRKGQZVDZ-XMMPIXPASA-N 425.504 2.469 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC[C@@H]3c3ccco3)cc2F)C[C@@H](C)O1 789828698 YEEWETBRVFOZKB-GQIGUUNPSA-N 445.491 2.249 10 20 IECD O=C(NCCc1cc(F)ccc1F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832594 BCBZIKXWUSAVBS-UHFFFAOYSA-N 435.446 2.040 10 20 IECD CCc1cnccc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833159 DIUSKXJHXMAZBK-OAHLLOKOSA-N 428.508 2.238 10 20 IECD CC(C)C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789847842 WVFGPHCQQSWGMY-MJGOQNOKSA-N 435.540 2.113 10 20 IECD CCc1[nH]nc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1[N+](=O)[O-] 790074429 QKLCWEXEIMYPSE-UHFFFAOYSA-N 448.391 2.451 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1)c1ccc(N2CCOCC2)cc1 803296333 AZLNYMSJWPQOCM-CVDCTZTESA-N 447.539 2.455 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)cc1F 803663758 ZEYBYGMCSDHKMN-UHFFFAOYSA-N 441.507 2.321 10 20 IECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 803975924 RSLPMFYPUGZPPU-LJQANCHMSA-N 436.556 2.049 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)CC2)cc1 804315287 JQDCCDWQZIERGW-PKTZIBPZSA-N 436.556 2.342 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C(F)(F)F)[C@H](CO)C3)CC2)cc1 806620321 SFVSTHIKFKGZLR-LPHOPBHVSA-N 444.498 2.020 10 20 IECD COC(=O)CNS(=O)(=O)c1cccc(NCc2cc(Cl)cc([N+](=O)[O-])c2O)c1 809683189 TUEOPJXGZMVTSF-UHFFFAOYSA-N 429.838 2.017 10 20 IECD CCNS(=O)(=O)[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)C1 809815351 WOTVAJSDWQTEIM-GOSISDBHSA-N 428.562 2.408 10 20 IECD COc1ccc(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(Cl)c1OC 817946752 OLFFLDVGZQDJHV-UHFFFAOYSA-N 428.894 2.407 10 20 IECD COc1ccc(N2CCCN(C(=O)NCC3(NS(C)(=O)=O)CCCCC3)CC2)cc1 918065604 VGKPLFLVRCTBAY-UHFFFAOYSA-N 438.594 2.169 10 20 IECD CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc([N+](=O)[O-])c1 919840498 QIWBRHHWERDGTA-UHFFFAOYSA-N 447.469 2.259 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920872238 JDNJITGKPRKTLS-INIZCTEOSA-N 440.500 2.309 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(N2CCOCC2)cc1 920920649 OYQQHRIFLJYTCU-IBGZPJMESA-N 438.576 2.230 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2NC1=O 920927652 ZWYTVQRKKLTGEL-HUUCEWRRSA-N 438.484 2.059 10 20 IECD Cc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc2cncn12 1116581624 VANZURFLDRMACU-UHFFFAOYSA-N 426.448 2.092 10 20 IECD COc1ccc(N2CCC(NC(=O)c3n[nH]cc3I)CC2)cc1 1338133319 IWIPGJHPXSTZJD-UHFFFAOYSA-N 426.258 2.422 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)NC4CC4)c3)CC2)cc1 1341406442 FWQFEFGJWUVABP-UHFFFAOYSA-N 429.542 2.488 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 1342917645 ZUMUPWLKCBBGRT-JKSUJKDBSA-N 436.505 2.478 10 20 IECD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782005198 YWHFKHRKVWJOIL-OAQYLSRUSA-N 431.876 2.212 10 20 IECD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)s1 1785251106 CYVMVEGJHKSKAV-WBAXXEDZSA-N 445.541 2.089 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@]3(F)Cl)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246048 HKYXTBYFDQFUFD-XDUGFGTRSA-N 447.290 2.269 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc2cccnn2c1 1804289313 CEQCHWZCTYLOBA-DVMWBXJWSA-N 448.479 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H]1CCCCC1(F)F 1804334244 KNGVIMPZGGZLAJ-XJFOESAGSA-N 445.557 2.310 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2coc(Cl)n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992412 YCKPSKKQQCTVCL-SJCJKPOMSA-N 443.847 2.163 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469888 RAQKHBKXNJLOGK-JLEJFLCFSA-N 449.486 2.238 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1 1814165210 CQUDTPJTMGOMJV-QQLGTAFNSA-N 441.459 2.420 10 20 IECD CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191237 JDJRTYSXCMWVOI-HKZGKQEBSA-N 446.598 2.160 10 20 IECD O=C(CCc1cccnc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815729436 YVIMFAKUSIMXAX-CQSZACIVSA-N 439.497 2.203 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428352 WELOAYAHJXMCAL-IBGZPJMESA-N 441.532 2.309 10 20 IECD CC(C)(C)c1cc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)ccn1 1847055973 RXBOPXTXMCFUGS-UHFFFAOYSA-N 446.598 2.056 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C(=O)OC)[C@@H]3C(=O)OC)ccc21 511318234 CVJIMAYNHQNXDD-FXAWDEMLSA-N 430.501 2.471 10 20 IECD Cc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1C[C@@H]1CCCO1 727176634 NIVGYDSYSXITCS-BMANGOCTSA-N 443.616 2.034 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ccn(-c4ccccc4)n3)CC2)cc1 729877527 VEFKUXYZDACZLE-HKBQPEDESA-N 438.553 2.478 10 20 IECD CCN1CCN(c2ccc(CNC(=O)COc3ccc(C=O)cc3OC)cc2F)CC1 731636369 BGAWLMDLKGGDCK-UHFFFAOYSA-N 429.492 2.484 10 20 IECD COc1ccc(O)c(CNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c1 734065950 GUOHQAOZMOOCJD-IBGZPJMESA-N 443.500 2.074 10 20 IECD C[C@@H](CN1CCN(C)CC1)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745809208 RHCRIKSAWCBFCE-IRXDYDNUSA-N 425.524 2.192 10 20 IECD O=C(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Nc1cccnc1 751060266 ITYCNQRCQLKJSD-UHFFFAOYSA-N 432.483 2.018 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(NC(C)=O)c(OC)c3)CC2)cc1F 754213811 VLXQDENRYWRQHZ-UHFFFAOYSA-N 444.463 2.089 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 756337342 UHRJHOLKBAXJOG-YADHBBJMSA-N 438.524 2.500 10 20 IECD C[C@@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1cc(Br)ccc1O 756738868 LZMCUHQVFLKLGN-GFCCVEGCSA-N 443.367 2.392 10 20 IECD COc1cccc(OCCN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c1 767047412 HUDMBQNGQQFHMM-UHFFFAOYSA-N 426.561 2.074 10 20 IECD COc1ccc(COCCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 772051355 KGLCNBIIMXGYEM-FQEVSTJZSA-N 440.544 2.413 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cc1ccnc(O)c1Br 773631888 FPWSGQVMNLOJLJ-UHFFFAOYSA-N 436.306 2.360 10 20 IECD COc1cc(O)c(CN2CCC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)cc1OC 776771076 FPCDLGRHULXBJQ-QGZVFWFLSA-N 449.548 2.453 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(=O)n(Cc2ccccc2)n1 777828993 RZHZEIPCAQNDIQ-UHFFFAOYSA-N 441.871 2.466 10 20 IECD C[C@@H](NC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(N2CCOCC2)cc1 786119872 JPWLDFSXDQMIIU-LJQANCHMSA-N 447.539 2.245 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 787919256 YVFVWKZVWNAKNB-UHFFFAOYSA-N 439.434 2.419 10 20 IECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 788143843 NGBYXZLBKNEDBU-UHFFFAOYSA-N 442.560 2.372 10 20 IECD COc1ccc(OC(F)F)c(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788322503 GYTMWMMPZSCMTA-UHFFFAOYSA-N 449.454 2.066 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(N(C)C)cc1 789797647 CEHNYFXOYMPMIY-MRXNPFEDSA-N 428.508 2.222 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@@H](c2cccc(O)c2)C1 789863794 HZXQKIVSVCBXQU-OAQYLSRUSA-N 441.553 2.162 10 20 IECD Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 792210659 QDXHUUUGAUBUEI-UHFFFAOYSA-N 425.464 2.226 10 20 IECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c1OC 795852262 KHYJRHQHHFWIPN-JTQLQIEISA-N 428.894 2.462 10 20 IECD CN(C)c1ccc(CN(C(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)C2CC2)cc1 798318398 IBZZFSKJJPHKLX-UHFFFAOYSA-N 431.558 2.170 10 20 IECD CC[C@@]1(CO)CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448586 CQFJEUOPCHXFGC-NRFANRHFSA-N 425.476 2.137 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCC2(CCOCC2)C1 803451822 XNMDYCBHPFZGMF-UHFFFAOYSA-N 437.487 2.402 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cs1 803686301 GWYINYUXVCYPGL-UHFFFAOYSA-N 441.601 2.049 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(c2nnc3ccccn23)CC1 806276835 LLDFGKQYNSGCTG-UHFFFAOYSA-N 430.559 2.190 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](C)O1 807770949 QCQBSTCSLZFOAV-ZMSDIMECSA-N 425.476 2.399 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H](C)C2CCN(C(=O)OC)CC2)cc1 807832788 BRYPWZFCOKHLNF-KRWDZBQOSA-N 432.565 2.474 10 20 IECD COc1cc(OC)c2c(c1)N(CN(C)Cc1ccc(N3CCOCC3)cc1)C(=O)C2=O 917421244 RKDTWQBWQFHWNM-UHFFFAOYSA-N 425.485 2.159 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 917930020 MTYDEAYSHDQRSS-GOSISDBHSA-N 431.558 2.492 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1Cl 918295704 STBNNKOPXTZVIU-HNNXBMFYSA-N 431.876 2.291 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCS3)C2)C1 1784796226 IAMBDDWDZYJCHF-HNAYVOBHSA-N 426.922 2.090 10 20 IECD O=C(C[C@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283683 KLFXBZZPVXPPOI-NHPUWBORSA-N 430.501 2.414 10 20 IECD Cc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340417 MPZQKPSLXOGYPQ-QDMKHBRRSA-N 435.546 2.246 10 20 IECD CCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806028390 AEOMXHVMJXGNBJ-XOBRGWDASA-N 437.456 2.072 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CC(=O)Nc2ccc(F)cc2)CC1 23302172 NVBDEFYGWHZXNA-UHFFFAOYSA-N 441.551 2.106 10 20 IECD CC(C)NS(=O)(=O)c1cccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 104986972 BJLKRKCLMVIPOQ-UHFFFAOYSA-N 447.557 2.255 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 117529462 QZNGBQCYTLPVLQ-HZPDHXFCSA-N 449.548 2.336 10 20 IECD COC(=O)c1ccc(N2CCN(S(=O)(=O)c3cccc4nsnc34)[C@H](C)C2)cc1 523365877 APZVRXPQWDEXHX-CYBMUJFWSA-N 432.527 2.377 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cccc(OC)c3)cc2F)CC1 730290094 GXOLXBBUHRURPM-UHFFFAOYSA-N 428.508 2.022 10 20 IECD CN1CCC[C@@H](CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 731120224 RGQSSYTVDVWENX-IBGZPJMESA-N 441.555 2.083 10 20 IECD COC(=O)Cn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(C)cc4)c3C)cnc21 731565881 HWTHPBMULFFXKH-UHFFFAOYSA-N 433.468 2.365 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C[C@@H]2CCCO2)CC1 734269416 JZPIAKMYLPYFSL-FQEVSTJZSA-N 434.556 2.229 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 734405586 UKUIHZXKLBMLFE-UHFFFAOYSA-N 435.521 2.151 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F 741099516 CBBXLPYPEYFICE-UHFFFAOYSA-N 435.452 2.314 10 20 IECD O=S1(=O)CCN(c2ccc(CNC(=S)N[C@@H]3CCc4ccccc4C3)cc2)CC1 742992172 JXQDFZIJODPLGK-HXUWFJFHSA-N 429.611 2.443 10 20 IECD O=C(CN1CCC[C@H]1CN1CCOCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 744412179 DCWQOYJZRPQJDM-KRWDZBQOSA-N 433.508 2.197 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCC(N(C)C)CC3)cc2F)C[C@H](C)O1 748960717 QJOWLIQCPHDQMR-ROUUACIJSA-N 435.588 2.265 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)N(C(C)=O)CC4)CC2)cc1F 754039636 BAKRLJIFRDXXNJ-UHFFFAOYSA-N 433.505 2.254 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1nnc2n1CCC2 754665958 DYDIZBCGEQTTAC-CQSZACIVSA-N 429.480 2.459 10 20 IECD CNS(=O)(=O)c1ccc2c(c1)nc(-c1ccc(N3CCOCC3)cc1)n2CCOC 758485493 NBXMGTUTIGJKFO-UHFFFAOYSA-N 430.530 2.094 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NC(=O)Nc1ccc2c(c1)OCCCO2 759596963 XLFFDQCVTINAFD-XVNBXDOJSA-N 428.397 2.164 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)cc1 759690047 RJYGZMKSYYAETJ-UHFFFAOYSA-N 434.562 2.259 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3cnc(C)cc3=O)c2C)c1 762201707 JEXKCZNPCKDVTP-UHFFFAOYSA-N 437.452 2.415 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(Br)n3)CC2)cc1 763773184 YBLLNSXIASSLBP-UHFFFAOYSA-N 434.290 2.358 10 20 IECD Cc1nnc(-c2ccccc2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)o1 764939024 JRHFWKBCGKRSEC-UHFFFAOYSA-N 426.498 2.210 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)cc1 767969807 UTDMFHDRKHIAOI-UHFFFAOYSA-N 447.495 2.420 10 20 IECD CCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 768942681 NVYUEJRHJBROCC-GOSISDBHSA-N 438.528 2.432 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc1F 769624175 BFJJSNUDIRDPCP-UHFFFAOYSA-N 429.539 2.474 10 20 IECD C/C=C/C[C@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771621295 PSGLCWRGWQOLIT-BAABZTOOSA-N 435.458 2.158 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)O1 774776905 USLONBLPPGVTPC-OLMNPRSZSA-N 440.491 2.192 10 20 IECD Cc1noc(Cl)c1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 777121422 UQYGQMZVLQIGMZ-UHFFFAOYSA-N 425.844 2.014 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc(C(F)(F)F)nc3)CC2)cc(OC)c1OC 777785378 SYEPMMQZLJKTEM-UHFFFAOYSA-N 426.395 2.484 10 20 IECD CCOC(=O)C1CCC(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778243392 IRDLAAICZNTHTH-SEYXRHQNSA-N 443.544 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cn4cccc(C)c4n3)CC2)cc1 778261613 OQJIEGWCYMRQCF-MDZDMXLPSA-N 433.512 2.173 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCc2ccc(S(=O)(=O)NCC)cc21 784028587 XJMRZTPHIWGELC-UHFFFAOYSA-N 445.541 2.018 10 20 IECD CCC(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCOCC1 786594816 AVQQVRQFWOUHJB-QFIPXVFZSA-N 430.593 2.156 10 20 IECD CC1CCN(C[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)CC1 788312580 JKOYTLKXPPBTBF-QFIPXVFZSA-N 442.604 2.110 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cn[nH]c4)CC3)cc2F)C[C@@H](C)O1 789816101 BULWVACZZAAPAV-IYBDPMFKSA-N 443.523 2.185 10 20 IECD CCCN1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789819103 LMDCGUGUQWZSEM-QZTJIDSGSA-N 448.583 2.294 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCC3CCOCC3)cc2F)C[C@@H](C)O1 789821407 SQOOYHMFQLOOBV-CALCHBBNSA-N 435.540 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CC(=O)N4C)CC2)cc1 790096106 YXGWAOIQIYSSNO-KTKRTIGZSA-N 434.496 2.058 10 20 IECD COC(=O)[C@@H](C)N(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CCC1 792348614 RLNZDYNJVJNNBO-MRXNPFEDSA-N 447.557 2.340 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2c(cccc2S(=O)(=O)N(C)C)C1 792891153 DLBOKNHJUYTKME-UHFFFAOYSA-N 444.601 2.020 10 20 IECD CCOC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(NS(=O)(=O)NC)cc2)c1 793429465 HUCDQMJCMQGEFQ-UHFFFAOYSA-N 447.922 2.194 10 20 IECD Cc1ccc(OCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 803722441 QIOBZARAJXQPDY-UHFFFAOYSA-N 425.529 2.375 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290805 AAYFWKVFUNAIEE-PKOBYXMFSA-N 442.560 2.441 10 20 IECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385525 MFMRUBHBXDSUEU-UHFFFAOYSA-N 430.262 2.205 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 808117327 NKTWFCLPAFZENY-HXUWFJFHSA-N 429.561 2.480 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ncc(C)s3)CC2)cc(OC)c1OC 808484191 MJMYMRKQLSOWNM-AWEZNQCLSA-N 448.545 2.003 10 20 IECD O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456711 NQAHAZZIFWXIQV-UHFFFAOYSA-N 447.413 2.454 10 20 IECD C[C@@H](CN1CCOCC1)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916466458 QVTUGANNLNLBTR-HNNXBMFYSA-N 430.471 2.062 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(NC(=O)C4CC4)CC3)cc2F)C[C@@H](C)O1 917056061 NGDMQIGIOYDHDS-IAGOWNOFSA-N 446.567 2.046 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3cnc4nc(O)nc(O)c4c3)cc2F)C[C@@H](C)O1 918140368 LXEULZJSUKBOGN-VXGBXAGGSA-N 427.436 2.119 10 20 IECD O=C(CC[C@@H]1Cc2ccccc2NC1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340866 XBBPEXNFWVQLRC-LJQANCHMSA-N 441.553 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(-c4ccco4)oc3=O)cc2F)C[C@@H](C)O1 918699189 BBXAOQHGRREQEM-OKILXGFUSA-N 430.436 2.165 10 20 IECD C[C@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 920866748 KTPZEJPZESWYSA-SFHVURJKSA-N 431.558 2.498 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc5c(c4)OCO5)CC3)cc2F)CC1 1323281415 FDFCITZXGOLPSM-UHFFFAOYSA-N 440.519 2.264 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ncoc4[C@H]4CCCO4)n3)CC2)cc1 1323585766 QVYAWRZPIFASLS-QGZVFWFLSA-N 439.472 2.476 10 20 IECD C[C@@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1341538559 OVGMJSXUFMTRLC-HXUWFJFHSA-N 431.600 2.096 10 20 IECD Cn1cccc1C(=O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429638 QBTSXBOQRTWOOG-UHFFFAOYSA-N 434.452 2.462 10 20 IECD COC(=O)C12CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)c(O)c(Cl)c3)(C1)C2 1800718961 MZYNPONYNDIUBK-ABHVRBQOSA-N 448.903 2.346 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ncccc1F 1804289057 VHCGLNJXQNECBK-RRJKNOHSSA-N 427.432 2.303 10 20 IECD CN(C)CCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811802713 ABRNQCVFPFIPMQ-FOIQADDNSA-N 446.935 2.418 10 20 IECD Cc1occc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816438244 OZNVYKYMFJJHDM-AWEZNQCLSA-N 447.542 2.477 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843431 OARPKGANGAAARC-AWEZNQCLSA-N 445.476 2.254 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccon2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146561 QFTYMAHPWLMHON-GOSISDBHSA-N 447.455 2.497 10 20 IECD Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1825532521 RSPJSCZNRGRGMN-MRXNPFEDSA-N 448.614 2.417 10 20 IECD COCc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427018 BGFWJYJVKHCIPC-QGZVFWFLSA-N 444.488 2.174 10 20 IECD CC1(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CCCC1 1833124871 UWPONUPWIYUHIY-UHFFFAOYSA-N 430.549 2.258 10 20 IECD COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1841345395 FHHDZTFCPLNTDW-STQMWFEESA-N 436.892 2.158 10 20 IECD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(C)(C)C 1841499087 MAVZIWRRZPVCML-KRWDZBQOSA-N 437.924 2.119 10 20 IECD Cc1cc(Br)cnc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842558839 HXHPVPSRKSGUEF-UHFFFAOYSA-N 447.289 2.090 10 20 IECD CC(C)(C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1ccccn1 1847037421 PHWOUYUHPBMYPK-CSKARUKUSA-N 437.496 2.393 10 20 IECD CSc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038702 NMESRRSRKMOCPT-SOFGYWHQSA-N 441.509 2.451 10 20 IECD Cc1cc(C(=O)CSc2nnnn2C(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 21739697 CTRRKGIMXJSJMV-UHFFFAOYSA-N 434.547 2.284 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCn3nnc4ccccc4c3=O)cc2F)C[C@@H](C)O1 108287485 LCDMMCMPPUZCNS-HZPDHXFCSA-N 439.491 2.251 10 20 IECD NS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726631868 GVYJMPQCWJEYMJ-UHFFFAOYSA-N 425.457 2.334 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)cc2F)CC1 730269072 NHSIJIHCAMSKRE-UHFFFAOYSA-N 436.509 2.495 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](Cc1ccccc1)CN1CCOCC1 732453624 YZQRKILMZSBJPD-QHCPKHFHSA-N 438.572 2.266 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)cc2F)CC1 734213465 BMMVDZBKGKXKDS-MOPGFXCFSA-N 433.572 2.414 10 20 IECD O=C(CN1CCC(CN2CCCCC2=O)CC1)NCc1ccc(N2CCOCC2)c(F)c1 744403220 NRTVDJDQIGYRFP-UHFFFAOYSA-N 446.567 2.003 10 20 IECD Nc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1 746479426 ZSCGWYOWWQLMAX-UHFFFAOYSA-N 431.514 2.470 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)C2CC2)cc1 747476037 IHLWLNTUBFBRBA-UHFFFAOYSA-N 443.569 2.469 10 20 IECD CCOC(=O)c1c(NC(=O)CCN2CCO[C@@H](C(N)=O)C2)sc(C)c1-c1ccccc1 747839787 YVQHURSPFMVZAA-MRXNPFEDSA-N 445.541 2.415 10 20 IECD CCOCCO[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 750261794 IUJQFABKZBKFRI-IBGZPJMESA-N 449.573 2.052 10 20 IECD COCCN1CCC[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060276 AOVOXHFFGJQUSM-HNNXBMFYSA-N 439.559 2.095 10 20 IECD Cc1c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnn1-c1ccccn1 751229587 ZFMSBGBJCKFDIE-UHFFFAOYSA-N 445.520 2.154 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](Cn2ccnn2)C1 752631836 QMKVHWKYUYAPJY-AWEZNQCLSA-N 447.542 2.398 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC(C)(C)C(=O)NCC3CCCCC3)CC2)cc1 754080992 IUVVECMURCFSDB-JOCHJYFZSA-N 446.636 2.243 10 20 IECD Cc1nc(N2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)sc1C 754348321 BNHQIQAMYNRKCP-UHFFFAOYSA-N 447.580 2.174 10 20 IECD CNS(=O)(=O)c1cccc([C@@H](C)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 764682822 ICQRMFMTLTXLFL-LJQANCHMSA-N 446.617 2.466 10 20 IECD CON(C)C(=O)[C@H](CCSC)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 767163900 MEVSCCXCAKWORT-IRXDYDNUSA-N 425.551 2.224 10 20 IECD CC(C)(O)[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770072094 WIOWUZKVEINTHG-SFHVURJKSA-N 449.485 2.477 10 20 IECD Cn1cnn(-c2ccc(NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)c1=O 771460144 NMTLNOLCVXBTFK-UHFFFAOYSA-N 436.516 2.101 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(C(F)(F)F)cn1 772929334 REWVNHUQOIGTJJ-UHFFFAOYSA-N 426.370 2.331 10 20 IECD C[C@H](NC(=O)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1)c1ccc(N(C)C)cc1 773614443 AGBVTDCZXPFWQG-INIZCTEOSA-N 440.573 2.410 10 20 IECD COc1c([N+](=O)[O-])ccc(CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1O 775028306 PBEDPIWKDIVSRI-UHFFFAOYSA-N 435.502 2.393 10 20 IECD O=S(=O)(NCc1ccco1)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 776303195 GZKORXYFYPOWEA-UHFFFAOYSA-N 434.455 2.095 10 20 IECD CCc1nc(CCNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 778252586 ABNWQBKQUXTEAH-HJWRWDBZSA-N 428.558 2.278 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 782108229 YDZABDDYBLTIPO-HNNXBMFYSA-N 441.484 2.134 10 20 IECD COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310176 JFAWIPPQKFPCMC-HXUWFJFHSA-N 437.540 2.384 10 20 IECD CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313839 WLJGNMUKRVPYJO-JOCHJYFZSA-N 425.529 2.030 10 20 IECD Cc1cc(C)nc(-n2nccc2NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 789309867 NHYLKLGCAQPQHM-GOSISDBHSA-N 448.531 2.303 10 20 IECD CCc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 789825634 NFTQXJNRJNGWGA-OKILXGFUSA-N 434.537 2.391 10 20 IECD CCN(C[C@@H]1CCOC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789954756 LOIZRTGWWRVUKF-HNNXBMFYSA-N 443.466 2.043 10 20 IECD C[C@@H](C1CCCCC1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735360 XNQQXQMJSWJSNM-FXAWDEMLSA-N 428.577 2.432 10 20 IECD Cc1cc(C(=O)CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 794805528 XSOCCTCZQYANKN-GOSISDBHSA-N 447.557 2.014 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](CS(C)(=O)=O)C1 795091326 STERBKIHLMSSDI-GJZGRUSLSA-N 440.521 2.156 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(C)c2Cl)cc1 797431434 OLRFOVIGLFBQPD-UHFFFAOYSA-N 433.895 2.024 10 20 IECD CC(C)(C)OC(=O)N1CCC(C(=O)NCCc2ccc(O)c(O)c2)(n2cccn2)CC1 802778483 CJWNPUULRQHRSY-UHFFFAOYSA-N 430.505 2.379 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)cc1F 803242971 IPWVTWGTCZRBAM-HNNXBMFYSA-N 434.462 2.429 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 803661006 MLHBFMWOBYQXPY-SFHVURJKSA-N 429.492 2.421 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)cc1F 803662159 SPRLPZWVOBKRIJ-UHFFFAOYSA-N 427.455 2.192 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)nc1 803663645 VTHPJPIBZUGTSO-UHFFFAOYSA-N 441.507 2.089 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 807023836 FITQCXNSUCLMBN-OAHLLOKOSA-N 442.516 2.064 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)CS(C)(=O)=O)cc2Cl)C1 807952537 NKQIQGHEIIVUGL-GJZGRUSLSA-N 443.997 2.084 10 20 IECD COc1cnc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 815521668 VAVGBNSJACALIW-GFCCVEGCSA-N 431.404 2.445 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2N1 815715509 KCACBONNTXFITR-CQSZACIVSA-N 444.438 2.369 10 20 IECD Cc1cc(C)n2c(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)nnc2n1 917176743 VVQHTBNZLVQCCL-UHFFFAOYSA-N 430.509 2.125 10 20 IECD O=C(CSc1nnnn1C1CCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 919969252 SBTKBJWNYMPVDZ-UHFFFAOYSA-N 430.578 2.405 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)NC4CCCCC4)CC3)cc2F)CC1 1254011035 RLZBBGWKKOIQOS-UHFFFAOYSA-N 431.600 2.144 10 20 IECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 1320122313 XIPRIWFHRPILIA-UHFFFAOYSA-N 442.472 2.081 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1CCCCO1)C1=NN(c2ccccc2)C(=O)C1 1794020850 BOESQQAMYGBDGC-GSEOLPGOSA-N 438.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1)c1cc(O)c(O)c(Cl)c1 1796287362 YUYUXLGPPGHZFQ-BTTYYORXSA-N 447.875 2.026 10 20 IECD COc1ccc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804336042 SUNYNOQFPFHVHP-QDMKHBRRSA-N 447.582 2.116 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)COC2CCCCC2)C1 1841229043 LTNHMKVGPCQFDO-UHFFFAOYSA-N 438.528 2.332 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2CCCSC2)C1 1847020811 XXPIWLOKHAMBMB-MRXNPFEDSA-N 426.542 2.126 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCc3nc4ccccc4c(=O)[nH]3)CC2)cc1 17812967 IEKVGICQZIJVJV-UHFFFAOYSA-N 449.555 2.193 10 20 IECD COc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 60106112 GMJQAPSNJXOXNP-MRXNPFEDSA-N 447.557 2.273 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCn3c(Cc4ccccc4)nnc3C2)n(C)c2ccccc12 576305501 ZHJCTWKQJOCXBX-UHFFFAOYSA-N 442.523 2.328 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(CSC)cc3)CC2)cc1 727615886 OMTNJNKHQIUVTK-UHFFFAOYSA-N 442.585 2.435 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1 729536224 XLTOVGAPZVOHFE-DFVNDGMQSA-N 437.496 2.381 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCNC(=O)c3cccs3)cc2F)CC1 730117141 UUFJYQAHTXFSOU-UHFFFAOYSA-N 433.553 2.258 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)cc1F 731408668 BBDOVTZITYCNRU-UHFFFAOYSA-N 425.468 2.211 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 735754050 XDQIJQFPJICSIK-UHFFFAOYSA-N 432.546 2.451 10 20 IECD COCCOc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 740610238 UUAQKIIAFAWWEK-UHFFFAOYSA-N 433.530 2.214 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c[nH]1 742334287 JEMLRPZMRNXMDO-GFCCVEGCSA-N 429.445 2.350 10 20 IECD CN(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCOCC1 746414450 PIGMJHXFIZHBRP-UHFFFAOYSA-N 428.512 2.263 10 20 IECD CCC[C@H](C)NC(=O)[C@@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 747835691 RSDCTCGTNHKRJC-VQTJNVASSA-N 430.593 2.361 10 20 IECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749556144 XECIKFAQXJIOHM-QPHCHLROSA-N 442.585 2.467 10 20 IECD COc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 751353624 JPLZWQNOFLRPQS-UHFFFAOYSA-N 448.516 2.348 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 754080955 HCLRPWPWNPFJCN-CTNGQTDRSA-N 440.592 2.053 10 20 IECD COc1ccc(NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)c([N+](=O)[O-])c1 767693005 SEIFHGSZBNBJLY-UHFFFAOYSA-N 425.492 2.167 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1 768034513 RTRQIPPVQTXSHL-UHFFFAOYSA-N 434.452 2.402 10 20 IECD O=S(=O)(c1ccc(Cl)s1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768443039 XOVXCAODBXYTLT-CQSZACIVSA-N 430.935 2.039 10 20 IECD COc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCCC[C@H]4O)CC3)CC2)cc1F 769164513 BNYHVWSTUVBZHF-NHCUHLMSSA-N 434.556 2.434 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(S(=O)(=O)N(C)C)nc1 771406406 JSBMDXGSDMABAK-UHFFFAOYSA-N 442.335 2.462 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2F)CC1 774494741 NOKVNKIIDPMLRD-UHFFFAOYSA-N 447.599 2.009 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCCc3cc(S(=O)(=O)N(C)C)ccc32)c1 775372731 HJFWOBQREOLCLS-OAHLLOKOSA-N 447.557 2.281 10 20 IECD CCN(CC)C[C@@H]1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295564 QTVZHPHIVYBTTR-PISNEZEASA-N 428.577 2.090 10 20 IECD O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NCc1ccc(O)c(O)c1 778917136 YRIQNXOBNIRYAE-UHFFFAOYSA-N 432.420 2.492 10 20 IECD COC(=O)CCSc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785295288 SNUPKOJHIRZMJA-ZDUSSCGKSA-N 432.498 2.439 10 20 IECD CCN(C[C@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313844 WLJGNMUKRVPYJO-QFIPXVFZSA-N 425.529 2.030 10 20 IECD CCCCN(C)CC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788321127 SUESSMPOIMFULK-UHFFFAOYSA-N 430.593 2.110 10 20 IECD COc1cccc(Cl)c1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798092 BGFJCEDGOKPNNB-UHFFFAOYSA-N 435.883 2.257 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H](N(C)C)C3)cc2F)C[C@@H](C)O1 789823706 FDYBNLHZGKLTIV-UKBAYJJMSA-N 434.556 2.045 10 20 IECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824580 JJMWUTRITCUIPH-NSHGMRRFSA-N 448.583 2.292 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@@H](Cc2ccccc2)C1 789841467 YXCJIWITBMWVMZ-FQEVSTJZSA-N 439.531 2.494 10 20 IECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 790964693 ULRRMMOSROUGGI-GFCCVEGCSA-N 437.294 2.037 10 20 IECD C[C@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793728371 YHGBNUMMHOOHMK-PXNSSMCTSA-N 434.540 2.150 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(OC)cc2O)(c2ccccc2)CC1 794380966 GQGKMAGYEPQUIM-UHFFFAOYSA-N 432.542 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]4C3)CC2)cc1 796599108 NOXVOUPQDBBCKJ-KDURUIRLSA-N 444.576 2.143 10 20 IECD CN1CCC[C@@H](CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448590 CRFPRFDMOTUKGY-MRXNPFEDSA-N 438.519 2.173 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@]2(CCOC2)O1 803677156 HDURNLIRJBWYBT-UUOWRZLLSA-N 429.561 2.478 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1F 804852958 JKYNSQYCBLSUOT-RDJZCZTQSA-N 436.528 2.271 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)cc2)CC1 805024671 LDQSUBGDSSTCRJ-WOJBJXKFSA-N 428.577 2.302 10 20 IECD COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 808029426 MSGPWHFHRDIQLD-MJGOQNOKSA-N 432.565 2.473 10 20 IECD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC=C1C(=O)NC(=S)NC1=O 814319150 QKENHWXSXBCMMR-UHFFFAOYSA-N 446.466 2.327 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)cc2)CC1 857494621 SDVXYJZEESVQMX-QHCPKHFHSA-N 437.540 2.382 10 20 IECD CN(Cc1ccccc1O)C(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 917308036 YDQAOKILCMAQOX-UHFFFAOYSA-N 446.525 2.223 10 20 IECD O=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917918619 VYOSYKNFLNSSKM-UHFFFAOYSA-N 433.505 2.033 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 918442839 QPXCEBVEMICBEV-UHFFFAOYSA-N 442.491 2.248 10 20 IECD O=C(CCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970541 KHWVVILOVKOGRO-UHFFFAOYSA-N 439.487 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 920252022 FRPPMIJVUSXWOO-GJCOWUBNSA-N 448.567 2.291 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](CO)C3CCCCC3)CC2)cc1 1117735368 XRIHZPBXEQTJRW-YVNCXZRQSA-N 429.561 2.205 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)COc4ccc(F)cc4)CC3)cc2F)CC1 1341539209 XNIRIXOBHHLUDY-UHFFFAOYSA-N 444.526 2.440 10 20 IECD C[C@@H](Sc1cccs1)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1778809258 LFCBFLHARQCZQO-XCLFUZPHSA-N 449.554 2.179 10 20 IECD Cc1ncsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932516 GIATXQUONYGDEW-ACHSLPGTSA-N 437.525 2.496 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469395 MMDGXEMCTSEALA-AVRDEDQJSA-N 431.496 2.290 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCOC2)[nH]n1 1823479800 QPZIUBXIBUNCLY-WQELODFKSA-N 442.472 2.269 10 20 IECD Cc1cc(/C=C/C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)no1 1844313119 MNBDOVIGQLQNGJ-NSLJXJERSA-N 425.441 2.030 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(CN2C(=O)CCC2=O)cc1 19355101 GEOBFLZLPUBXAK-UHFFFAOYSA-N 437.496 2.217 10 20 IECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1=O 554728461 VXPGAHCENJPTTP-KRWDZBQOSA-N 434.496 2.033 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(NC(C)=O)c(OC)c3)CC2)cc1 726727020 YZQPZIFEWZZWNV-UHFFFAOYSA-N 440.500 2.386 10 20 IECD COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3cccc(-n4cnnn4)c3)n2)cc1 727244244 WEZUTILQDRTYSJ-UHFFFAOYSA-N 442.482 2.373 10 20 IECD Cc1ccc2cccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2n1 727615704 QAQLRBGDFMCIQW-LJQANCHMSA-N 445.523 2.500 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 728025164 YTEFSXSNNKQNDM-XBNBKLGLSA-N 446.617 2.191 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)cc2F)C[C@@H](C)O1 728746066 POIILLSWKXJHLS-XWOARTFESA-N 434.556 2.180 10 20 IECD CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729062876 GBQCYLPTIRCHOA-OAHLLOKOSA-N 443.500 2.464 10 20 IECD COc1c(C)cnc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 747860977 LGLOIDCUZPGKCE-GOSISDBHSA-N 425.533 2.408 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 751818262 NNNSDVWWHNFDTE-UHFFFAOYSA-N 438.528 2.131 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 754026770 YAMKNAIEXZDCGO-TZIWHRDSSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](Cn3cccn3)c3ccccc3)CC2)cc1 754068843 SITQCKBQCAEFHH-NOZRDPDXSA-N 435.572 2.406 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccn(CC(F)F)n3)cc2F)C[C@@H](C)O1 754924092 VNONMZOCEINRHH-CHWSQXEVSA-N 439.438 2.156 10 20 IECD COc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1[N+](=O)[O-] 769602186 KGZWFJNZODGKEU-UHFFFAOYSA-N 447.419 2.052 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4csc(NC(C)=O)n4)n3)CC2)cc1 771055595 GTHQLSXJVAHUAK-UHFFFAOYSA-N 442.501 2.051 10 20 IECD C[C@H](NC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773132728 UUOKXRNBQZMKJW-KRWDZBQOSA-N 446.573 2.334 10 20 IECD CC[C@]1(O)CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 779335763 LQZRQWWKPPUREV-IBGZPJMESA-N 435.458 2.088 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H](CO)C1CCOCC1 782498228 CLOHVVPIUOPAOC-GOSISDBHSA-N 431.455 2.129 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cscc2Br)SC1=S 794682857 YPGLRHLZRFCGCX-WTKPLQERSA-N 427.392 2.261 10 20 IECD CN(CCO)S(=O)(=O)c1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 798332599 WUDQFLHGLMCWMS-UHFFFAOYSA-N 444.509 2.441 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OC 798441496 ZHCSWZNEHLCQJO-UHFFFAOYSA-N 448.541 2.169 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cc(COC(C)(C)C)on1)c1ccc(N2CCOCC2)cc1 803300328 SAVYLKZHERKISH-MRXNPFEDSA-N 444.532 2.320 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(CCCN(C)C)CC1)c1ccc(N2CCOCC2)cc1 803307208 YJTYKHWAFCUWBG-LJQANCHMSA-N 430.593 2.281 10 20 IECD COCCO[C@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677306 LZIXCVIFPKBJBW-YADHBBJMSA-N 447.576 2.008 10 20 IECD CO[C@@H]1CCC[C@@H]1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804108983 ASCJMCKKOPDCRM-IIDMSEBBSA-N 425.476 2.304 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc1 804975564 PJAPUJVSEKTNSH-UHFFFAOYSA-N 437.587 2.236 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(F)c(S(=O)(=O)N(C)C)c3)CC2)cc1 806544062 RZKRXGCXJLSBGQ-UHFFFAOYSA-N 436.509 2.439 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc4n(n3)CCCC4)cc2F)C[C@@H](C)O1 806842361 IZGZEHSFGSERCY-HUUCEWRRSA-N 429.496 2.227 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@](C)(CNC(=O)OC(C)(C)C)C1 807098487 YWKIUGPNQXYLME-HSZRJFAPSA-N 432.565 2.441 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@@H]1CCOC1 807954955 IXFHYULOVSORSY-SJLPKXTDSA-N 437.968 2.456 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2nc3n(c2=O)CCCCC3)cc1 1318319389 UKEOWSJNMLTYBM-UHFFFAOYSA-N 425.455 2.428 10 20 IECD CCc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767261 HVSPCDRKCVSDLU-HBCWATKFSA-N 445.903 2.226 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1807994301 GJYMPASCKKRXQB-XBQZDBRBSA-N 449.467 2.217 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncc[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145960 OROUNZRZBUONST-QGZVFWFLSA-N 446.471 2.232 10 20 IECD CN1CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827425182 ZRWUMONUAXSLMO-HXUWFJFHSA-N 444.576 2.458 10 20 IECD O=C(CC1CCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435321 GYGMZFJSKMVAPA-OAQYLSRUSA-N 438.908 2.011 10 20 IECD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccc1C=O 1843022539 NUQXDLKFDGDBMY-ZDUSSCGKSA-N 431.876 2.443 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc(S(C)(=O)=O)c3)n2)c[nH]1 727247975 YBITVOXKGLQRRJ-UHFFFAOYSA-N 441.512 2.129 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1 728149316 DMWMBZZKDRFHRJ-QPJJXVBHSA-N 437.426 2.095 10 20 IECD C[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(=O)N1c1cnn(C)c1 745919060 QJJOLPADKSTJCP-AYOQOUSVSA-N 427.505 2.010 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccccc3CSC)CC2)cc1 759370240 RAVOMPDBVZVGBR-UHFFFAOYSA-N 442.585 2.435 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(C)c(C(N)=O)c3)CC2)cc(OC)c1OC 759963370 PCJKWQBIBHLNDJ-UHFFFAOYSA-N 428.489 2.474 10 20 IECD CCN1CCN(c2ccc(-c3noc(-c4cc(NS(C)(=O)=O)ccc4O)n3)cn2)CC1 761939711 ROCHLVMMRXJQMI-UHFFFAOYSA-N 444.517 2.018 10 20 IECD CCc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1S(C)(=O)=O 765667058 VOYGQLSQMWBHCD-UHFFFAOYSA-N 436.555 2.140 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1F 765927429 RMGDFTCPTPSBQP-VWLOTQADSA-N 429.267 2.286 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C(F)F)c3)cc2F)C[C@@H](C)O1 767999358 OOSXXKBUSDDLCZ-TXEJJXNPSA-N 425.411 2.286 10 20 IECD C[C@@H]([C@@H](C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)S(C)(=O)=O 769857291 FXYQDVZSMFQKAX-NEPJUHHUSA-N 446.572 2.148 10 20 IECD CC(C)CO[C@H](C)c1noc(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 769934260 QSEDMTZKNYRNGD-GFCCVEGCSA-N 426.495 2.153 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cn(CCC(C)C)nn4)n3)CC2)cc1 771064323 AFAKQAIVAVUZJJ-UHFFFAOYSA-N 439.520 2.274 10 20 IECD C[C@@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1cccc(S(=O)(=O)N(C)C)c1 775334539 ODXJVZXIJYJNMZ-QGZVFWFLSA-N 432.590 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CCN(C)C)Cc3ccco3)CC2)cc1 778319282 UBJUOZYPIAEHDP-ZHACJKMWSA-N 440.544 2.083 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccccc3-c3nc[nH]n3)CC2)cc1 778393856 OGJLLTPKPLITPQ-KHPPLWFESA-N 432.484 2.324 10 20 IECD O=S(=O)(Nc1ccccn1)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 781649739 WHLNIAATRQWWQG-UHFFFAOYSA-N 431.455 2.219 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1 788937916 OSQFTROKCWGZBN-UXHICEINSA-N 443.569 2.316 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c(O)c1 797388468 ZOOQDRDGGRMTJG-HZPDHXFCSA-N 427.501 2.265 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1OC 799121554 DODGKQKLUNHNPM-UHFFFAOYSA-N 447.922 2.010 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3Oc3cnn(C)c3)nc12 801466152 JUIGYTUDCYSHJW-UHFFFAOYSA-N 437.412 2.494 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298387 SMXNRVDIQINYPU-KBMIEXCESA-N 437.540 2.475 10 20 IECD C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662061 GNFOGUASKMLZGC-GDBMZVCRSA-N 436.528 2.270 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cc1F 804853257 VEEIVVGKZILIGR-CQSZACIVSA-N 432.462 2.383 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccc[nH]3)cc2F)CC1 805008921 UTTLPXCNNWKSTB-NRFANRHFSA-N 427.524 2.276 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807636356 YXGFNKAQNNEQHO-SFHVURJKSA-N 441.528 2.074 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 807847248 ULMYCYCJWSTHPS-NRFANRHFSA-N 436.556 2.061 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(N4CCOCC4)cc3)cc2)CC1 863994209 VYSOPSFEBSDMLO-UHFFFAOYSA-N 430.574 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ccc(OC)c(F)c3)CC2)cc1 914469815 XJSFWSQQDHURGS-UHFFFAOYSA-N 436.505 2.107 10 20 IECD O=C(O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)NCc3ccc(N4CCCC4)cc3)cc2)C1 915220721 OWWGDBABTULZQA-KRWDZBQOSA-N 443.525 2.203 10 20 IECD CC(C)Cn1nnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917202164 AQOXNRQWQTYWRL-GJZGRUSLSA-N 436.557 2.490 10 20 IECD COc1ccc(N2CCCN(CN3C(=O)C(=O)c4c(OC)cc(OC)cc43)CC2)cc1 917485177 LPWTZHKWKZKSDS-UHFFFAOYSA-N 425.485 2.412 10 20 IECD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1OC 919877792 BQXLKJZRUJFWSI-UHFFFAOYSA-N 449.485 2.489 10 20 IECD COc1ccc(N2C[C@@H](C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2=O)cc1 919969500 NXDZTLHZSIDPIA-KRWDZBQOSA-N 441.503 2.465 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3ccc(C(N)=O)cc3)CC2)cc1 1317886281 NECLPFCVPIOBMC-UHFFFAOYSA-N 439.560 2.148 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CCCCC1)C2)c1cc(O)nc(O)c1 1777848220 MYZUOIXTVYUHQA-IIBYNOLFSA-N 435.496 2.293 10 20 IECD Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)co1 1781121076 AVWAMPVEWIBPFY-DYESRHJHSA-N 449.891 2.489 10 20 IECD CCc1noc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782006994 FIGRIVOSSCIZIQ-NRFANRHFSA-N 449.891 2.367 10 20 IECD CC[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)N(CC)CC 1810547953 ZWXVBXUTFGQHKL-GOSISDBHSA-N 432.565 2.458 10 20 IECD Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722338 YBQSWPUDTBDIGD-GFCCVEGCSA-N 443.485 2.023 10 20 IECD O=C(Cc1cscn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817545630 ADIRFMIDFDYTQR-AWEZNQCLSA-N 428.474 2.221 10 20 IECD COc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844299 WURCBIHAQLNCLY-OAHLLOKOSA-N 438.444 2.239 10 20 IECD CC1=CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CC1 1835433277 BJXPQUGWILDUKX-KRWDZBQOSA-N 442.560 2.424 10 20 IECD CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 725904225 RDZBWBQCBKUEMQ-AWEZNQCLSA-N 427.523 2.235 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1 729062459 BHJYOLRGFDTNNZ-SNVBAGLBSA-N 426.878 2.274 10 20 IECD C[C@H](CN1CCN(C)CC1)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 730127361 QBQVWSIYJQVOGA-MRXNPFEDSA-N 425.524 2.192 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@@H]3CN3CCCC3=O)cc2)C1 732447773 CFXSUEHXVOCNTD-TZIWHRDSSA-N 441.576 2.075 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)cc2F)C[C@@H](C)O1 733851010 VOPJEMZUUPUHIC-OKILXGFUSA-N 440.475 2.189 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1C 735314746 SMSZYBMGCHFULD-SFHVURJKSA-N 431.558 2.492 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 736986848 XJDMEVHZUBQBTE-UHFFFAOYSA-N 432.546 2.404 10 20 IECD CCNC(=O)c1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743299552 RVSWYZUKLYYOLN-UHFFFAOYSA-N 425.533 2.389 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)CN1CC2(CC1=O)CN(C(=O)OC(C)(C)C)C2 744432170 PJQCRSLQMVWALL-UHFFFAOYSA-N 444.576 2.382 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H]3C[C@H](N(C)C)CC[C@@H]32)c1 746655073 ZPDFCFCIUWFBBN-XPWALMASSA-N 431.577 2.111 10 20 IECD COC(=O)c1csc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227705 JZTBSGNUGYTAGY-UHFFFAOYSA-N 428.507 2.113 10 20 IECD O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)N(Cc1ccco1)Cc1ccccc1O 752089502 XOLVTYKAYWSYQO-QFIPXVFZSA-N 441.528 2.227 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1 752656834 LCCPZEUSDJDGDT-UHFFFAOYSA-N 446.573 2.428 10 20 IECD CCn1ncc2ccc(NC(=O)C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cc21 754211573 GMBCDHCBHXKWKQ-UHFFFAOYSA-N 425.464 2.491 10 20 IECD O=C(NCCc1ccncc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 762652979 BKHPROZWHFENHI-UHFFFAOYSA-N 435.507 2.379 10 20 IECD C[C@H](NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1)c1ccc(N2CCOCC2)cc1 764363782 QLLSEKFCPGVOIC-QTEQDKRBSA-N 429.609 2.252 10 20 IECD C[C@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1 764444898 XDGCHZRZHZXMJO-LSDHHAIUSA-N 431.505 2.333 10 20 IECD Cc1cc(=O)n(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Br 766117255 ODQAINOSDQJCME-UHFFFAOYSA-N 438.297 2.211 10 20 IECD O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1ccc(N2CCCC2)cc1 767700113 YKMMBLYCQNZEEX-UHFFFAOYSA-N 427.526 2.393 10 20 IECD COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774356637 JZINFVVPCRQAPR-UHFFFAOYSA-N 442.390 2.439 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1OC 775273037 COSYRSMIGZOZCR-UHFFFAOYSA-N 442.441 2.016 10 20 IECD CCOC(=O)c1cnc(C)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 779081805 FYQOMHWIIIFKPQ-UHFFFAOYSA-N 446.529 2.123 10 20 IECD CC(C)NC(=O)c1cnn2c1C[C@H](CNCc1ccc(N3CCOCC3)c(F)c1)CC2 785562623 HPRIWCQBLFIBRQ-GOSISDBHSA-N 429.540 2.349 10 20 IECD COc1cc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc(OC)c1OC 787857644 UYHFZEIXNPXZOJ-ZDUSSCGKSA-N 433.480 2.411 10 20 IECD CC(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789823312 DCJIBSKECXVVCE-IRXDYDNUSA-N 435.540 2.472 10 20 IECD C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950290 NSBIMUGPUQYXQN-QLFBSQMISA-N 443.466 2.183 10 20 IECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)CC2 803300804 KLOKOFJERHNAEH-PXNSSMCTSA-N 439.560 2.152 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1F 803659025 ITEPNJGGZRRAAF-UHFFFAOYSA-N 449.486 2.472 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)C2CC2)cc1 804737432 QZTLHHNZFBKBDH-UHFFFAOYSA-N 428.577 2.005 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC[C@H]1NC(=O)OC(C)(C)C 807291167 GYYIOAULHJQRIH-FXAWDEMLSA-N 442.560 2.441 10 20 IECD Cn1ccnc1[C@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769542 HHSQLHFNWIBSMA-HOTGVXAUSA-N 447.486 2.123 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)cc1 808112706 ZUMJPJIMRGIRFB-CYFREDJKSA-N 441.528 2.329 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F)c1ccc(N(C)C)cc1 810388522 YFFQVJUPWIUKOA-GFCCVEGCSA-N 434.443 2.311 10 20 IECD COCCCNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 822948423 QXTGJKAVHBCQTE-GFCCVEGCSA-N 440.408 2.068 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 914756112 GENPHGHVGQSDDQ-GOSISDBHSA-N 431.558 2.168 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc4c(c3)S(=O)(=O)N(CC)C4=O)CC2)cc1 1253686199 WEYOYDFWHBGYHJ-UHFFFAOYSA-N 443.525 2.212 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 1324159785 ZUOVZXQHANUZPI-IYBDPMFKSA-N 435.521 2.034 10 20 IECD CN(C)CC(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788672560 SCWNEHDZWYWLBI-UHFFFAOYSA-N 433.512 2.475 10 20 IECD COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1794866860 ZCEHZTIXKZKOFE-VBUUOAMHSA-N 447.495 2.135 10 20 IECD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)n1cccc1 1807998780 OMJATRIJXGODFB-LDBYXDLTSA-N 435.484 2.270 10 20 IECD Cc1onc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1C 1817843657 VKROYJGNSQRJGO-AWEZNQCLSA-N 426.433 2.440 10 20 IECD CC(=O)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821981408 OHGIDWYAWFMCLB-HNNXBMFYSA-N 449.895 2.306 10 20 IECD CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1827428452 QOTQECWAVMJVDU-GOSISDBHSA-N 441.532 2.336 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCCC2)CC1 1832965839 JNJAGGMEEJDBBH-IBGZPJMESA-N 430.549 2.212 10 20 IECD O=C(c1cc[nH]c2nccc1-2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441524 FXLJBMKOSNPMGS-UHFFFAOYSA-N 442.479 2.124 10 20 IECD O=C(c1cc2ccoc2cn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442319 KUKTWJBXFOJTIG-UHFFFAOYSA-N 443.463 2.438 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)Cn3ccncc3=O)C2)cc1 1845768086 NLZDDKHUHZAAQZ-UHFFFAOYSA-N 445.523 2.168 10 20 IECD O=C(c1cc2ncccc2[nH]1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039441 QCAUSXCNKYTPNM-FNORWQNLSA-N 434.452 2.210 10 20 IECD COc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1OCC(N)=O 108458382 CZZBKWWWGPTWHX-GJZGRUSLSA-N 445.491 2.242 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](O)COc1ccc(F)c(F)c1 729598069 VQMOFSLQRDNSDI-OAHLLOKOSA-N 439.434 2.180 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCCS(=O)(=O)CC1 732119237 SBYYLLKLQRSGPD-WYMLVPIESA-N 444.625 2.377 10 20 IECD COc1cc(C)cc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1O 732476709 SZSSFVNGSGVFIE-UHFFFAOYSA-N 435.502 2.343 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC[C@H](N3CCNC3=O)C2)c([N+](=O)[O-])c1Br 733994420 PPJQYHWPGGPOCU-VIFPVBQESA-N 444.242 2.268 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1 734688502 QADMKKAPKIKAQO-UHFFFAOYSA-N 440.573 2.158 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1N1C(=O)CCC1=O 741097172 NEZUQUCMOIXPBM-UHFFFAOYSA-N 432.480 2.280 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccnc(OC(C)C)c3)CC2)cc1 752155735 ZGNZJVJYGNSIQK-UHFFFAOYSA-N 427.549 2.499 10 20 IECD COc1cccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 752568721 FCUXUZCHNUOHMB-GJZGRUSLSA-N 431.464 2.316 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3ccsc3c2)cc1C(=O)O 753076342 ANGICPMSPJKDJU-UHFFFAOYSA-N 427.485 2.167 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(C)(C)CNC(=O)OC(C)(C)C)CC2)cc1 756923842 KHPSENMGNGRJFZ-UHFFFAOYSA-N 434.581 2.484 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cc(N(C)C)ccc3[N+](=O)[O-])CC2)cc1 758233574 VFBUDRHFLXWVRY-IBGZPJMESA-N 430.505 2.231 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C)[C@@H](n4ccnc4)C3)CC2)cc1 759576414 VHBVBYFKQLXDOJ-KNQAVFIVSA-N 426.565 2.306 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)cn1 769665435 BRUSFMOUWSRUTC-UHFFFAOYSA-N 436.471 2.022 10 20 IECD COc1ccc(N2CCN(Cc3cc(OC)c(OCC(N)=O)c(OC)c3)CC2)cc1F 770308080 YHUYHUOJCZPHOV-UHFFFAOYSA-N 433.480 2.038 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCN3CCOCC3)cc2Cl)C1 774468037 HLYKZKFAGNPHJX-KRWDZBQOSA-N 436.984 2.031 10 20 IECD C[C@H](NCC(=O)NCC(=O)Nc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 775259646 WODQOFTUPWZUFN-HNNXBMFYSA-N 432.471 2.207 10 20 IECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1C(=O)NCC(F)(F)F 775687573 FMWYRSVUKVFMQL-UHFFFAOYSA-N 444.479 2.396 10 20 IECD C[C@H](NC(=O)C(=O)NCCCn1cnc2ccccc21)c1ccc(N2CCOCC2)cc1 785410705 HONYYQQACJHZGE-SFHVURJKSA-N 435.528 2.257 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)cc2)C1 785538205 SYRPJYDETSDHSE-XABWRGDLSA-N 425.451 2.360 10 20 IECD CN(Cc1ccccc1)C(=O)CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 787753756 JSORDLAIFNRRMS-UHFFFAOYSA-N 436.556 2.410 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)C3=Cc4ccccc4OC3)cc2)CC1 788916808 NPCHIQCXRZEAPH-UHFFFAOYSA-N 427.526 2.208 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](OC(F)F)C3)cc2F)C[C@@H](C)O1 789824608 JVHFTQHYOLLHTM-IIAWOOMASA-N 443.466 2.286 10 20 IECD Cc1c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nnn1CCOc1ccc(F)cc1 802164348 WZOLSYBIZPYIIA-UHFFFAOYSA-N 449.464 2.134 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1 805153928 DJPCAOCFEZVWBI-UHFFFAOYSA-N 429.517 2.062 10 20 IECD NS(=O)(=O)CCCCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 816889504 APOKQMUVUVAOAI-UHFFFAOYSA-N 437.484 2.007 10 20 IECD Cc1cc(CN2CCN(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)CC2)c(O)c(C(C)(C)C)c1 914851047 XLVYHSDFUZSOSB-QZTJIDSGSA-N 439.622 2.470 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(C(=O)c2ccccn2)CC1 916624879 VVOKKSNIFOKFJH-UHFFFAOYSA-N 425.558 2.302 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2)C1 917833866 UNAAECJBBXXGSX-QZTJIDSGSA-N 438.503 2.197 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1 918039166 BAVKYVWSFDBXGE-UHFFFAOYSA-N 437.500 2.491 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295933 UDYRBUFHCUUYOV-INIZCTEOSA-N 429.429 2.455 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 918440205 PIKMNIFFZKNAOQ-UHFFFAOYSA-N 442.491 2.309 10 20 IECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCc1ccccc1Cl 920638356 XTETVWRHGYCIAJ-NSHDSACASA-N 426.878 2.279 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1 1778482999 SYWMVTBWVZRWSR-JOCHJYFZSA-N 443.525 2.190 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1 1785070253 ZIDSHAYYBXJUOA-FQEVSTJZSA-N 435.839 2.043 10 20 IECD CC(C)(C)OC(=O)NCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1804367712 PKIDGAOKJNUWCO-MUJYYYPQSA-N 448.520 2.050 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1C 1807993338 HYTGNEFPDVCFGD-HRAATJIYSA-N 435.484 2.168 10 20 IECD COc1ncc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cc1C 1808838121 WWXZQMJVNCXJKL-UHFFFAOYSA-N 440.500 2.363 10 20 IECD O=C(c1ccc2ccnn2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810553995 CEHUPGICLGEQGB-UHFFFAOYSA-N 435.484 2.299 10 20 IECD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)n1cccc1 1816729235 YDJVFCCXYLRVHL-WCQYABFASA-N 427.486 2.238 10 20 IECD O=C(CN1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817135954 PFCXUTYRDCXQLY-MRXNPFEDSA-N 428.493 2.008 10 20 IECD CCOCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826459439 APJYRDAOVUIGPZ-KOEDOTQGSA-N 432.517 2.473 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1832185514 AYNBYYLDMMQKIU-LPHOPBHVSA-N 441.532 2.492 10 20 IECD O=C(CNc1ccc(F)cc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441948 KAJAEROXHANTHM-UHFFFAOYSA-N 449.486 2.234 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCN1C(=O)COc2ccccc21 7105468 OYZGCGOLCFQGIL-UHFFFAOYSA-N 425.485 2.070 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(C3CCN(C(C)C)CC3)CC2)n(C)c2ccccc12 554641411 WQOUQYOOXKUNNZ-UHFFFAOYSA-N 439.604 2.120 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)CC3)cc2F)CC1 730133491 VVVNQQXBJBJKFX-UHFFFAOYSA-N 426.540 2.394 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)NCCS(=O)(=O)NC[C@@H]2CCCCO2)cc1 732474732 VSNFIGOLRGFWQZ-FQEVSTJZSA-N 440.610 2.163 10 20 IECD C[C@H](NC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1)c1ccc(N2CCOCC2)cc1 733632125 URHLVQMRQASRBH-INIZCTEOSA-N 439.516 2.011 10 20 IECD CN(CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncnc2[nH]cnc12 742799596 LTYKHSDGUXBWCI-ZDUSSCGKSA-N 431.447 2.176 10 20 IECD CN1CCCc2cc(CNC(=O)[C@@H]3CCCN3C(=O)/C=C/c3ccc(C(N)=O)cc3)ccc21 746814609 UHIMRRZGEKYTAA-XLIBHFEYSA-N 446.551 2.489 10 20 IECD COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751932028 RNERBNCWKYGUAH-ZDUSSCGKSA-N 431.514 2.273 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H](O)c1cccc(F)c1 752878943 HEVVYGGOBMWFKU-RRMPHLOHSA-N 428.508 2.449 10 20 IECD CS(=O)(=O)CCN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC1 753645301 LRTDIGPFGCGBRZ-CQSZACIVSA-N 431.505 2.475 10 20 IECD CCCN(CC(=O)OC(C)(C)C)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 756871151 NMHIOWRSCZYUIE-VAWYXSNFSA-N 445.560 2.480 10 20 IECD COC(=O)c1ccc(OC)cc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758223815 NILRFVDAUKTONY-SFHVURJKSA-N 430.501 2.052 10 20 IECD CCN(C)C(=O)c1cccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758230798 JBDILABHLAYUMW-OAQYLSRUSA-N 427.545 2.349 10 20 IECD CSc1ccccc1NC(=O)CN(C)C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 759591381 HGGPKCIMKKKQFY-NTMALXAHSA-N 430.482 2.473 10 20 IECD O=S(=O)(c1ccc(Cl)c(NC(=S)NCc2ccc(F)cn2)c1)N1CCOCC1 763164603 DBXLHBAWGRKJHG-UHFFFAOYSA-N 444.941 2.382 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)CC2)cc1 765098581 JJIVVCLMOIEAFN-UHFFFAOYSA-N 441.553 2.432 10 20 IECD Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 768024466 JFQJWDCDUDAYRC-UHFFFAOYSA-N 438.528 2.131 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCCN(Cc2ccc(N3CCOCC3)cc2)CC1 768216200 QJRMXBJKJLOKOM-UHFFFAOYSA-N 434.562 2.025 10 20 IECD O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914057 CBQPYQRIKMQZRB-HOTGVXAUSA-N 432.995 2.047 10 20 IECD CCc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769022936 HCBPYCJBLZMBMZ-UHFFFAOYSA-N 425.533 2.332 10 20 IECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 771491149 FNBXRZSTKQYVGC-LJQANCHMSA-N 434.543 2.217 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)c1 777961377 GKFPRQWERDADDG-LLVKDONJSA-N 437.430 2.305 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1-n1cnnn1 781609436 UJXHBEZKGSXBJK-GJZGRUSLSA-N 440.479 2.354 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCn3cnc4ccccc43)CC2)cc1 785411225 KVFGMTLMBBDMQD-UHFFFAOYSA-N 435.528 2.290 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccccc1OCC(=O)N(C)C 785421741 FFBYZIDUZSVDTR-HXUWFJFHSA-N 440.544 2.103 10 20 IECD O=C(NCCc1ccccc1OC(F)F)C(=O)NCc1ccc(N2CCOCC2)cc1 787007372 UTAUUAFIAYAUQP-UHFFFAOYSA-N 433.455 2.100 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(O[C@H]4CCOC4)cc3)CC2)cc1 789201174 YYFGNMTYGRWZLN-QFIPXVFZSA-N 440.496 2.369 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(OC)cc3OC)CC2)cc1 793864227 LWJNRVMRLMXYIS-UHFFFAOYSA-N 441.528 2.110 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1OC 798455309 INZHLVKSCHWMOQ-UHFFFAOYSA-N 430.276 2.428 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(Br)c2F)ccc1O 799123538 AFJVHVITLWEIGG-UHFFFAOYSA-N 439.284 2.003 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1 807025212 RBPNBHQDQVKRIU-CYBMUJFWSA-N 432.448 2.481 10 20 IECD CCc1nsc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 807673716 XWBVJEQJLCMMFK-HNNXBMFYSA-N 430.578 2.083 10 20 IECD Cn1nc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1C1CC1 810379476 YADCXJICVZBZRB-UHFFFAOYSA-N 436.560 2.084 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCC(=O)NC3CCCCC3)CC2)cc1 918125797 SYFIFTMXCMRBSO-UHFFFAOYSA-N 445.608 2.346 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccnc(N2CCOCC2)c1 918205028 FIWGUJKSHHHQGQ-UHFFFAOYSA-N 439.560 2.126 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N2C[C@@H](C(=O)NC)Oc3ccccc32)cc1 918310999 QMWHDXJAKDHQGD-NRFANRHFSA-N 438.528 2.031 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccsc4)n3)cc2F)C[C@@H](C)O1 918632648 AJEQLSBCMFQXMZ-OKILXGFUSA-N 430.509 2.471 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCC(=O)N4)c2)CC1 1255351227 GZNKXMRMCDBDEK-UHFFFAOYSA-N 428.514 2.041 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)F 1793952341 ZDLLCZRUBBNHFQ-NMHLOJTESA-N 432.370 2.355 10 20 IECD CNCCCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804210 SEKDBGJLVLLYSI-QRWLVFNGSA-N 446.935 2.465 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nccn2c1 1818754520 KKTSGQRUHXGOBY-INIZCTEOSA-N 447.455 2.483 10 20 IECD O=C1CC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)[nH]n2)C1 1823405655 BNQRSCAUSLIUCZ-IBGZPJMESA-N 448.483 2.174 10 20 IECD C[C@H](NC=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830330934 FNHNSKPJXGYDKY-GUYCJALGSA-N 437.924 2.119 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832308229 JDXDJVRRBJIIMH-KXBFYZLASA-N 441.532 2.492 10 20 IECD Cc1cccc(C)c1NC(=O)CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 23302794 MGBGUWNWQQUVFJ-UHFFFAOYSA-N 437.588 2.242 10 20 IECD NC(=O)[C@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1Cl 731756313 ISGOZGPAKXLRAL-KRWDZBQOSA-N 448.926 2.459 10 20 IECD CC(C)n1c(S)nnc1[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 732306332 YRSFYLFLKMFREJ-GFCCVEGCSA-N 439.563 2.245 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(S(=O)(=O)c2ccccc2)CC1 740919145 CRTQILHNQVVUOF-UHFFFAOYSA-N 426.542 2.279 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1F 755158299 OSQAPBGKXTYOBP-XAMWDVODSA-N 428.508 2.278 10 20 IECD COC(=O)C1(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCCC1 759274572 WLIXPBGGXGLLIR-UHFFFAOYSA-N 435.521 2.277 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1 759688435 HIMMZOWIBGCMHH-UHFFFAOYSA-N 446.573 2.403 10 20 IECD COCCCN(C(=O)/C=C/c1ccc(Cl)nc1)c1c(O)nc(=O)n(CC(C)C)c1N 759769326 SRROCBMPODGPPW-SOFGYWHQSA-N 435.912 2.318 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN1CC(F)(F)F 763014160 ZYRYEXBKDZOWAV-NVXWUHKLSA-N 441.498 2.166 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763902016 SHSXJVQLJQKQSV-LSDHHAIUSA-N 440.521 2.156 10 20 IECD C[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(=O)(=O)C1CCOCC1 765687629 VALBFXXDVZQDEF-HUUCEWRRSA-N 446.516 2.355 10 20 IECD Cc1ncc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(N)n1 767404529 BXEJQCDHISBURL-LLVKDONJSA-N 430.420 2.327 10 20 IECD COc1cc2c(cc1NCC(=O)NCc1ccc(N3CCOCC3)c(F)c1)NC(=O)CC2 767624772 BHIOKWSQBOLDIX-UHFFFAOYSA-N 442.491 2.284 10 20 IECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 771257537 SUHJKQXGDYJGJY-XMMPIXPASA-N 436.512 2.161 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O 773769193 QLXYUCKIRNOOME-WIUDPPPLSA-N 449.866 2.405 10 20 IECD C[C@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 774246438 VQTKVTAPSXVTQC-SOLBZPMBSA-N 437.968 2.191 10 20 IECD COCc1nnc(-c2cccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)c2)o1 776310032 OASNSUDEKURPDH-UHFFFAOYSA-N 442.497 2.370 10 20 IECD Cc1sc(NS(=O)(=O)c2cn(C)c(=O)n(C)c2=O)nc1-c1cccc2ccccc12 777696521 YJPWJMBWAPBGHL-UHFFFAOYSA-N 442.522 2.470 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(OCC(F)F)ccn3)CC2)cc1 778182452 GEUVDOXKPGUNCC-UHFFFAOYSA-N 435.427 2.240 10 20 IECD CCN(CC)C[C@H]1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295562 QTVZHPHIVYBTTR-JPMGXVIASA-N 428.577 2.090 10 20 IECD CCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C[C@@H]1COc2ccccc2O1 779219535 LYUODGLCOSWZLQ-JTHBVZDNSA-N 441.572 2.340 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@H](C)CC3)CC2)cc1 785529016 UJZOMRURKUYAGR-VQTJNVASSA-N 430.593 2.409 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1 786369147 DZODSVXJHTUIBT-UHFFFAOYSA-N 432.571 2.294 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N(C)c1ccccc1 787642166 VMKUVCXMGWCSAN-SFHVURJKSA-N 426.586 2.497 10 20 IECD CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800125 LNABWIACFXWBGG-YLJYHZDGSA-N 435.540 2.236 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCc2ccccc21 789845847 NIUSXENKZPHUDW-GOSISDBHSA-N 438.597 2.423 10 20 IECD COc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc(Cl)cc1C(=O)N(C)C 793050752 GIELNOLKJYPTGM-LLVKDONJSA-N 449.891 2.148 10 20 IECD COc1ccc(N2CCN(C(=O)CN(Cc3ccc(C(N)=O)cc3F)C3CC3)CC2)cc1 794769900 GPYTXUWFQQJQSU-UHFFFAOYSA-N 440.519 2.246 10 20 IECD CN(C)c1ccc([C@@H](CNS(=O)(=O)C[C@H]2CCCO2)NC(=O)OC(C)(C)C)cc1 795248652 ITALETORSIKDHY-QZTJIDSGSA-N 427.567 2.417 10 20 IECD COC(=O)[C@]1(C(F)(F)F)CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 795687425 KRIFCNGSYLIZJB-FQEVSTJZSA-N 444.450 2.354 10 20 IECD COc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCSCC3)cc1)OCC(=O)N2 797443560 ZKBNEERWFZSKAC-UHFFFAOYSA-N 449.554 2.058 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(N)(=O)=O)c(Br)c1 798317090 TVKYCDAIFVMNBH-UHFFFAOYSA-N 426.336 2.435 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 799589676 XZLRCHGXAYIOQG-UHFFFAOYSA-N 426.489 2.117 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CCO)Cc3ccccc3)CC2)cc1 799811545 KSOVATPAJKEGCY-GMGKOPGTSA-N 437.540 2.010 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(CCO)Cc2cccnc2Cl)cc1F 804851999 WGVVDOQRDCIERT-UHFFFAOYSA-N 436.915 2.358 10 20 IECD CCOC(=O)N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805025725 XGTGFSJHULNGNM-LJQANCHMSA-N 430.549 2.276 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1 806426440 FTEHHYXDNXZZOA-OAQYLSRUSA-N 436.556 2.267 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1cc(-n2cnnn2)ccc1F 807513570 PWELMKGLZBGLJX-UHFFFAOYSA-N 425.207 2.069 10 20 IECD CC[C@]1(CO)CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768413 JGKBQSZUULTUMN-YCRPNKLZSA-N 425.476 2.137 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN3CCOC[C@@H]3C)cc2Cl)C1 807955326 SZJMLCZJESYOPV-IRXDYDNUSA-N 436.984 2.029 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CCC(OC[C@@H]4CCCO4)CC3)nc12 815344217 LBRZJBXJHUGXJH-PREGVCBESA-N 447.488 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C4CCC4)C[C@H](C)C3)CC2)cc1 817020990 PCGAXNIFCPSTTQ-PISNEZEASA-N 440.588 2.233 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)N3CCCCC3)CC2)c1 844257301 AQEZHPJYZRPWDC-UHFFFAOYSA-N 444.576 2.151 10 20 IECD O=C(NCc1ccnc(N2CCOCC2)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918205979 YVZKQSUNPQNQFF-UHFFFAOYSA-N 443.523 2.018 10 20 IECD Cn1cnnc1-c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918294581 HABMGCUAAHEFMR-LJQANCHMSA-N 435.484 2.334 10 20 IECD COC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1 919722526 BUNRGVOWMNNEFU-HNNXBMFYSA-N 442.472 2.335 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(CCC(N)=O)c3ccc(F)cc3)CC2)cc1 1116415613 CMDVEIMJRMSSIJ-UHFFFAOYSA-N 428.508 2.255 10 20 IECD CN1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786570002 IWAJVSFCOZCVCK-INIZCTEOSA-N 446.598 2.075 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246046 HKYXTBYFDQFUFD-LGZKAGKASA-N 447.290 2.269 10 20 IECD CC(C)c1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)co1 1794285468 DBBBQSQJYCDUTL-FVCICTRLSA-N 449.891 2.380 10 20 IECD C[C@H](Cn1ccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428778 IPNBJYRAIFMECC-VQIMIIECSA-N 441.532 2.259 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428803 KEEMXRUBRIGFIG-KRWDZBQOSA-N 447.532 2.315 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3c(C)nc(C(C)(C)C)[nH]c3=O)CC2)cc1 97100021 ULHJPMUYQHSCGD-UHFFFAOYSA-N 441.576 2.327 10 20 IECD C[C@@H]1CN(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 726258215 VWPFZIXAPYZMSA-OAHLLOKOSA-N 430.471 2.062 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(N3CCCCC3)cc2)SC1=S 727177802 NZLKQULNTPVAEK-DTQAZKPQSA-N 425.601 2.427 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(Cc4cnn(C)c4)CC3)cc2F)C[C@H](C)O1 730064870 PXHWSWCTAWWSFI-ROUUACIJSA-N 444.555 2.200 10 20 IECD COc1ccc(N2CCN(CCCNc3cc(N4CCC[C@@H](CO)C4)ncn3)CC2)cc1 731919535 UPNSHROWYVWYCA-HXUWFJFHSA-N 440.592 2.318 10 20 IECD COc1ccc(O)c(CNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1 734061801 GVOXXNMHOZKCEZ-UHFFFAOYSA-N 425.489 2.176 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1C 734704189 XYVLYYWSHABDHP-UHFFFAOYSA-N 438.528 2.097 10 20 IECD COc1cc(N(C)CC(=O)NCc2ccccc2CN2CCOCC2)cc(OC)c1OC 741807565 WSTCAZLNDOKYBU-UHFFFAOYSA-N 443.544 2.297 10 20 IECD CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 746037975 KSPFOMIMSBTIJN-UHFFFAOYSA-N 438.528 2.133 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3c(C)[nH]c(-c4ccncc4)nc3=O)CC2)cc1F 753733296 YANYZEIWIANNNO-UHFFFAOYSA-N 437.475 2.179 10 20 IECD C[C@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)NS(=O)(=O)c1cccnc1Cl 760474776 RUOOGQKIRMKYRA-GFCCVEGCSA-N 428.917 2.313 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765904775 VMZZXSUICRZTKP-VWLOTQADSA-N 425.304 2.288 10 20 IECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c1 769529571 HCQVBOYMQXFSEM-UHFFFAOYSA-N 446.525 2.321 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 773742008 OLQHTCZYZFRUKA-ZBFHGGJFSA-N 435.521 2.051 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3n[nH]c4cc(OC)ccc34)CC2)cc1 773863892 RNGMDXVJQAYDBE-KTKRTIGZSA-N 435.484 2.424 10 20 IECD C[C@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 774246441 VQTKVTAPSXVTQC-XYJFISCASA-N 437.968 2.191 10 20 IECD CN(C)C1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCC1 774852181 CEEVRYPARLRMEM-INIZCTEOSA-N 438.519 2.364 10 20 IECD C[C@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1ccc(N(C)C)cc1 776250965 ZKJGLHLJCZZAGR-AVRDEDQJSA-N 425.577 2.402 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 777828033 GKVTWEBGSYJOLY-HXUWFJFHSA-N 432.904 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccccc3CN(C)C)CC2)cc1 778219394 CUFXVKINLASCRK-SEYXRHQNSA-N 436.556 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc4c(c3)c(C)nn4C)CC2)cc1 778222725 COCITWNWUHERDS-CMDGGOBGSA-N 434.500 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nc4c(s3)COCC4)CC2)cc1 778256657 LTQKPYCKYSUKHJ-SREVYHEPSA-N 428.514 2.068 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789818811 LCCTYOFVULLJTL-XQQFMLRXSA-N 435.525 2.093 10 20 IECD CC(C)O[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789832725 CVHMZSURKKBALS-PMACEKPBSA-N 435.540 2.111 10 20 IECD Nc1nccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1[N+](=O)[O-] 791204955 ITHCNEHIXNZORT-UHFFFAOYSA-N 425.367 2.357 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(Cc4nnc5n4CCC5)cc3)ccc21 792218900 FBAIWUHWSFLPAC-UHFFFAOYSA-N 444.539 2.452 10 20 IECD COc1ccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)c(O)c1 794377042 FFVWZXJXIGCLBQ-GASCZTMLSA-N 434.514 2.129 10 20 IECD CO[C@]1(C)CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448337 OMRQCGQQRWWTGT-OAQYLSRUSA-N 425.476 2.401 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@H]3c3cccs3)CC2)cc1 803747472 QNIGMIGCSXSNPC-FQEVSTJZSA-N 442.585 2.359 10 20 IECD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCCCSc3nccs3)C2)n1 806275449 HFDUOMNBBNHFMC-HNNXBMFYSA-N 447.586 2.322 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C1CCN(C(=O)c2ccccc2)CC1 807096096 AMQWDEKAMWMCJQ-UHFFFAOYSA-N 436.556 2.440 10 20 IECD CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807289959 OEDIXFJTYOXEHD-LJQANCHMSA-N 442.560 2.442 10 20 IECD CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290679 MCMRTKBAWIGTRG-LJQANCHMSA-N 428.533 2.147 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCCCN4C(C)=O)n3)CC2)cc1 809465586 XTOHYJKVRALIPP-IBGZPJMESA-N 427.505 2.043 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H]3CS[C@@H](Cc4ccccc4F)C(=O)N3)CC2)cc1 889063364 SFDHEYMIOOJKGM-RTWAWAEBSA-N 443.544 2.326 10 20 IECD CC(C)CN1C[C@@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914676171 MPHIHMAOGCBFPX-HNNXBMFYSA-N 448.475 2.448 10 20 IECD COC(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc([N+](=O)[O-])c1 917834196 YQABCLIMMQKWNI-HNNXBMFYSA-N 440.456 2.013 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1 918434316 LHANWCRHEIEEJA-UHFFFAOYSA-N 438.528 2.260 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OCCN(C)C)cc3)CC2)cc1 918461827 NSCAYOPOOPLLIH-UHFFFAOYSA-N 440.544 2.313 10 20 IECD CN1CCN(c2ccc(CNC3CCN(S(=O)(=O)C(C)(C)C)CC3)cc2F)CC1 1320747137 WLTCSZLLHMVRSP-UHFFFAOYSA-N 426.602 2.260 10 20 IECD COc1cc(Br)c(C(=O)O)c(NS(=O)(=O)c2cccc3nonc23)c1 1324699030 WOVWVAVVNKLAPF-UHFFFAOYSA-N 428.220 2.493 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccsc1 1796228101 INSBKKVSFURREY-QDMKHBRRSA-N 437.612 2.179 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(F)(F)C1)C2)c1cc(O)c(O)c(Cl)c1 1799767193 ZLLDDFJVOXVMMT-VFFTVRQLSA-N 444.862 2.390 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1 1809511434 NXTOBCJNPTZZFS-BFIPOCKSSA-N 445.903 2.237 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccn4nccc34)CC2)C1 1810554285 JTWJQGHKGZYRKP-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@H]1CCCSC1 1814136327 GYMJHZYOSITWCB-FTRWYGJKSA-N 442.541 2.351 10 20 IECD CC(C)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433059 JFSYYMCQTRACON-NRFANRHFSA-N 440.924 2.257 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1 729536227 XLTOVGAPZVOHFE-OOSHQQHJSA-N 437.496 2.381 10 20 IECD C[C@@H](OC(=O)CCCS(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 731259330 QPSVQVSOVBYIMB-CYBMUJFWSA-N 443.477 2.157 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC 734416343 QVOFKYMPDSPEQF-UHFFFAOYSA-N 429.476 2.474 10 20 IECD CC[C@@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCCC1=O 745700584 WFQUYUXMPXOSKZ-IBGZPJMESA-N 434.448 2.345 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 749628772 MFZVBZLMMIBOQH-UHFFFAOYSA-N 432.546 2.038 10 20 IECD CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccccc2O)c2ccccc2O1 750362323 NGBKKMICZBERLV-HXUWFJFHSA-N 425.485 2.107 10 20 IECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)C2=O 756946381 DOJWEPXBPRPESP-AIDSWVIKSA-N 442.560 2.447 10 20 IECD COC(=O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 757656244 NYDHWYXUVVMTHS-UHFFFAOYSA-N 430.232 2.440 10 20 IECD CCOC(=O)c1cc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1C 759505452 VDHGIIAJOXTJMS-MRXNPFEDSA-N 427.505 2.225 10 20 IECD CCO[C@@H]1COCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760044845 DEYVTMFHUYFQBA-GOEBONIOSA-N 426.516 2.178 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4ccc5c(c4)CCO5)C3=O)cc2)C1 761123859 PLNZTVAKVNDBPU-RXVVDRJESA-N 434.496 2.116 10 20 IECD C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(N2CCOCC2)cc1Cl 765026054 PIFUMAAYOJGZOL-HNNXBMFYSA-N 430.936 2.243 10 20 IECD CCOc1ccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c(O)c1 768184392 GJQFVIBRGFPPBB-UHFFFAOYSA-N 434.543 2.302 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)cc(O)c3)cc2F)C[C@@H](C)O1 768594602 MHIYPAUZCHEJLR-ZIAGYGMSSA-N 432.448 2.324 10 20 IECD CC(=O)N1CCc2c(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cccc21 769248908 VMXPGRUGKNXDAQ-UHFFFAOYSA-N 442.541 2.152 10 20 IECD C[C@@H]1CCC[C@@H](C)C12NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 772876241 OVONIUUXGKMQSR-HZPDHXFCSA-N 446.523 2.025 10 20 IECD CC1(C)CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS1(=O)=O 773953331 FJNPHQIFLZKCBV-UHFFFAOYSA-N 440.521 2.300 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3cccc4c3NC(=O)CO4)cc2F)C[C@@H](C)O1 774679618 LLTXFCJVWYWSIF-HUUCEWRRSA-N 443.475 2.465 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)c2)CC1 781271479 XSCOFIYHYRHXLX-UHFFFAOYSA-N 435.444 2.096 10 20 IECD Cc1cc(=O)n(C)cc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 781971842 YCIHWCOYFVGBRU-CQSZACIVSA-N 434.443 2.019 10 20 IECD CCCn1c(=O)nc(O)c2c(C(=O)OCC(=O)c3ccc(O)c(O)c3)cc(C3CC3)nc21 782671906 FKINEWQAIVKYNQ-UHFFFAOYSA-N 439.424 2.235 10 20 IECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1 784113365 REDNOURLNSBNOY-UHFFFAOYSA-N 449.511 2.483 10 20 IECD C[C@@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427892 GRUIOGJLGDPORX-FQEVSTJZSA-N 438.572 2.118 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc(N(C)C)c3)cc2F)C[C@H](C)O1 786897513 HPVNTFZWJUVNGY-IRXDYDNUSA-N 442.535 2.438 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(COC)cc3)cc2F)CC1 787506993 YZIIJIMSDNUNMK-UHFFFAOYSA-N 442.535 2.047 10 20 IECD NC(=O)[C@@H]1CCC[C@@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 787820730 IHOGWZWQBZDHIG-ZIAGYGMSSA-N 434.448 2.235 10 20 IECD CN(Cc1nc2c(s1)CCCC2)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321341 UZGYJIVVGQXULH-UHFFFAOYSA-N 428.558 2.133 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)cc1 788955597 UIWZHBQVEJJSCW-UHFFFAOYSA-N 431.606 2.175 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H]1C 789950289 NSBIMUGPUQYXQN-KFWWJZLASA-N 443.466 2.183 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc(OC)c1OC 791703638 HUMALEXBAXKWFD-CQSZACIVSA-N 431.455 2.245 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@@H]3CCC[C@H](C)C3)CC2)cc(OC)c1OC 793936990 AJAQJDDBHIEHIU-DLBZAZTESA-N 433.549 2.304 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccc(N2CCOCC2)cc1 803298123 PGELJNRGZOKLJK-HXUWFJFHSA-N 430.593 2.473 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1OC 807385795 QWSJFTQVBMKVJK-UHFFFAOYSA-N 437.246 2.205 10 20 IECD CCOC[C@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770587 NAGQSVPAFOMNEL-HOTGVXAUSA-N 425.476 2.258 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 808345711 GGMPJAXELVQWEU-XZOQPEGZSA-N 444.620 2.374 10 20 IECD C[C@H]1CCCN(c2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccn2)C1 812476424 BUCDDGKTUSYPFP-SFHVURJKSA-N 442.585 2.483 10 20 IECD COC[C@H](C)[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 812623294 QLRWURSQVMQPGH-DZGCQCFKSA-N 436.530 2.386 10 20 IECD CCN1C[C@@H](C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914910188 AVVOERGRSGCLBX-KBPBESRZSA-N 434.448 2.201 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cn2)CCO1 918205926 XNTLJLLTGCHPAD-QGZVFWFLSA-N 443.523 2.282 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(N2CCCC2)nc1 918442938 YEQHAONLOBQNRE-UHFFFAOYSA-N 437.544 2.145 10 20 IECD COc1ccc(/C=C\C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1O 919561384 IYHWKWIAHYRHGP-DAXSKMNVSA-N 444.459 2.249 10 20 IECD Cc1cc2cccc(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)c2[nH]1 1777869480 DCQSVOWVZKFIHD-HSZRJFAPSA-N 436.468 2.040 10 20 IECD O=C(/C=C/C1CCCC1)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510187 QSLOAWHHLLNWFR-YCPLPMEKSA-N 442.512 2.393 10 20 IECD C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603302 IOECMWQESPUFIG-DMRZNYOFSA-N 428.514 2.320 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ncccc12)c1cc(O)nc(O)c1 1804262737 PKZGMLFRORZMSJ-BJWYYQGGSA-N 435.484 2.254 10 20 IECD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1 1817842502 CUASVMPLOCJANR-HNNXBMFYSA-N 438.444 2.239 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)/C=C/C2CC2)[nH]n1 1823496922 RGFWRFBELMPLGV-PSKZRQQASA-N 433.559 2.228 10 20 IECD CN1CCC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)C1 1827427650 GQUAXPFWWGPXAH-HKUYNNGSSA-N 430.549 2.068 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc(F)cc(Cl)c2)C1 1846827650 DRBFSZCOPDRQCV-UHFFFAOYSA-N 441.937 2.156 10 20 IECD COc1ccc(N(C)CC(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1OC 109101169 FDPIFGJSSMLGKQ-UHFFFAOYSA-N 437.518 2.038 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NNC(=S)Nc3ccc(F)cc3F)cc2)CC1 727978886 DUMPNISWPIIMPW-UHFFFAOYSA-N 441.529 2.214 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3ccccc3OC(F)F)C2)c1 735117621 AIRUSNVPJXCSAZ-ZDUSSCGKSA-N 441.456 2.374 10 20 IECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194767 CXYPVRLDOMRANR-NRFANRHFSA-N 437.606 2.106 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1S(N)(=O)=O 737192188 XYRUETRCRUVUCC-UHFFFAOYSA-N 444.557 2.134 10 20 IECD Cc1sc(NS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)nc1-c1ccccc1 743248531 HPDMXUNQMXYGEU-UHFFFAOYSA-N 429.483 2.267 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)cc1 746391305 RTFCWBMSRSUIGV-UHFFFAOYSA-N 434.500 2.059 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccccc3CS(C)(=O)=O)CC2)cc1 746770967 WHLNQXUJDJIEQB-UHFFFAOYSA-N 446.573 2.184 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1 748837060 FOGTXNVQHPPLAF-UHFFFAOYSA-N 428.558 2.259 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCCS(=O)(=O)N2CCCC2)cc1 751405341 LNCTVKZVOBTAHY-NRFANRHFSA-N 437.606 2.466 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cncc(Br)c1 757160527 OSXJBGNUERPPBK-UHFFFAOYSA-N 447.333 2.308 10 20 IECD O=C(CN1CCN(C(=O)NCCCSc2nccs2)CC1)N1CCCCCC1 759602819 MHRMJQLJKIXPIW-UHFFFAOYSA-N 425.624 2.355 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)C2CC2)cc1 764255412 ROXAGNNRWVSTND-UHFFFAOYSA-N 427.526 2.212 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(=O)n(-c2ccccc2F)n1 765647400 OJCMEWWNJCFKGE-UHFFFAOYSA-N 426.423 2.277 10 20 IECD Cc1cc(C(=O)CN2CCN(C(=O)[C@@H](C)O)CC2)c(C)n1-c1ccc(OC(F)F)cc1 766266961 GXWQZCBOWPWUHA-MRXNPFEDSA-N 435.471 2.403 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc4c3CCN4C(C)=O)CC2)cc1 769254233 NXLJTUVMFAIFHH-UHFFFAOYSA-N 436.512 2.328 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775258769 BAIKVVGLMIJBSR-GOSISDBHSA-N 444.601 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@H](O)c3cccc(F)c3)CC2)cc1 778391865 YMNRFEBIBYUJGN-SXTZPUNZSA-N 441.503 2.277 10 20 IECD C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789802352 XDTYXWOCWHIJMK-BUBGKSFDSA-N 447.551 2.067 10 20 IECD CO[C@H](CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(F)(F)F 789823072 YMJRUOZXKILNNO-PBFPGSCMSA-N 449.445 2.139 10 20 IECD CCOC(=O)[C@@]1(COC)CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 799158904 AWKFCJQRSLGYJG-DEOSSOPVSA-N 448.560 2.219 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ncnn3C(C)(C)C)CC2)cc(OC)c1OC 800040225 XQMCGIFURWQZHA-UHFFFAOYSA-N 432.525 2.091 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)N(C)[C@@H](C)c3ccccc3)nc12 800499115 CGJSXCBHCMRKDC-HNNXBMFYSA-N 425.489 2.263 10 20 IECD Cc1cc(-c2nnc(N3CCN(CC(=O)NC4CC4)CC3)n2C)c(C)n1-c1ccccc1 800731715 QOGRSQJLLPFMHE-UHFFFAOYSA-N 433.560 2.290 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cccc1[N+](=O)[O-] 803300809 KMPQWDSSKMZGOH-INIZCTEOSA-N 426.473 2.233 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1F 803664560 OLKCSUABWABBIY-UHFFFAOYSA-N 444.473 2.429 10 20 IECD CC(C)[C@@H](CO)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 805310810 PLOXDOJJIZFMHM-CYBMUJFWSA-N 437.474 2.096 10 20 IECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c1 806811725 WXFINUGEAGKJHW-GOSISDBHSA-N 429.473 2.018 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc3nccnc3c2Br)c(O)c1 807069102 BAXMBJUSEUGLKD-UHFFFAOYSA-N 431.246 2.361 10 20 IECD CN1CCC(CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768766 BFTLLIULLPYNJR-QGZVFWFLSA-N 438.519 2.173 10 20 IECD C[C@@H]1c2cccn2CCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856525 VKMPJIYVJDCXFO-LJQANCHMSA-N 435.572 2.240 10 20 IECD CCCNC(=O)C1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 917008371 PSRGNFOVIVGQJL-ROUUACIJSA-N 448.583 2.294 10 20 IECD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917929926 JFHFYXLXXCZLDX-INIZCTEOSA-N 432.502 2.083 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)N3C(=O)CCC3=O)c2C)cc1 919260434 OBNFVDXREGETHI-OAHLLOKOSA-N 440.452 2.144 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccncc3)cc2F)C[C@@H](C)O1 1326553425 TUCRECKKZLZPSC-IAGOWNOFSA-N 445.491 2.211 10 20 IECD CCc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1780466045 ZUBYWIZMJNAQIX-NTKDMRAZSA-N 439.512 2.497 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1Cl 1783707891 COULIVXCWVJYNI-ZVZYQTTQSA-N 445.903 2.362 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H]3CCCO3)cc2)CCC1 1788300078 NMXPFGWINOFINI-OAHLLOKOSA-N 433.555 2.160 10 20 IECD CC[C@H](C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314810 YSUAPNQBDDLASJ-SCLBCKFNSA-N 449.598 2.388 10 20 IECD CC(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)cc1 1796139652 LOAYJUBQZNXFQM-RMFSNUHRSA-N 425.485 2.133 10 20 IECD Cc1onc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1C 1796930857 FWTUESCYCBNKGK-VBUUOAMHSA-N 435.484 2.336 10 20 IECD COc1ccnc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810547184 QGBVBGHATKLSQB-UHFFFAOYSA-N 426.473 2.055 10 20 IECD COc1cscc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843563636 VBANPNXJMMANIB-UHFFFAOYSA-N 438.509 2.367 10 20 IECD O=C(c1cc(C(F)F)no1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039114 SNKNDLSVZIFZOA-HWKANZROSA-N 435.383 2.259 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)N3CCN(c4ncccn4)CC3)sc2n1 28776328 HHCZIHKYDVDHDR-CQSZACIVSA-N 440.529 2.179 10 20 IECD CS(=O)(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 730278326 KHUOEIHSZXSRIU-UHFFFAOYSA-N 435.521 2.017 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2OC)cc1F 731408470 MJPCNZXPXULBQE-UHFFFAOYSA-N 430.480 2.295 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 731855932 GWNWYBCISVXWGG-IBGZPJMESA-N 448.541 2.138 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4cc(F)ccc4F)=NO3)cc2)C1 732637425 VEYGLGRFNPOURP-VFNWGFHPSA-N 442.466 2.476 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 734494975 LHWYRYQBJYLQCM-INIZCTEOSA-N 447.557 2.273 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 742920799 UJEQLKFNEIAIRJ-LJQANCHMSA-N 428.577 2.115 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 752871979 PVUBBPKWKDDDNO-JBVUFVISSA-N 441.528 2.257 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN(C(C)=O)c4ccccc43)CC2)cc1 754067967 REOVLHCAXSEFHC-JOCHJYFZSA-N 438.572 2.441 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](CO)C[C@@H](O)c3ccccc3)cc2F)CC1 754641096 QAOCMFSROURGTB-NZQKXSOJSA-N 444.551 2.251 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2cnc3c(c2)nnn3C)NC(=O)OC(C)(C)C)cc1 755421704 HNFYKXBOMVACQH-GOSISDBHSA-N 439.520 2.425 10 20 IECD COC(=O)[C@H](C)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 756896680 PTATXXLHTPUXRY-UZUQRXQVSA-N 443.519 2.419 10 20 IECD CCO[C@H]1COCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760044846 DEYVTMFHUYFQBA-HOCLYGCPSA-N 426.516 2.178 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C2(NS(=O)(=O)c3c(C)noc3C)CCCC2)c1 761981092 FVVCCARLDAVJGY-LBPRGKRZSA-N 437.518 2.474 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cn(CC(F)(F)F)nc3C)CC2)cc1 763307085 NKDWZQSNONKORW-UHFFFAOYSA-N 425.455 2.314 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)cc1 768155161 BVHJQEHBAQURQW-UHFFFAOYSA-N 449.548 2.177 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1Br 768901055 ULNLEBBWFMBFHT-UHFFFAOYSA-N 443.319 2.083 10 20 IECD CCN1CCN(C(=O)CC2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 769337997 NFWSJLLGFCDORO-UHFFFAOYSA-N 432.584 2.429 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCCCS2(=O)=O)NC(=O)OC(C)(C)C)cc1 773194314 WBPMVOIIOPKAGR-QZTJIDSGSA-N 439.578 2.402 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1 773739795 KMBSCPYDVOXHKR-LLVKDONJSA-N 436.515 2.055 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1 774356049 GJGPKCODOZCMQK-UHFFFAOYSA-N 432.839 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](C)O[C@@H](C(F)(F)F)C3)CC2)cc1 778294223 KGSQFMAWZOWDPE-BUSQMGNYSA-N 441.450 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cn(C)nc3C(F)(F)F)CC2)cc1 778392641 QFSAAELIAXKLMP-FPLPWBNLSA-N 437.422 2.291 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1 785562302 VYKGIQDNPRQNPV-NRFANRHFSA-N 425.529 2.321 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cnn(-c4ccccc4)c3)CC2)cc1 786119148 ACTKIPPAHFTMBF-UHFFFAOYSA-N 447.539 2.279 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc2)CC1 786259195 MHVYWAWGIKIBJY-QGZVFWFLSA-N 443.569 2.179 10 20 IECD COc1ccc(OC)c(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 786683089 KUAMXWZNPNWSRI-QGZVFWFLSA-N 441.528 2.077 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1C(=O)N1CCCCC1 787532620 FIEIMTAQBHCOFE-UHFFFAOYSA-N 425.485 2.330 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(OC2CCCCC2)CC1 788312849 NISLGRLKOAXREV-UHFFFAOYSA-N 429.561 2.480 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCc4ccccc43)cc2)C1 788484792 OWYPDEMOGPPNEC-RTWAWAEBSA-N 448.567 2.241 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCC[C@H]3O)cc2F)C[C@@H](C)O1 789823011 CCVBKHYROYUHSV-ONFYXGJMSA-N 435.540 2.065 10 20 IECD CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789839815 AMPGLBWWNAQBJT-UWJYYQICSA-N 449.567 2.361 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 789844371 FZKPSUURPNLNAM-UGKGYDQZSA-N 442.629 2.331 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(NC(=O)C4CC4)c3)CC2)cc1 794825164 WDXJFYIISNBVJA-UHFFFAOYSA-N 437.544 2.381 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cn3c(C)nc4cc(F)c(F)cc43)nc12 796003450 PEAZWKDTDCXDHQ-UHFFFAOYSA-N 445.382 2.291 10 20 IECD COc1ccccc1OCCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803302442 ONMVGNUUTYIGAG-GOSISDBHSA-N 441.528 2.246 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803305704 OGOSSJALSUEQLD-HKUYNNGSSA-N 445.560 2.138 10 20 IECD CCCN(CC(C)(C)O)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451869 ZUQQJZBOVHIWCM-UHFFFAOYSA-N 427.492 2.383 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(C)c(OC)c3)CC2)cc1 806465574 HXRHOFMPKRXOCQ-UHFFFAOYSA-N 425.529 2.410 10 20 IECD NC(=O)CCOc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512720 GKFWAAQRTAEWBG-UHFFFAOYSA-N 426.256 2.208 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807771905 YZLHHKUEJOFGOC-DOTOQJQBSA-N 425.476 2.401 10 20 IECD CNC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 807951816 AZZKYXJCHBPCQZ-NYHFZMIOSA-N 434.968 2.177 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)O[C@@](C)(c4ccccc4)C3=O)CC2)cc1 809210198 SBPYFZSEVCWICD-RDPSFJRHSA-N 439.512 2.072 10 20 IECD NC(=O)Cn1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 918668323 FSMBODLZZYKWCW-FMIVXFBMSA-N 435.556 2.050 10 20 IECD CN1CCN(C(=O)c2ccccc2NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919772464 DNVWMJGJMXHIMG-UHFFFAOYSA-N 437.544 2.233 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920880809 IQIXVFRKZLBLQT-INIZCTEOSA-N 433.530 2.196 10 20 IECD COc1ccc([C@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)cc1 920979844 KCJCWRKRVIPTNO-GQEMFKIVSA-N 430.574 2.205 10 20 IECD Cc1ccc([C@@H](C)C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1783309325 AJZHKMHOVNHONP-MWTRTKDXSA-N 425.485 2.048 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)Cc2cnc[nH]2)cc1 1796332795 DRNFUIWPSGXNJW-IRJINJETSA-N 447.539 2.263 10 20 IECD O=C(CC1CCOCC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806934377 VLZGPZUQWHQLKW-VGSWGCGISA-N 440.500 2.024 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1C 1808726116 YNDYOBZKIDEDOH-HRAATJIYSA-N 435.484 2.168 10 20 IECD Cc1nc(F)ccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820948483 AQCWQGXNIIHTLM-NSHDSACASA-N 443.460 2.331 10 20 IECD O=C(CCC(F)(F)F)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837785333 WITCVLVGMVJMLZ-UHFFFAOYSA-N 445.438 2.448 10 20 IECD O=C([C@H]1CCc2ccoc2C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441109 MXLLNECGBYKBGV-SFHVURJKSA-N 446.507 2.381 10 20 IECD COC(=O)CN(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)Cc1cc(Cl)ccc1O 731845442 YDPUWLPVHUHCMS-UHFFFAOYSA-N 433.892 2.361 10 20 IECD CC[C@H](CCO)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755939777 UPZVXMRLFWTUOF-QGZVFWFLSA-N 430.528 2.150 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(N4CCOC4=O)cc3)CC2)cc1 758229671 FYCKJCXGCUSAMY-HXUWFJFHSA-N 427.501 2.214 10 20 IECD CNS(=O)(=O)c1ccc([C@@H](C)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764685424 VOLGGPQFEGMEOG-LJQANCHMSA-N 446.617 2.466 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(Cn5cccn5)o4)n3)CC2)cc1 771082332 KOQWREBEXMAKAS-UHFFFAOYSA-N 448.483 2.474 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCOc3ccccc3)cc2F)C[C@@H](C)O1 774855942 BFTNGLPXBJTOQI-IAGOWNOFSA-N 429.492 2.251 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)c1 775376679 XHNDWOPEOSVJSJ-CMJOXMDJSA-N 440.500 2.026 10 20 IECD Cc1cc(Br)cc(CN2CCN(S(=O)(=O)CCOC(C)C)CC2)c1O 775735825 ZEAMUCDFQJPWJP-UHFFFAOYSA-N 435.384 2.336 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@@H]2CNC(=O)CCNC(=O)OC(C)(C)C)c(O)c1O 775918806 GLMHTNOPCFJPFG-OAHLLOKOSA-N 435.521 2.432 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]1OC 776226395 FWZGACAJYXTQFD-FRFSOERESA-N 426.516 2.177 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 779493866 PUHIMYWGEAMYNO-QHHAFSJGSA-N 425.485 2.423 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 788933633 RBIHFGKKPZBRJH-HXUWFJFHSA-N 440.931 2.478 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1COc2ccccc21 789840824 NWJXJZGVAHQTIA-BEFAXECRSA-N 441.503 2.084 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H](CCCO)c1ccccc1 789856148 PEIIQZUVUYWGDM-NRFANRHFSA-N 427.570 2.486 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](Oc3ccccc3)C(C)(C)O)CC2)cc1 795764572 PLVXFFJKKRLTER-QFIPXVFZSA-N 442.512 2.106 10 20 IECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@@H]1C[C@H]2CC[C@H]1C2 804315961 WIXPNHCEPIREGZ-NPPFBWRTSA-N 429.561 2.444 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H]1CCCS(=O)(=O)C1 804969052 ICORANOVJICUBA-CQSZACIVSA-N 449.495 2.166 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1 807292509 RRJFFEKMMLGFMO-QHCPKHFHSA-N 446.551 2.490 10 20 IECD C[C@@H]1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 807972692 UCYSMIKLQXDSPN-WOJBJXKFSA-N 442.604 2.156 10 20 IECD O=C(NCCC[C@@H]1CCCCO1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807995162 VGFOVNOFVCUVFG-QHCPKHFHSA-N 442.604 2.300 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F 810351153 FILXIUWSMDGEIR-UHFFFAOYSA-N 448.470 2.483 10 20 IECD C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 818641777 WJPNAIZUFYYMNB-UGSOOPFHSA-N 449.504 2.385 10 20 IECD O=C(NCCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccco1 881464097 JFBYHBPMYZUMGI-UHFFFAOYSA-N 433.376 2.123 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC 917759341 OBUKBOKBGHLCJR-UHFFFAOYSA-N 429.476 2.474 10 20 IECD CC(C)C(=O)Nc1nc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cs1 917835589 CWTKKBUOGWAULT-INIZCTEOSA-N 443.573 2.298 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 1252597016 MKVFENVPIIJEHV-UHFFFAOYSA-N 435.521 2.478 10 20 IECD Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c1Cl 1785028361 OPKQQNFTBKSVCF-OAQYLSRUSA-N 431.876 2.212 10 20 IECD CC(C)NCCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1788120192 LGBHJANBRMHCDY-UHFFFAOYSA-N 448.614 2.369 10 20 IECD O=C(Nc1ccc(C2(NC(=O)c3cnncc3C(=O)O)CCC2)cc1)c1cc(O)nc(O)c1 1788427140 OQJSIAREFCRHAV-UHFFFAOYSA-N 449.423 2.043 10 20 IECD CC(C)CNC(=O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788662940 PHQRTZBYCDLNNC-UHFFFAOYSA-N 426.473 2.013 10 20 IECD C[C@@H](NC=O)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788674220 WQBNQZAREPAQOX-MRXNPFEDSA-N 447.495 2.048 10 20 IECD Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807994143 QHVFYCMVLXCDQV-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(CCCn1ccnc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550760 RQSXDSYHRZVIFM-UHFFFAOYSA-N 427.505 2.015 10 20 IECD O=C1CC(C(=O)N2CC[C@@H](CNC(=O)C3(F)CC3)[C@@H]2c2cccnc2)=NN1c1ccccc1 1812457387 VTLDQDUHGSHNRC-UWJYYQICSA-N 449.486 2.382 10 20 IECD CCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812613685 GVBSHKVZVCDFJO-CRAIPNDOSA-N 448.614 2.384 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)C2CCCC2)[nH]n1 1823496265 JODLUQXLCDTVAO-AWEZNQCLSA-N 435.575 2.452 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCCC12CN(C(=O)C1(Br)CC1)C2 1845501955 WCDCQWKRGYPVST-UHFFFAOYSA-N 429.698 2.496 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](n4ccnc4)C3)CC2)cc1 728741051 MKJYNPFSQGCDDD-NRFANRHFSA-N 426.565 2.451 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc(COc2ccccc2)n1N 729033142 TXPVMMJMHRYRFH-UHFFFAOYSA-N 426.546 2.388 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CNC(=O)c3c(F)cccc3Cl)CC2)cc1 730596341 MWHHKEQHDPIYFY-UHFFFAOYSA-N 448.926 2.156 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1N1C(=O)CCC1=O 733046819 AASJAGUFUYKBFO-UHFFFAOYSA-N 426.448 2.108 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 734701489 ALCHKQBKWRNKRH-IRXDYDNUSA-N 425.533 2.325 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(C(=O)Nc4ccccc4)CC3)CC2)cc1 738440671 XCWOVDWIEVAGNQ-UHFFFAOYSA-N 437.544 2.194 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1 739922349 IZUQGDNOXXOATL-UHFFFAOYSA-N 431.558 2.196 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3noc(-c4cccs4)n3)cc2)C1 745182507 FXHSZETVEVQROF-OAHLLOKOSA-N 440.529 2.499 10 20 IECD CCN(CC)CCO[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 746757574 OYWUVCLUDCBHJS-IRLDBZIGSA-N 445.608 2.031 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)C1 749178598 MJZLGBFQSSZIGZ-FGZHOGPDSA-N 435.572 2.312 10 20 IECD CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 755574263 KBSUHJAUOMJZRQ-UHFFFAOYSA-N 448.391 2.382 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)[C@H]2CCS(=O)(=O)C2)cc1 765325464 CKHIVUKGNNKBFM-NRFANRHFSA-N 445.585 2.413 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)cc1 765325465 CKHIVUKGNNKBFM-OAQYLSRUSA-N 445.585 2.413 10 20 IECD O=C(COC(=O)c1ccnc(Cl)c1F)NCc1ccc(N2CCOCC2)c(F)c1 766933936 DBCGUZUSUPQLIR-UHFFFAOYSA-N 425.819 2.323 10 20 IECD C[C@H](NC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 777469816 NTBXSUJTCNQGSE-GOEBONIOSA-N 428.455 2.294 10 20 IECD COCC(=O)N1CCc2cc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)ccc21 778628735 HVSGMKQISWHSHW-UHFFFAOYSA-N 437.496 2.061 10 20 IECD O=C(Nc1cnc2c(c1)COCC2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768372 WYEYXDMVQSXPPM-KRWDZBQOSA-N 444.919 2.233 10 20 IECD CC(C)CN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 786331499 QBBVFNQDVNNMNF-ROUUACIJSA-N 448.583 2.292 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2OCCOC)cc1 786717603 GWTNYOJLPMYYHS-UHFFFAOYSA-N 432.495 2.413 10 20 IECD CCOC(=O)[C@@H](CC)N(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787678194 CPBQXUREZSSGKK-JNCYCUAHSA-N 443.544 2.233 10 20 IECD Cc1nc2c(s1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCC2 789800862 VXKDVFRBVSXDIF-QGZVFWFLSA-N 432.521 2.237 10 20 IECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860960 OONQGUCWAKPCNP-SFHVURJKSA-N 438.597 2.423 10 20 IECD COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)C2)c1 791725199 SYPVIOZTKBCNIW-QHCPKHFHSA-N 436.512 2.173 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CN(C)C)c(Br)c2)c(O)c1 797390802 SOMXFYXXIHFZHP-UHFFFAOYSA-N 436.306 2.480 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](S(C)(=O)=O)CC3)cc2F)CC1 800705841 TYJILCNFUUJSOU-GOSISDBHSA-N 440.585 2.076 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(c4c[nH]nc4C)CC3)CC2)cc1 803637582 PCYZRPIJPKFQLO-BQYQJAHWSA-N 437.544 2.338 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc(Cl)c(F)c3)cc2)C1 804961489 YFIWCUQQEYLZQM-CYBMUJFWSA-N 426.901 2.054 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCC[C@H](N(C)C)C1 806505798 YNJYHRDHRPZPNA-CVEARBPZSA-N 426.355 2.492 10 20 IECD COCCn1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(=O)cc1C 806513661 MFVISUFKLDOGJM-IAGOWNOFSA-N 431.508 2.486 10 20 IECD CN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1)C(=O)OC(C)(C)C 807287219 HJVWILINYWSPOP-LJQANCHMSA-N 442.560 2.394 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@@H]3[C@H]3CCCO3)CC2)cc(OC)c1OC 811764087 NZNGIHCOTWTGDS-UTKZUKDTSA-N 433.549 2.208 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](n3cccn3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 812876073 FLGBXLLZSPDYQX-GOSISDBHSA-N 427.530 2.068 10 20 IECD COc1cccc(C(=O)NCCNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 916262857 RNCRTDZCTWBJFE-UHFFFAOYSA-N 428.558 2.478 10 20 IECD C[C@@H](Sc1nncn1C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456540 IECALPOGJYIPSD-GFCCVEGCSA-N 429.468 2.468 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCCc1ccc(O)c(O)c1 917371589 IOJRYJLVGMIEOB-UHFFFAOYSA-N 448.419 2.024 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2)C1 918121132 DNJWHQFYPWRYBA-QGZVFWFLSA-N 440.504 2.208 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 918438073 FEXMNDCBXLLHFM-UHFFFAOYSA-N 445.491 2.367 10 20 IECD CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(N3CCN(C)CC3)c(F)c1)C2 1117104187 ZBGXDPXFRDXGJQ-UHFFFAOYSA-N 432.565 2.044 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ncon4)C[C@@H]32)cc1 1790125969 COZZCAAAVJHXLZ-JBACZVJFSA-N 449.511 2.384 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243084 QLYIUWKNFPQCPZ-RQDXYIEZSA-N 434.920 2.391 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccc(O)cc1 1796933058 NJFOPRPDMHACCJ-GGPHIMKMSA-N 432.480 2.437 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800720080 YPKGNWCKSIJNPH-JYYAWHABSA-N 437.924 2.308 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1[nH]cc2c1CCC2 1811291850 PDRXNXDQOQMXKS-AOMKIAJQSA-N 447.495 2.338 10 20 IECD O=C(c1ccsc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837407517 HYQNABAPKXDEBS-UHFFFAOYSA-N 431.514 2.480 10 20 IECD Cc1nc(F)ccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442416 JKKHVAJXWAEDGV-UHFFFAOYSA-N 435.459 2.139 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1O 1843442512 OVGFEBBCSGSCIK-UHFFFAOYSA-N 432.480 2.311 10 20 IECD C[C@@H](Oc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846606491 UKQADKKZQCDSKK-CYBMUJFWSA-N 431.876 2.431 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)Nc3nnc(C(C)(C)C)s3)nnc2n1 108573843 DDMSSWXCUFNUSE-UHFFFAOYSA-N 436.571 2.263 10 20 IECD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 726234677 JDTGVBDMHPMLRE-VQTJNVASSA-N 443.592 2.082 10 20 IECD C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 729596869 MMZJVUSTSIVUJJ-BGYRXZFFSA-N 447.599 2.362 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)c1 731130771 VYAAKYKIAZKCPG-GFCCVEGCSA-N 426.429 2.487 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1)c1ccc(N2CCOCC2)cc1 731405646 GWPJYHIRHCQHLP-HNNXBMFYSA-N 437.500 2.083 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OCC(=O)N(C)C)c1 734702005 OZFVPAIHXATSCE-UHFFFAOYSA-N 426.517 2.091 10 20 IECD COC(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1C(=O)OC 742266316 LCTXDURDEBQJLN-UHFFFAOYSA-N 441.484 2.029 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNc3ccc(S(=O)(=O)NCC4CC4)cn3)cc2)C1 742396050 GRUBNHBMVWIYON-SFHVURJKSA-N 443.573 2.084 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](C(F)(F)F)O[C@H](C)C3)CC2)cc1 745784512 WHWZXMJFLKSURK-QAPCUYQASA-N 430.471 2.178 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747077696 DSNJPKBFYCBDTF-OLZOCXBDSA-N 443.477 2.013 10 20 IECD CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 747481458 DMELTGGEDMOUDS-UHFFFAOYSA-N 430.526 2.113 10 20 IECD CCN(CC1CC1)S(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 766039888 YMCIARNODAAWLO-UHFFFAOYSA-N 448.568 2.009 10 20 IECD COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NCc1cccc(OC)c1O)CC2 767944136 BCCPXXLOYHNMPX-UHFFFAOYSA-N 428.485 2.399 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@@H](S(C)(=O)=O)C3)cc2F)CC1 770538794 XYZDUQISIBPSJX-GOSISDBHSA-N 440.585 2.076 10 20 IECD Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781440761 NNAJJHISCFADRL-UHFFFAOYSA-N 437.475 2.411 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](N4CCNC4=O)C3)cc2F)C[C@@H](C)O1 782937102 CHEKTDUAPPXNFG-NUJGCVRESA-N 433.528 2.139 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 786285411 GQJNMRZQSFHFCS-UHFFFAOYSA-N 427.505 2.184 10 20 IECD O=C([C@H](CNCc1ccc(N2CCOCC2)cc1)Cc1cccc(F)c1)N1CCOCC1 788530177 VZRGJUGQNWZFRJ-QFIPXVFZSA-N 441.547 2.470 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N(C)C)cc1 789840661 MAJSNVRBYJNACU-INIZCTEOSA-N 442.535 2.346 10 20 IECD COc1ccc(CNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c(O)c1 794387768 LTEQWTYSUXDDPP-UHFFFAOYSA-N 427.486 2.190 10 20 IECD COc1ccccc1-c1csc(NS(=O)(=O)c2ccc(S(C)(=O)=O)nc2)n1 795604974 FAYCRNQSZPSOPG-UHFFFAOYSA-N 425.513 2.418 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1OCC 798221732 CWQQEHNGRFJRIT-UHFFFAOYSA-N 449.573 2.487 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689101 KDJXRAMQWFIXGB-IBGZPJMESA-N 443.569 2.054 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317143 SYZZOUZQEUPKQP-UHFFFAOYSA-N 429.517 2.357 10 20 IECD CCCN(C[C@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805006999 CDNAYHYCYNCSKC-HXUWFJFHSA-N 448.583 2.392 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cc(C(C)C)no3)cc2F)CC1 805008008 XLZJANHEWMZSQC-UHFFFAOYSA-N 431.512 2.012 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 807291171 GYYIOAULHJQRIH-XLIONFOSSA-N 442.560 2.441 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@@](C)(O)c3ccccc3)CC2)cc1 807495317 ASALMWZTXPXXNV-XMMPIXPASA-N 425.529 2.148 10 20 IECD CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 808035408 WBQIHYYAFKYQAA-LJQANCHMSA-N 447.919 2.268 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)C1 808037029 HYUZKLBXAZAAHV-PKOBYXMFSA-N 432.565 2.474 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)c4ccc(Cl)cc4)CC3)nc12 917096464 YYVLNIHFNPMXTG-UHFFFAOYSA-N 443.891 2.223 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](NC(C)=O)c3ccc(C)cc3)nc12 918901327 AATZFKKGEGLXBP-GOSISDBHSA-N 440.456 2.231 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)cc2)C1 919816660 CHKUAKWTGWJHBQ-SJORKVTESA-N 426.483 2.279 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 920188899 PXSBBBQLGSVISJ-UHFFFAOYSA-N 427.501 2.146 10 20 IECD CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)O 1117707424 PEHNOYDHDRWECQ-GOSISDBHSA-N 439.528 2.067 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)/C=C/C3CCCC3)C2)C1 1781283172 ZPVSQBNHTTWNKT-HYIAZSBSSA-N 442.512 2.393 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@H]1CCCS1 1791804341 RTPPCIIETSYHDH-WGGXSYPISA-N 440.949 2.240 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)CC1 1828369358 WIGYFDVFNPNOGJ-AZDNCTHESA-N 444.528 2.207 10 20 IECD CN(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccc(Cl)cc1 1843250787 PBFLDMMTHLIMIX-LJQANCHMSA-N 444.919 2.266 10 20 IECD CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCS(=O)(=O)C1 29959139 UMMNNRHHTYEDNG-LQELWAHVSA-N 444.625 2.375 10 20 IECD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)Nc2cccc(N3CCCC3)c2)c1 108027040 FHMQGHVUMNWXSW-UHFFFAOYSA-N 430.530 2.023 10 20 IECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)cc1)Nc1ccc(-n2cccn2)cc1 725866367 QIIWAKGHECLLQF-UHFFFAOYSA-N 434.500 2.147 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)C(=O)Nc3ccccc3)CC2)cc1 732572415 UPJRZNQRBKNPOL-GOSISDBHSA-N 425.533 2.144 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1 732575445 BINSYHAIBAZDCB-LJQANCHMSA-N 437.544 2.042 10 20 IECD C[C@@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 733364881 WQIJHULEMINXIK-IBGZPJMESA-N 435.458 2.258 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)c1O 737285551 HBSTULBIPWOXGS-UHFFFAOYSA-N 432.498 2.372 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](CN4CCCC4)C3)cc2F)C[C@@H](C)O1 739926971 PYSPCSRZIMUGBD-SVFBPWRDSA-N 432.584 2.473 10 20 IECD O=C1NC(=O)C2(CCC(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)N1 742804692 APDLRIJDGHPESZ-GJGORFQUSA-N 436.459 2.141 10 20 IECD O=C(Cn1c(=O)nc(O)c2ccccc21)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743737172 ZTRYFKMPPTUEKW-CQSZACIVSA-N 444.438 2.489 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCc4ccc(C)cc43)CC2)cc1 746991108 YKGFFAOOBAWYTR-UHFFFAOYSA-N 436.556 2.221 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 747604475 MDFLIIIUJHWBTM-UHFFFAOYSA-N 448.906 2.308 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(CNC(C)=O)s3)CC2)cc1F 754040392 PQBJGEAVZBIQTR-UHFFFAOYSA-N 427.523 2.043 10 20 IECD NC(=O)[C@@H](Cc1ccccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 758145223 YNTKDFGYFNTYRG-OAQYLSRUSA-N 434.519 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](CO)Oc4ccccc43)cc2F)C[C@@H](C)O1 759746032 AVDKFHXPEXCZNE-SCTDSRPQSA-N 443.519 2.315 10 20 IECD COc1ccc(N2CCN(c3ccc(S(=O)(=O)N(C)C)cc3[N+](=O)[O-])CC2)cc1F 763369388 ZAJFZEFZCPRWBR-UHFFFAOYSA-N 438.481 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCCN3C3CC3)CC2)cc1 765798589 RKFJMGPNPMIRJI-GMGKOPGTSA-N 426.561 2.033 10 20 IECD CCOC1CC(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)(N2CCOCC2)C1 767896301 OHTDHDCENYUUHU-UHFFFAOYSA-N 446.592 2.233 10 20 IECD C[C@@H](CCCOc1ccccc1C(N)=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769517997 SQSBEMSKJOKCNL-SFHVURJKSA-N 445.585 2.358 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773845461 GWRHRPQKDUDFJQ-CQSZACIVSA-N 430.530 2.009 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 774767443 RJNNJTMQJKZYQD-OAQYLSRUSA-N 426.586 2.275 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc4c(c3)c(C)nn4C)CC2)cc1 778222726 COCITWNWUHERDS-HJWRWDBZSA-N 434.500 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)CC2)cc1 778408541 BZGXLANGTCXWLC-NEZZHTIASA-N 447.626 2.396 10 20 IECD CCc1ccccc1CNC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785526491 DYZOJXGHERPJRH-UHFFFAOYSA-N 438.572 2.202 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCN(c2ccccc2)CC1 788012264 CBFHKYPCEZBCGD-NRFANRHFSA-N 449.599 2.230 10 20 IECD CN(Cc1ccccc1O)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 789314867 ZPQYEFBOHIFGAF-LJQANCHMSA-N 429.492 2.390 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@H](Oc2cccc(F)c2)C1 789813746 VEKXSFHGZIHIQX-IBGZPJMESA-N 445.466 2.098 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@@H](N2CCCC2=O)C1 790205298 ZOYMSSGSVDYTRC-QGZVFWFLSA-N 440.466 2.448 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3C3CCCC3)cc2)C1 793716425 BMHGRAIMWXAGRU-TZIWHRDSSA-N 426.561 2.186 10 20 IECD O=C(NCc1cccc2c1OCO2)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793738024 QTRCBUKZLDESSQ-OAHLLOKOSA-N 447.438 2.418 10 20 IECD O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NCc1ccc(N2CC=CC2)cc1 799373475 FVZNJORXAFPIOI-UHFFFAOYSA-N 436.484 2.119 10 20 IECD CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662324 ISWIQPDBVNJFIS-HXUWFJFHSA-N 441.551 2.416 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768718 AKLYBORLSOLOFP-IAGOWNOFSA-N 438.519 2.362 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 916759554 AQTPVNPMZLPDER-UHFFFAOYSA-N 447.557 2.241 10 20 IECD CC1CCN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)CC1 917126585 JXGCIIYZVFJUQG-UHFFFAOYSA-N 431.543 2.103 10 20 IECD O=C(CCc1ccco1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004932 QGIPBJPWJQWZPE-NRFANRHFSA-N 434.876 2.421 10 20 IECD Cc1scc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1C 1787291541 HRCIUZUIWHWUKK-QRTARXTBSA-N 431.514 2.078 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ncc[nH]3)CCC2)cc1 1792314055 NXYBJIUWQWGBPT-UHFFFAOYSA-N 429.527 2.018 10 20 IECD Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1811605156 MTPDQMZZYMQFHE-HRAATJIYSA-N 435.484 2.168 10 20 IECD O=C(CC1CCCC1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834363710 BTRDSOSQTSSZFS-UHFFFAOYSA-N 430.549 2.258 10 20 IECD O=C(Cc1ccccc1F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442088 WWUKZQRMCQWZJG-UHFFFAOYSA-N 434.471 2.365 10 20 IECD CN1CCC(N2CCC(NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)CC2)CC1 216003560 JXBAKFJPPBUJLG-UHFFFAOYSA-N 443.636 2.253 10 20 IECD Cc1cc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 726236457 DLSGBJSGIYBHBA-UHFFFAOYSA-N 425.468 2.238 10 20 IECD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 729523845 WBVUFBMSOUEJFB-UHFFFAOYSA-N 437.544 2.358 10 20 IECD COc1ccc(N2CCC(NC(=O)Cc3c(C)nc(-c4ncccn4)nc3O)CC2)cc1 729532069 SCHLKFIZXVXUNK-UHFFFAOYSA-N 434.500 2.284 10 20 IECD COC1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 730830948 UPIKYLGYTGNOCF-LJQANCHMSA-N 445.608 2.077 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3cccc(OC)c3)CC2)cc1 732444374 SYMLMZQUDYELLR-QHCPKHFHSA-N 442.560 2.249 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(CNC(=O)c3cc(O)cs3)CC2)cc1OC 733001048 INNUTBQCWGPHQP-UHFFFAOYSA-N 440.543 2.302 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 735189721 CGAAGZANCCUOSY-WJOKGBTCSA-N 443.569 2.437 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](Cc4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 746679957 RVJNXHDGCYRVAX-GGPKGHCWSA-N 443.567 2.354 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 749730663 ATDUVGWAHPJYKA-HNNXBMFYSA-N 434.543 2.498 10 20 IECD Cc1cc(C(=O)CN2CCCN(S(C)(=O)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 749829568 QNXVOCIGPVTILS-UHFFFAOYSA-N 447.557 2.015 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3C[C@@H](O)c3ccco3)CC2)cc1 754063013 YRIAUKHLSGSUBC-QNWVGRARSA-N 429.561 2.359 10 20 IECD COC(=O)N(C)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754213797 VESAGFSHJSSODW-UHFFFAOYSA-N 444.463 2.324 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc3nnnn3c2)NC(=O)OC(C)(C)C)cc1 758254181 UBGIHPZBQWZDJM-QGZVFWFLSA-N 425.493 2.186 10 20 IECD CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 760116606 ZYHYTJSKVRMKHL-UHFFFAOYSA-N 434.489 2.210 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ncccc3Cl)CC2)cc1 760744851 ZKNAOPQTOYVALM-UHFFFAOYSA-N 433.940 2.244 10 20 IECD COc1ncc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C(N)=O 762226702 XJGVUSWTHHXAGG-CHWSQXEVSA-N 431.468 2.264 10 20 IECD C[C@@H](C(=O)NC(=O)Nc1ccc2c(c1)OCCO2)N1CCOc2cc(N(C)C)ccc21 762341716 FCQVJGGVTIKMDY-AWEZNQCLSA-N 426.473 2.459 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C)S(=O)(=O)C1CCOCC1 768170182 GXWSYDMMVVQMFO-LBPRGKRZSA-N 434.352 2.486 10 20 IECD CCc1ccc(O[C@@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768446454 KJDYAHQRWYAQJU-AOMKIAJQSA-N 426.513 2.492 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@H](C)[C@H](O)C3)c2C)c1 768765372 DLEBSRUSABCTGU-RNODOKPDSA-N 428.485 2.163 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)cc2)C1 772446311 MMGGKABMKZOWIJ-MOPGFXCFSA-N 441.576 2.121 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c(C)n1[C@@H]1CCS(=O)(=O)C1 772766106 PUJYWEKQYLDNJH-DQOPKJQZSA-N 433.482 2.315 10 20 IECD CCN1CCOC[C@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 775041756 HFXSVTMHVHEYNB-IBGZPJMESA-N 428.485 2.312 10 20 IECD CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H](CNC(=O)OC(C)(C)C)C1 775426975 NGYYNCPWAGJLHS-IBGZPJMESA-N 431.581 2.419 10 20 IECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@H](O)C(F)(F)F 778202063 DAHGYLUQWYZNBL-SFHVURJKSA-N 447.479 2.169 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN(C)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 785526579 FOQINFAJBKRTAH-HXUWFJFHSA-N 438.572 2.339 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccnc(N2CCCC2)c1 786501828 UWCBSKWOVWGFMM-UHFFFAOYSA-N 439.585 2.168 10 20 IECD CCOC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 787364137 NSEVYRMSCREGCI-ZACQAIPSSA-N 435.540 2.472 10 20 IECD C[C@@H]1CCCC[C@@H]1OCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787985251 AXVNZEYKUHKQDG-IERDGZPVSA-N 435.540 2.115 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3CCN(c4ccccc4)C3)CC2)cc1 788823190 NUJZLOHHQOOXCQ-FQEVSTJZSA-N 436.556 2.377 10 20 IECD CC(C)(C)Oc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 789800270 RMUXQWBPRXPACI-UHFFFAOYSA-N 444.507 2.167 10 20 IECD CC(C)Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822400 WLJUNCRAUHXJTK-IRXDYDNUSA-N 445.539 2.224 10 20 IECD COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 791535459 XVBIPXPMJYRYDA-XMSQKQJNSA-N 436.512 2.206 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCC[C@@H]3C[C@H]4CC[C@H]3C4)CC2)cc(OC)c1OC 793581535 WAEVFONKWGUFDG-OKZBNKHCSA-N 445.560 2.304 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 793915598 ZNILHEVHDPSMNY-CEXWTWQISA-N 430.593 2.263 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Br)c2C)cc1 797431407 NWKIAWGFNZIZRU-UHFFFAOYSA-N 434.337 2.434 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nn(-c4cccc(F)c4)cc3O)cc2)CC1 803162903 XTWPOGNTHVEPRZ-UHFFFAOYSA-N 437.475 2.316 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(CN2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803307699 KVUUTDAFPDGEQL-LJQANCHMSA-N 428.577 2.035 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCN(C4CCCC4)CC3)CC2)cc1 804316852 LVVMGJWKUBBCII-UHFFFAOYSA-N 428.577 2.257 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cccn3C)cc2F)CC1 805007595 MSUYFKZIQAYYNC-QFIPXVFZSA-N 441.551 2.286 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 805013172 ZNGQHQLAVVIKOA-CYBMUJFWSA-N 428.532 2.129 10 20 IECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807071930 DWPCZGLBDSJMLF-JLSDUUJJSA-N 425.476 2.447 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 807832061 ISDCVYGNAUTYPJ-MRXNPFEDSA-N 430.549 2.227 10 20 IECD CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807952180 FXNHBTPUTBIZNR-HNNXBMFYSA-N 432.956 2.370 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(-c5nc[nH]n5)cc4)n3)CC2)cc1 809465031 PCWBOLWYXBVGFO-UHFFFAOYSA-N 445.483 2.422 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnn4c3OCCC4)ccc21 816205606 DLVIKVOHBHRXTB-UHFFFAOYSA-N 432.502 2.002 10 20 IECD Cc1cc(C(=O)O[C@@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)c(C)n1-c1ccccn1 914903881 SVJSPHYLNUUYAN-DENIHFKCSA-N 447.557 2.364 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(N2C(=O)CNC2=O)c1 916688859 KWWGNZRYKUEJAD-UHFFFAOYSA-N 427.436 2.040 10 20 IECD C[C@@H](Oc1cccc(F)c1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919074985 KERAYWNYZZEHRD-OAHLLOKOSA-N 434.439 2.428 10 20 IECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN(C)c2ccc(OC)c(OC)c2)C1=O 920418777 GLXITWCDUNBKLI-QFIPXVFZSA-N 426.473 2.029 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(Cc4cccnc4)c3)cc2)C1 1323498697 RMWLUDAMLMEDRM-LJQANCHMSA-N 433.516 2.350 10 20 IECD Cc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1793282332 IKAJKSQYZUAHCG-QZJJICTCSA-N 437.496 2.401 10 20 IECD CC(C)n1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725793 LYVMQCDCENCUIQ-GFCCVEGCSA-N 442.501 2.266 10 20 IECD Cn1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)cn1 1823708806 PJFCUCWQLIBTOL-NSHDSACASA-N 447.904 2.481 10 20 IECD CCN1CCC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827430520 ZOLGRYXIEXWCCF-FQEVSTJZSA-N 444.576 2.458 10 20 IECD O=S(=O)(Nc1ncccn1)c1cccc(NS(=O)(=O)c2cccc3nsnc23)c1 525866412 DMYDYPSYYMAOPU-UHFFFAOYSA-N 448.511 2.083 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)n(C)c2ccccc12 565721239 WMQMEBUIWWCAFM-INIZCTEOSA-N 435.528 2.039 10 20 IECD COc1cccc(CNCCc2ccc(OCCN3CCN(C(C)=O)CC3)cc2)c1O 728063719 ZCIKLTBZPFZJBU-UHFFFAOYSA-N 427.545 2.276 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)C(=O)Nc3ccccc3)CC2)cc1 732572416 UPJRZNQRBKNPOL-SFHVURJKSA-N 425.533 2.144 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2C[C@H]3CC[C@H]2O3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 733834139 FWQATKCEPDCAIT-MOXGXCLJSA-N 432.498 2.035 10 20 IECD CCN1CC[C@@H](CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 746685918 LJFXCLTUOHGBBH-AWEZNQCLSA-N 448.501 2.173 10 20 IECD CC(C)OCCS(=O)(=O)NCC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 747906826 CMFNHKHSUZFXJP-UHFFFAOYSA-N 425.595 2.416 10 20 IECD O=C(NCC[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 753231132 CNDCDKUDBBHIGV-CYBMUJFWSA-N 435.458 2.258 10 20 IECD CCOC(=O)c1sc([C@H](C)NCc2cc(O)n3ncc(C(=O)OCC)c3n2)nc1C 755024136 YDKWSUZJQNPLED-NSHDSACASA-N 433.490 2.404 10 20 IECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4CCOCC4)cc3C(F)(F)F)C(=O)[C@@H]2C1 761096608 JYVRTHHGGRVQHB-WBVHZDCISA-N 427.423 2.484 10 20 IECD Cn1nc2c(c1NC(=O)C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 761973096 MXHCGIXLYANNQL-ZDUSSCGKSA-N 433.459 2.234 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)n1cccn1 761982427 LEYIMUPMMXMBTQ-QAPCUYQASA-N 433.940 2.042 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC(F)F)c3)cc2F)C[C@H](C)O1 762414539 NMKZUFQQTBHWOR-STQMWFEESA-N 439.438 2.156 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H](CCO)C1 765222362 OAYTWKPBAKXWCK-AWEZNQCLSA-N 449.485 2.336 10 20 IECD Cc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1-c1ccc(O)nn1 768912143 NANLUUNWHIMYHF-MRXNPFEDSA-N 442.907 2.430 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@@H]1CCO[C@]3(CCOC3)C1)c2[N+](=O)[O-] 770907135 AGXDBVQCOAUIIQ-JCQPUDPBSA-N 436.420 2.438 10 20 IECD CCCOc1ncccc1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778243814 AAEJVZBKEPPWQX-ZHACJKMWSA-N 438.528 2.400 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778301462 IQHJROZJTKDYBH-SQZREULQSA-N 437.540 2.274 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(OC[C@@H]4CCCCO4)CC3)CC2)cc1 779222232 JLXBZXDEMXBXNO-RDGATRHJSA-N 447.620 2.228 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1 785298527 VQGNNBFELIKICJ-AWEZNQCLSA-N 435.484 2.379 10 20 IECD CSCC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 785600801 JNKWTKTXVWPDFI-MRXNPFEDSA-N 444.536 2.161 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1 786650358 PFEBNSVIPLFWOA-UHFFFAOYSA-N 426.517 2.163 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1nnn(Cc2noc(C)n2)c1C 787425289 NTVQLFURIUHIJS-UHFFFAOYSA-N 435.282 2.457 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccccc1CN1CCCC1=O 787435450 XZZSXFJJLYVDDR-UHFFFAOYSA-N 432.571 2.180 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccsc3)CC2)cc1 788953626 BYKJFBYYNNJKLJ-UHFFFAOYSA-N 428.558 2.195 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 789826005 OLFCMXSTNNJHKC-WSTZPKSXSA-N 446.567 2.142 10 20 IECD Cc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841283 WPYYCMOJABZBRT-UHFFFAOYSA-N 443.519 2.249 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCC3CCC(C)CC3)CC2)cc(OC)c1OC 793948582 QAOJTDFZTYKFSY-UHFFFAOYSA-N 433.549 2.304 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c(F)c1 794594820 BYOYAAGXGJECCP-UHFFFAOYSA-N 435.477 2.082 10 20 IECD CCOC(=O)c1ccc(F)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 795349468 CRCGMCKIYVYWDX-UHFFFAOYSA-N 449.504 2.472 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3COC(=O)NC(C)C)CC2)cc1 796703664 CPCVEYJBDQUERD-FGZHOGPDSA-N 448.608 2.167 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1 801527328 JXENCXYIMWDNOB-AXKGWLQCSA-N 437.540 2.367 10 20 IECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 806181571 YEDMGARGCKSUAP-WMZOPIPTSA-N 427.501 2.277 10 20 IECD CC(C)(C)[S@@](=O)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806194908 MUDSBQFZSHILMQ-KJEZJMDVSA-N 445.532 2.036 10 20 IECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCCCSc2nccs2)CC1 806278982 AZNZCMLOYYAVAA-OAHLLOKOSA-N 433.603 2.478 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](CO)(Cc4ccc(F)cc4)C3)nc12 808794364 FYJYKPMNUPGCME-QFIPXVFZSA-N 428.464 2.178 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 810064582 LATUAZPZUDKHKS-UHFFFAOYSA-N 444.557 2.181 10 20 IECD COC(=O)c1ccc(CNC(=O)[C@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 821958512 LUXGDTJXQIPQCU-SFHVURJKSA-N 425.529 2.447 10 20 IECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)c([N+](=O)[O-])c1 917085707 XXPVKAZODXBPMA-UHFFFAOYSA-N 434.518 2.324 10 20 IECD CS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918027724 CLDMLYQTNDVYQV-MRXNPFEDSA-N 430.530 2.114 10 20 IECD COc1cc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1OCCO 918229059 VYHVWUBQYXKBLX-UHFFFAOYSA-N 443.544 2.274 10 20 IECD CCCNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284911 USNHPJDYWVVSLR-UHFFFAOYSA-N 442.491 2.057 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 918305959 PUQGBHDCMXRWQP-UHFFFAOYSA-N 425.518 2.047 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 918372195 WGBFMFMDVMCHEC-FQEVSTJZSA-N 445.541 2.233 10 20 IECD CCNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918436747 ASNILVQGXAJMEE-UHFFFAOYSA-N 426.542 2.244 10 20 IECD Cc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 1322789754 JMNIBXVLIZDCOV-CQSZACIVSA-N 440.483 2.194 10 20 IECD NS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc2c1CCC2 1335430322 WRJLBSIYLNITQL-GOSISDBHSA-N 430.526 2.350 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CC1)C2)C1=NN(c2ccccc2)C(=O)C1 1778126478 XOQUUYPLOVPOSE-HYBUGGRVSA-N 438.528 2.093 10 20 IECD COC(=O)C1(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)CC1 1791309414 FFPVINKSVXMAKN-UHFFFAOYSA-N 425.441 2.194 10 20 IECD CO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878246 HNYIJFCHGIVXOW-SBYGZDSISA-N 432.517 2.471 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2ccccc2F)C1 1842699159 XLSCRYJTIZCNSD-UHFFFAOYSA-N 434.471 2.365 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc3ccoc3s2)C1 1843241319 ZRJKSPGKGGDELY-UHFFFAOYSA-N 435.552 2.172 10 20 IECD Cc1ccn2ncc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)c2c1 1847039197 WNQFGUNVEHDSCN-GQCTYLIASA-N 448.479 2.290 10 20 IECD COc1ccc(N2CCCN(C(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]43)CC2)cc1 209768173 TVBCKQJGWXAKPV-DYXWJJEUSA-N 432.590 2.460 10 20 IECD NS(=O)(=O)c1cccc(NC(=O)CCN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 731845393 ZPJDCIZBQVMPIJ-SFHVURJKSA-N 433.530 2.049 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1N1CCOC1=O 743900316 GAGXGLWBDMEEGQ-UHFFFAOYSA-N 430.436 2.112 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(cccc4N4CCOC4=O)C3)nc12 744413734 HMNMZBHHPPZDJJ-UHFFFAOYSA-N 437.456 2.127 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)[C@@H](C)c3ccc(C)cc3)CC2)cc1 745753390 CKCLVYOSTJHCPJ-FDDCHVKYSA-N 426.513 2.360 10 20 IECD CCOc1ccc(N(CC)CC(=O)NN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)cc1 746158608 BYZNJBAEIZCKNO-HSZRJFAPSA-N 440.500 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cc1 747545924 KPQANRFZRMIYOW-UHFFFAOYSA-N 430.530 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@](C)(O)[C@H](C)c3ccccc3)CC2)cc1 748483292 FXIOGRXPEOESJA-KOSHJBKYSA-N 426.513 2.442 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(C(N)=O)s3)cc2F)C[C@@H](C)O1 748958829 OPPVVAQSODNVHV-CHWSQXEVSA-N 449.504 2.073 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(C3CCOCC3)c2)cc1Cl 749754707 FIPMWIARPDGVFH-UHFFFAOYSA-N 434.927 2.060 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C[C@@H]2CCOC2)CC1 749852439 FYJQANBGLYTLNW-MSOLQXFVSA-N 447.535 2.443 10 20 IECD CCN(CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S)C1CC1 750830208 ZDPBRRAULRJWCW-YVLHZVERSA-N 433.555 2.217 10 20 IECD COCCN1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751063802 RVAYLYGEGAIQDF-UHFFFAOYSA-N 439.559 2.095 10 20 IECD O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751213566 XZWPBPKTAGQZLQ-UHFFFAOYSA-N 445.906 2.284 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2nc(O)c3cnn(C)c3n2)cc1 751405228 JQRPYCUIVSWKFC-GOSISDBHSA-N 438.532 2.275 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C(F)(F)C3(O)CCC3)cc2F)C[C@@H](C)O1 753417811 NTNHCNQGPKOENK-ZIAGYGMSSA-N 444.450 2.149 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F)c1ccc(N2CCOCC2)cc1 772991834 XAQSAMBFTPAWDK-LBPRGKRZSA-N 425.411 2.091 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)CC2)cc1 774754449 JOBLBCDCCDBZAC-NNMXDRDESA-N 430.593 2.264 10 20 IECD CN1CCN(c2ccc(CN3CCC(NS(=O)(=O)c4cccs4)CC3)cc2)CC1 775645849 RQJMDWGFPANRJQ-UHFFFAOYSA-N 434.631 2.443 10 20 IECD CNC(=O)[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCO1 782096249 AAMMXLYVIZADRY-IBGZPJMESA-N 434.334 2.486 10 20 IECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785297757 SEBJNXGKLPEDCY-CQSZACIVSA-N 441.484 2.171 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 788012617 DNERPLUVCSRGQI-WOJBJXKFSA-N 437.588 2.257 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(-n4cccn4)cc3)CC2)cc1 788379426 JWCGLESHLRIZKY-UHFFFAOYSA-N 433.512 2.282 10 20 IECD CCCC[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734115 PYSVKUZYANLALE-SBHAEUEKSA-N 428.577 2.480 10 20 IECD COc1ccc(CNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c(O)c1 797623314 QJFXEJRLVJYJEC-UHFFFAOYSA-N 448.545 2.049 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)Oc1ccc(F)cc1 803304189 FBVRNJQZNLUPPK-IRXDYDNUSA-N 429.492 2.423 10 20 IECD CCN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1)CC(F)(F)F 803687272 APOPKMKSGYUOBB-QGZVFWFLSA-N 440.510 2.418 10 20 IECD O=C(NCCN1CCCc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803999391 XXUYILLGIFVBRT-OAQYLSRUSA-N 437.540 2.469 10 20 IECD COc1ccc(O)c(CNC(=O)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c1 806811727 WXFINUGEAGKJHW-SFHVURJKSA-N 429.473 2.018 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 807372877 NJDKHSKRUBYSEN-IRXDYDNUSA-N 431.558 2.217 10 20 IECD COCCN(C)CCN1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1=O 808269629 LDBSXKVSXHGPAA-IBGZPJMESA-N 430.524 2.142 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918140712 OJXFROCCWONLJT-GASCZTMLSA-N 435.521 2.325 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 918295238 OXULBJDAWQMKNY-KRWDZBQOSA-N 425.485 2.207 10 20 IECD Cc1cc(C)n(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cn2)n1 918337291 IPVPPBITAFENEU-UHFFFAOYSA-N 439.541 2.049 10 20 IECD CNC(=O)[C@@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)c1ccccc1 918992635 KCEOGLNSWMVTQX-KRWDZBQOSA-N 426.498 2.256 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C(=O)c2cccc(F)c2)CC1 919791734 HGMPTMPUOBNURS-UHFFFAOYSA-N 426.492 2.330 10 20 IECD NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919971435 XYXKFTMYLSDWEN-UHFFFAOYSA-N 441.912 2.018 10 20 IECD CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 920345299 GAFFTUJOUBBFIO-RBUKOAKNSA-N 428.577 2.289 10 20 IECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 920495829 GCVQZYYWFGFSAE-DVECYGJZSA-N 437.496 2.367 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(C(=O)OC)ccc3OC)CC2)cc1 1186563048 ICCXHSVWSWEQPO-UHFFFAOYSA-N 434.514 2.391 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1319047598 YSFUSIGXQRTUQK-UHFFFAOYSA-N 439.516 2.493 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)no1 1779133781 WVYTZPVRBSMBDL-ATKOVBFVSA-N 447.875 2.205 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@@H]21 1801327186 KUDCAIUGHWJNAO-KAKHCHCBSA-N 428.510 2.330 10 20 IECD COc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c(F)c1 1810543081 SHIHZEIPBZSSHA-UHFFFAOYSA-N 444.463 2.194 10 20 IECD O=C(Cc1cc[nH]n1)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823712253 APDVFHPSLVKXFV-JTQLQIEISA-N 447.904 2.399 10 20 IECD Cc1cc(C)n(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827426871 LQOGBLAWADMZLO-IBGZPJMESA-N 441.532 2.240 10 20 IECD O=C(c1nc(-c2ccccc2)ns1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249694 MPLPBYBYYKDYQA-UHFFFAOYSA-N 437.481 2.142 10 20 IECD C[C@@H](Oc1cccnc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502409 ULVXCOYUOGWJKY-CYBMUJFWSA-N 431.876 2.431 10 20 IECD C[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccn1 1846665084 URYFXAUYDRCKIW-QGZVFWFLSA-N 431.496 2.181 10 20 IECD CC(=O)N[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)C(C)(C)C 1847704276 MCFVLAXYLPVNQK-RLFYNMQTSA-N 437.924 2.117 10 20 IECD COc1ccc(N2CCCN(CC(=O)N3CCC(C(=O)N(C)C(C)C)CC3)CC2)cc1 97476995 QPPFYYZBHSEUGU-UHFFFAOYSA-N 430.593 2.313 10 20 IECD C[C@@H](NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(N2CCOCC2)cc1 728296899 WWOYSEYYGUBZNR-CQSZACIVSA-N 449.485 2.242 10 20 IECD CNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 729579389 ITBKWMNNFDFPBR-UHFFFAOYSA-N 430.480 2.233 10 20 IECD COC(=O)N(C)CCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729777560 BAYLDIFSKNDWLK-UHFFFAOYSA-N 438.436 2.422 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(c4ccccn4)CC3)cc2F)CC1 730132939 JFRBDYXDZWFHFN-UHFFFAOYSA-N 426.540 2.394 10 20 IECD CN(CCN1CCN(C(=O)OC(C)(C)C)CC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 738325824 JBMCSXFEBBVJPX-UHFFFAOYSA-N 447.624 2.196 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)cc1 746135197 VUYCVGKEHVPJGU-HXUWFJFHSA-N 436.512 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(c4cc(C)oc4C)C3=O)CC2)cc1 750823476 VZGYSHNYXOUAQJ-HSZRJFAPSA-N 440.500 2.021 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(N4CCN(C)CC4)nc3)CC2)cc1F 753832488 BOBFOFXVEDJYTA-UHFFFAOYSA-N 442.539 2.013 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 760972923 MDXAGTYJLVIATO-XLIONFOSSA-N 434.581 2.325 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cnn(CC(F)(F)F)c3)cc2)C1 763683933 XFDYNDRLYOQAPC-MRXNPFEDSA-N 438.454 2.147 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnc(CO)n3C3CC3)cc2F)C[C@@H](C)O1 767217819 TWRSDGZQOUHCFJ-OKILXGFUSA-N 449.552 2.267 10 20 IECD COc1cccc(C(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c1OC 769142306 UMWGSNBHQPOCAR-UHFFFAOYSA-N 425.529 2.498 10 20 IECD COc1cccc(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c1O 769502935 BCHQRNXHRXDBNV-IBGZPJMESA-N 446.525 2.463 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c(OC)c1 776434976 UNEJZJLVFMLAQI-UHFFFAOYSA-N 444.487 2.052 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3OCCc4ccccc43)CC2)cc1 778275048 GTALUYUQIOICSA-YSESTWPTSA-N 435.524 2.330 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccccc3-c3nc[nH]n3)CC2)cc1 778393857 OGJLLTPKPLITPQ-ZHACJKMWSA-N 432.484 2.324 10 20 IECD COc1ccc(N2CCN(C(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1F 782728263 PAOFRMCXRZABAO-UHFFFAOYSA-N 430.436 2.130 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3Cl)cc2)C1 786681255 HLORNVKFHOAXIR-GOSISDBHSA-N 442.947 2.017 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(C[C@H]2CCCO2)CC1 787120750 CKEPWVHCAVSTAX-HSZRJFAPSA-N 442.604 2.395 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3ccncc3)cc2F)C[C@H](C)O1 789819083 LHODDZGEFCKKON-IRXDYDNUSA-N 428.508 2.152 10 20 IECD CCSCC[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840715 MXICXLYVPJQMQU-OAHLLOKOSA-N 425.570 2.393 10 20 IECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789856217 QMJGXQKOFRLNRH-HXUWFJFHSA-N 432.634 2.340 10 20 IECD C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793723291 WLDRFIJYAKTTFJ-PIPMEXSNSA-N 449.555 2.009 10 20 IECD CCc1cc2nncn2c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 794490296 NCMFKUUNRJVUOD-UHFFFAOYSA-N 430.509 2.071 10 20 IECD CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NCc3ccc(OC)cc3O)ccc21 797389659 RYWXDFOMBDYAGD-UHFFFAOYSA-N 425.441 2.174 10 20 IECD O=C(NCC[C@@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451462 LNKATRUJTMLNBF-KRWDZBQOSA-N 425.476 2.448 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1 806885412 DQRHDHIJEPDZGH-LBPRGKRZSA-N 435.427 2.332 10 20 IECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 808085458 MAWCDSZYHYRXMU-GGAORHGYSA-N 442.604 2.155 10 20 IECD CN(C)CCCOc1cnccc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 808243456 KSMYTKKMOOEZBX-UHFFFAOYSA-N 427.549 2.248 10 20 IECD CCC1(O)CCC(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 809321023 PIZFRLLRGQBBNM-UHFFFAOYSA-N 442.604 2.035 10 20 IECD O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1ccc(N2CCSCC2)cc1 810161405 KQPZEDBTMUXOGY-UHFFFAOYSA-N 441.525 2.113 10 20 IECD CCOC(=O)[C@@H]1CCCc2sc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)nc21 817497100 RMQVSNGLERGXFJ-LLVKDONJSA-N 439.515 2.456 10 20 IECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1O 915796606 MEOOQCMSIROLGN-UHFFFAOYSA-N 435.502 2.432 10 20 IECD CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C)cc1 918339738 GPNDHRAOJXNVIZ-JOCHJYFZSA-N 443.569 2.114 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(N4CCOC4=O)cc3)CC2)cc1 918461817 NDXOXGHDSVLFOE-UHFFFAOYSA-N 438.484 2.329 10 20 IECD Cc1c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1-c1ccc(O)nn1 918632943 FMHMXHBRFPREGP-ZIAGYGMSSA-N 440.479 2.359 10 20 IECD COc1ccc(N2CCN(c3nnc(-c4ccc(S(C)(=O)=O)cc4)n3C)CC2)cc1F 1121278934 HZRCGQWSTHHXKG-UHFFFAOYSA-N 445.520 2.360 10 20 IECD C/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1781712326 JVTVRVVJQJPDSS-RVVWZKGKSA-N 430.501 2.297 10 20 IECD Cc1nc(N)sc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1796120748 KKYJDKYJDFJSRU-JDGWPXKUSA-N 444.513 2.116 10 20 IECD Nc1nc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)ccc2s1 1796600339 BHUKWQNIWXRTQG-BTTYYORXSA-N 439.497 2.250 10 20 IECD CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1798176954 WUYCELAIRPFIBT-IVWMJMPLSA-N 449.891 2.127 10 20 IECD Cc1cccc(C)c1NC(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1800086363 JXBKESBLNMFFMI-BJWYYQGGSA-N 438.484 2.000 10 20 IECD O=C(CN1CCCCC1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718804 GVIOLCGOILJTOB-QDMKHBRRSA-N 435.908 2.016 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C(=O)c1ccccc1 1804285035 ASDOKETZPFBPEJ-CBOOJTBASA-N 436.464 2.338 10 20 IECD CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cc1C 1804286493 ZTEICVREEYJZDK-FJXIAYRNSA-N 440.500 2.293 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)CC1 1826653217 AYCMDYQBAUTDCJ-SIKLNZKXSA-N 439.512 2.460 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CC1)CC2 1828197640 FWLUUYAUZOZNQR-GSQGTZRGSA-N 433.461 2.387 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829829988 ASAKGZDKUCVDJG-MRXNPFEDSA-N 443.460 2.276 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832845821 MRHWXRSNHHVQHF-MOPGFXCFSA-N 446.548 2.031 10 20 IECD C/C(=C\c1cccnc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846595602 WIXQTHZYVXUYEX-QGOAFFKASA-N 443.507 2.481 10 20 IECD C[C@@H](NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(=O)O 15036889 OFBBDBGYYAKVRD-QKNMJKLUSA-N 429.317 2.240 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc([N+](=O)[O-])c1 109034830 SWIMHBKPQUSLHE-UHFFFAOYSA-N 435.527 2.482 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(CN2C(=O)CCC2=O)cc1 117528348 LGRMDQSXUOCEBM-UHFFFAOYSA-N 425.460 2.241 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@H](C)NC(=O)C3CCCC3)CC2)cc1 727099914 JSVREQQVQHNYCI-IBGZPJMESA-N 430.593 2.409 10 20 IECD O=C(CN1CCN(CC2CCOCC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 736318130 FQKKFJOMEVFEKJ-UHFFFAOYSA-N 447.535 2.445 10 20 IECD C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 736374634 CHEWHMKPSNUPCA-UONOGXRCSA-N 449.495 2.259 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1 740916116 VTBRARFKAVZJRO-UHFFFAOYSA-N 446.495 2.424 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)CC2)cc1 742921611 VRVWXACBPBGFRC-FQEVSTJZSA-N 426.492 2.199 10 20 IECD CN(C)c1ccc(CNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1F 748951051 NTXMMWFNUPZJBY-UHFFFAOYSA-N 430.480 2.451 10 20 IECD C[C@]1(CCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCC(=O)N1 751513319 UEGJGNIETDLOOD-XMMPIXPASA-N 434.448 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3C[C@@H](O)c3cccs3)CC2)cc1 753865947 ILLCGPIGNVALFF-TZIWHRDSSA-N 445.585 2.230 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cc1 754127445 JCYZRJCCMFIRKS-YPAWHYETSA-N 428.577 2.464 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 755202883 PAFMTTMKCZPWPV-UHFFFAOYSA-N 444.557 2.228 10 20 IECD CC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 756232836 RSZPZRIPROIFAV-LJQANCHMSA-N 434.448 2.345 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cc3c(cc2OC(F)F)OCO3)c1 757426662 WTQNXRGYZVWBGF-UHFFFAOYSA-N 430.385 2.024 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)N3CCc4sccc4C3)CC2)cc1 758208510 GSRLHSQQBYIFRA-SIKLNZKXSA-N 444.645 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc([S@](C)=O)cc4)n3)CC2)cc1 771082152 JKSSKSBKQSYFBL-HKBQPEDESA-N 440.525 2.374 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCO4)cc2)C1 771732149 PDVIZMCFCSMRCV-SFHVURJKSA-N 429.542 2.192 10 20 IECD CNC(=O)c1ccc(Cl)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772912501 UKDAFQRNGCEOTH-UHFFFAOYSA-N 434.899 2.404 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)ccc3N3CCOCC3)cc2)CC1 786655623 GJERTVNRAJVPFF-UHFFFAOYSA-N 440.519 2.261 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 788823860 QSNTZNWTKUOQEC-WOJBJXKFSA-N 436.556 2.343 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@](C)(C4(C)CC4)C3=O)cc2F)C[C@@H](C)O1 789655423 YSRZUIUXCVSOJD-HUYGQZFBSA-N 446.523 2.166 10 20 IECD O=C(NCc1ccccc1-n1ccnc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793718497 MRRTVHQYRNEOAU-FQEVSTJZSA-N 434.496 2.402 10 20 IECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 803298747 DYKRXEFTEFBPJY-UTKZUKDTSA-N 441.528 2.456 10 20 IECD C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450526 JULQIFGXLFBJNW-LSDHHAIUSA-N 425.476 2.304 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@@H](c4ccsc4)C3)CC2)cc1 804317060 RTPPINXBANZKNV-HXUWFJFHSA-N 429.542 2.442 10 20 IECD COCCN(CCc1ccccc1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317243 XJNNUAJKAPZURS-UHFFFAOYSA-N 439.556 2.498 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)CC2)cc1 806515776 FGZHNYWEMPGOOI-KRWDZBQOSA-N 448.564 2.153 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 807387786 WWFHWZMODMCJGF-UHFFFAOYSA-N 448.195 2.134 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 918283058 AOENKIXEAJUUBV-UHFFFAOYSA-N 440.475 2.266 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c[nH]n2c1nc(=O)c1ccccc12 919971794 XZJMSHHNIJTLCW-UHFFFAOYSA-N 435.459 2.206 10 20 IECD C[C@@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 920920590 NWVWYHXEKRZPSV-VQIMIIECSA-N 443.500 2.052 10 20 IECD Cc1ocnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121851 BUHJVZIMDUXUCW-IIBYNOLFSA-N 449.891 2.489 10 20 IECD Cc1nccn1[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291665 SNLKDJHNWIWRFN-MHHQIZQESA-N 440.500 2.221 10 20 IECD COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1OCC(N)=O 105038708 MULYUMXQHPGNJL-HXUWFJFHSA-N 441.528 2.447 10 20 IECD CC(C)OCCCNC(=O)Cc1noc(-c2ccc(NC(=O)C3=S=CC=C3)cc2)n1 445410318 ZVWQQKOJWRPURA-UHFFFAOYSA-N 428.514 2.427 10 20 IECD COc1ccc(N2CCC(NC(=O)C[C@@](O)(c3nccn3C)C(F)(F)F)CC2)cc1 726562726 OZSZTSPKIFKVMI-LJQANCHMSA-N 426.439 2.354 10 20 IECD CO[C@@](C)(C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 730356534 ZRODCVMOZRKQRT-HSZRJFAPSA-N 430.476 2.384 10 20 IECD COc1ncnc(OC)c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 731974746 XCWKABATSDZQOF-UHFFFAOYSA-N 426.395 2.279 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)cc2F)C[C@@H](C)O1 732572312 SNUIBUWFGNOIHZ-ZENOOKHLSA-N 446.445 2.402 10 20 IECD CCN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](C)CS(=O)(=O)CC 733644365 FPCMHNRHXZOHFM-OAHLLOKOSA-N 429.558 2.142 10 20 IECD COc1ccc(O)c(CNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1 734069103 LPUVEMUJJSZIRU-UHFFFAOYSA-N 433.530 2.301 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1 740813212 XZGDYGHCGVMALJ-UHFFFAOYSA-N 446.572 2.433 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3=NN(c4ccccc4)C(=O)CC3)CC2)cc1 742917114 QREKNMLSMXUUSP-UHFFFAOYSA-N 435.528 2.116 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NCc2cc(OC)ccc2O)c1 751415537 RXJSABFOMRKYBR-VMPITWQZSA-N 437.470 2.083 10 20 IECD CCc1ccc(CC)c(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 752100784 SORJRIMVODIUJO-UHFFFAOYSA-N 443.569 2.301 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4nc(C)c(C)s4)CC3)CC2)cc1 754068433 AUWDJDJVJTVEJZ-OAQYLSRUSA-N 445.633 2.074 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc4c(cc3F)CCC(=O)N4)CC2)cc1F 754214572 MZMWMBIGBBKOOY-UHFFFAOYSA-N 444.438 2.145 10 20 IECD COc1cccc([C@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC)c(Cl)c3)C2=O)c1 757857283 OCZXMBYPFSDCDN-NRFANRHFSA-N 446.891 2.292 10 20 IECD Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 758150404 CPJQMZUOCQFMPD-UHFFFAOYSA-N 439.515 2.247 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(SC)nc3)CC2)cc(OC)c1OC 759409481 KYMCQNSZVTUBRF-UHFFFAOYSA-N 446.529 2.117 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCS(=O)(=O)C1 764228635 MURYEPXCKBZEBT-HRCADAONSA-N 427.542 2.015 10 20 IECD O=C(N[C@@H](CCO)C1CCOCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 764397070 FKGXXQWRVBMXFH-INIZCTEOSA-N 440.543 2.162 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)c2)CC1 771638035 XBZSFLCGOZBDFM-UHFFFAOYSA-N 434.537 2.470 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](C)C[C@H]2[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785546102 MNUIXJZBYGORBJ-OXTHUFEASA-N 433.574 2.406 10 20 IECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 787577824 ZVFIQKSELXWTJI-UHFFFAOYSA-N 447.289 2.248 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21 788281832 UQSIJRWJGHJTLX-GOSISDBHSA-N 430.549 2.201 10 20 IECD CN(Cc1ccc(Br)o1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311153 RFIXYYSWZSISJE-UHFFFAOYSA-N 436.306 2.154 10 20 IECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823744 FWHHYXWCYWTMMV-RRFJBIMHSA-N 446.523 2.408 10 20 IECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 790020721 DQKLCOFVCPHYGY-IBGZPJMESA-N 436.578 2.137 10 20 IECD CCC1CCC(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793734403 TZASJRPUXPJQRW-QLOJAFMTSA-N 428.577 2.337 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)COc3cccc(F)c3)CC2)cc1 793799536 OCMBWZQYVRJDQK-QGZVFWFLSA-N 429.492 2.457 10 20 IECD COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 797619986 DTBCJQLEHOVOKL-CQSZACIVSA-N 429.473 2.332 10 20 IECD CO[C@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798773668 XNYZRDODDJFBCN-QFIPXVFZSA-N 433.420 2.065 10 20 IECD O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803388311 XJPOTXQCSNGTNR-OAHLLOKOSA-N 425.407 2.267 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1F 803663922 AVHOZXNDAROPJX-UHFFFAOYSA-N 434.512 2.191 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688804 BMXMZPDMAVFGHG-LPHOPBHVSA-N 430.549 2.058 10 20 IECD CN(C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1)S(C)(=O)=O 804970051 UXKRZTJFHCIBGR-SFHVURJKSA-N 440.635 2.053 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)cn1C 805135152 HGLVBCVDAUNWLU-UHFFFAOYSA-N 435.285 2.262 10 20 IECD CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806280705 RYQBNQQAHRTROZ-CYBMUJFWSA-N 428.580 2.209 10 20 IECD CCCCCNC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807291898 PPGWVQBBUVAKRV-UHFFFAOYSA-N 426.561 2.224 10 20 IECD O=C(CN1CCN(C(=O)C(=O)NC2CC2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 917123999 AGTDCXATMNPHIB-UHFFFAOYSA-N 434.500 2.463 10 20 IECD CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918440584 SOKXMRSDRARYID-UHFFFAOYSA-N 442.491 2.309 10 20 IECD C[C@@H](OCc1ccccc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919109811 HOBIXLDLQOOQOL-QGZVFWFLSA-N 430.476 2.427 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 1320392875 BNEVFXODEIJHEF-SFHVURJKSA-N 442.512 2.416 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CC12CCS(=O)(=O)CC2 1323043408 VCWSDGIULZHEPZ-SJORKVTESA-N 426.966 2.341 10 20 IECD Cc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)o1 1799770161 KDFBQVFXPJVUOI-HBCWATKFSA-N 434.876 2.099 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1C 1807993341 HYTGNEFPDVCFGD-KKSFZXQISA-N 435.484 2.168 10 20 IECD O=C(Cn1cccn1)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1810176812 GJWGRXWHAKSCTO-UHFFFAOYSA-N 432.908 2.493 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(=O)C2CC2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811797268 RFRHRKPNAKQUFC-KBXCAEBGSA-N 443.887 2.445 10 20 IECD COC1(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1813672419 BNMNXFNGSWQFFW-KKSFZXQISA-N 440.500 2.167 10 20 IECD CC1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1815063637 IRXXYQOPEIODGO-KRWDZBQOSA-N 442.520 2.254 10 20 IECD Cc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816720930 CPYFGJYHOAGIQW-JTQLQIEISA-N 431.499 2.254 10 20 IECD O=C(CN1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817135953 PFCXUTYRDCXQLY-INIZCTEOSA-N 428.493 2.008 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1C[C@@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817364822 ZYHZAQNNVICLLS-YUTCNCBUSA-N 441.488 2.206 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1[nH]nc2ccncc12 1817908248 DFGYIJYLDKDGML-OAHLLOKOSA-N 448.443 2.107 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cncnc2)CC1 1827132077 FXEZSKBWKKICLE-IBGZPJMESA-N 439.516 2.149 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1 10619778 VWHIVSNTPMAMFM-INIZCTEOSA-N 433.482 2.041 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](n4cc(C(=O)OC)nn4)C3)ccc21 545453145 LRWCIJIVPFPQBH-QGZVFWFLSA-N 425.489 2.370 10 20 IECD C[C@@H](NC(=O)NCc1cccnc1N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 725867243 XDCOUJGYYHLYOP-LJQANCHMSA-N 438.576 2.230 10 20 IECD CC[C@H](C)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)NCCN1CCOCC1 732155935 GMRPNJUNSJXOII-JTSKRJEESA-N 441.576 2.082 10 20 IECD O=C1CCCN1C[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 732449079 LTTGBMAKHHOBHY-GOSISDBHSA-N 432.540 2.473 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2cnc(C)s2)c(O)nc1=O 732727580 OQHNHNDELGKILZ-CMDGGOBGSA-N 441.513 2.189 10 20 IECD CCN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 737106839 BYJMHKLKTJFORX-UHFFFAOYSA-N 426.492 2.300 10 20 IECD O=C(Cc1cc(-c2ccccc2)on1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 746136421 RDKPRTOZUATQPE-UHFFFAOYSA-N 425.510 2.435 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cncc(N4CCOCC4)c3)cc2F)CC1 756974384 ZRVOXYDOYKQLEZ-UHFFFAOYSA-N 427.524 2.129 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc4c(c3)C(=O)NCC4)CC2)cc(OC)c1OC 759982855 IBHUICFPGMETJA-UHFFFAOYSA-N 440.500 2.352 10 20 IECD O=C(COC(=O)c1cnc([C@H]2CCCO2)s1)NCc1ccc(N2CCOCC2)c(F)c1 760661950 CUWNEDPPQLFIMS-QGZVFWFLSA-N 449.504 2.444 10 20 IECD CN(CCNC(=O)NCc1cccc(Br)c1O)S(=O)(=O)c1cccs1 764798683 HKTFECDOOBCPJD-UHFFFAOYSA-N 448.364 2.336 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 765445693 IADOHSPBXKUDQK-UHFFFAOYSA-N 440.905 2.289 10 20 IECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1NC(=O)CCN(C)C 768580522 JEXMJKGBGQLRDB-UHFFFAOYSA-N 434.518 2.215 10 20 IECD CCOC(=O)C[C@@](C)(NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 776003639 XYGDZBGZFYJTGC-FJIRUFBNSA-N 445.560 2.384 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1[N+](=O)[O-] 777633948 ZIHHXZBLIIPGKO-UHFFFAOYSA-N 436.446 2.427 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCC(=O)OC(C)(C)C)CC2)cc1 778295876 WYUKLLJBWJRSMO-VAWYXSNFSA-N 431.533 2.138 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1F 780407134 FNYKSQNBHNAWLB-UHFFFAOYSA-N 435.477 2.082 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)c(F)c3)cc2F)CC1 786681993 GYTPMOYGJCTWLQ-UHFFFAOYSA-N 434.462 2.178 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1cccc(C(=O)NC)c1 787866669 YPDSFXCAMQOHIY-UHFFFAOYSA-N 448.317 2.179 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@H]1CCN(Cc2ccccc2)C1=O 788932307 JVSRYNOTILSAIU-QFIPXVFZSA-N 434.540 2.163 10 20 IECD COc1ccc(O)c(CNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1 789013175 MOMFQQNFBIRGGV-SFHVURJKSA-N 445.491 2.057 10 20 IECD CCn1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 789820339 PXWPZPPFDNPGBE-GASCZTMLSA-N 445.539 2.205 10 20 IECD CC(C)C[C@@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828787 YOFKAWNNQINOLE-NXMSCROESA-N 449.567 2.455 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N(C[C@H]1CCCO1)C1CCCC1 789839828 AUGDIEORNCVYBS-HXUWFJFHSA-N 447.551 2.353 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(c2cccs2)CC1 789845717 KMHTZLWLEWUHBI-UHFFFAOYSA-N 430.599 2.266 10 20 IECD CS[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)C 789845992 YDIMFUGIPLKUTN-GOSISDBHSA-N 425.570 2.297 10 20 IECD Cc1nc(O)c(Br)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795396645 LRQFVORQFHIYCQ-AWEZNQCLSA-N 447.333 2.490 10 20 IECD COc1ccc(N2CCN(c3nnc(-c4nn(C)c(=O)c5ccccc45)n3C)CC2)cc1F 800728661 YAXFJMPLAVCGKR-UHFFFAOYSA-N 449.490 2.203 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3nccn3CCc3ccccc3)ccc21 803687236 YLPFGBUHFNRCIB-UHFFFAOYSA-N 431.540 2.441 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccc[nH]3)cc2F)CC1 805008922 UTTLPXCNNWKSTB-OAQYLSRUSA-N 427.524 2.276 10 20 IECD CN(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCCOC1 806507862 RUPJEVIKPPJRIX-SFHVURJKSA-N 428.512 2.263 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)C3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 806847493 QIDSWWKQAJNQRF-GOSISDBHSA-N 446.592 2.436 10 20 IECD CN(C)CCN(C)CCCN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808781958 ZGWBPFGHFUXBBI-UHFFFAOYSA-N 436.556 2.216 10 20 IECD C[C@@H](C(=O)NCCc1ccc2c(c1)OCCO2)N(C)Cc1ccc(N2CCOCC2)cc1 857758594 MEWLLUUZTYAQEM-IBGZPJMESA-N 439.556 2.474 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4cccs4)CC3)cc2)C1 918118248 PSCCDNKCKZVEKH-LJQANCHMSA-N 441.601 2.477 10 20 IECD O=C(Nc1ccc(Cn2cncn2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918294042 BWOMKYURXOYNJE-FQEVSTJZSA-N 435.484 2.178 10 20 IECD CCOc1cccc2c1OCC(C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)=C2 918644530 BWFZGDRUYYVFHP-UHFFFAOYSA-N 442.537 2.412 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(N(C)C)nc3)cc2F)C[C@H](C)O1 919088884 UDOYRYAMHCDWIO-HOTGVXAUSA-N 444.507 2.374 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H](O)c1ccccc1Cl 1796602397 FBORQLZWQBFVTO-ZYKCCNLVSA-N 431.876 2.132 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cncc1F 1798934447 OWEZFJGPUVSHOA-LJWNITHASA-N 445.422 2.442 10 20 IECD O=C(CCN1CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1814071426 GGZJNLXVVMWGHO-CQSZACIVSA-N 445.545 2.051 10 20 IECD Cc1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816722284 GGZSYRGCSUMWGY-CYBMUJFWSA-N 425.470 2.192 10 20 IECD O=C(Cc1cccs1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722794 YBRSIOVXFCWXGR-NSHDSACASA-N 430.511 2.479 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1Cl 1843110703 KQYDWGVCYLQBFJ-FNORWQNLSA-N 446.891 2.273 10 20 IECD O=C(CNC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCC(O)CC2)c(F)c1 732275032 WZZCDQATHHTMSN-UHFFFAOYSA-N 440.519 2.171 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c1 734016625 VZRYRRWLNRCPRT-GOSISDBHSA-N 438.571 2.426 10 20 IECD C[C@H](NS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 734842621 SWLHCTJZPJEHNT-INIZCTEOSA-N 438.571 2.107 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(CS(C)(=O)=O)cc3)CC2)cc1 734842802 XRIYKNVFSOBTBY-UHFFFAOYSA-N 438.571 2.141 10 20 IECD O=C(NC[C@@H]1CCCO1)c1c(NS(=O)(=O)C[C@H]2CCCO2)sc2c1CCCC2 735646302 OTVJGIJHQUTFFM-UONOGXRCSA-N 428.576 2.456 10 20 IECD CN1CCC(=O)Nc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 741742237 SFLFIXBDEIONOK-UHFFFAOYSA-N 426.492 2.495 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C2(C(=O)NC3CC3)CC2)NC(=O)OC(C)(C)C)cc1 742752271 FRBCFWOIBABJSA-GOSISDBHSA-N 430.549 2.493 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OC)n1 743381930 KUFUXBDOKJETSN-OKILXGFUSA-N 446.479 2.106 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](O)[C@@H](C)c3ccc(C)cc3)CC2)cc1 745753404 CKCLVYOSTJHCPJ-MBSDFSHPSA-N 426.513 2.360 10 20 IECD NC(=O)NC[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745905932 SPVJYYSFNWJGFZ-CABCVRRESA-N 425.480 2.347 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](CNC(=O)c4ccccc4)C3)nc12 748834709 GKPGSDCZROYVKG-MRXNPFEDSA-N 437.500 2.254 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccc(-n2cnnn2)cc1 751467257 LQJXNKQAQMDXTK-UHFFFAOYSA-N 438.307 2.341 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 752005539 UJWHVMSFFCCLAU-HUUCEWRRSA-N 427.542 2.063 10 20 IECD C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 752633582 ZXHVMJKWCBBODG-CHWSQXEVSA-N 427.523 2.139 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@H]4CCOC4)CC3)cc2)C1 753121453 NOOWLFMDHTVEAP-PMACEKPBSA-N 444.576 2.115 10 20 IECD CCOC1CC(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)(N2CCOCC2)C1 767781556 ONNZDKKLAWCWPK-HRRASNIPSA-N 446.592 2.153 10 20 IECD CCOc1cccc(CN2CCN(S(=O)(=O)c3cc(C(=O)OC)cs3)CC2)c1O 768212575 LWUIFRPHNRZOBN-UHFFFAOYSA-N 440.543 2.146 10 20 IECD CC(C)(C)c1nnc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cn12 769560592 XNQOWSXTHYQROZ-UHFFFAOYSA-N 441.557 2.192 10 20 IECD CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 770006775 BKVUEZQBMUSZNL-QGZVFWFLSA-N 434.514 2.447 10 20 IECD COc1cc(Br)cc(CN2CCN(c3nccn4cnnc34)[C@@H](C)C2)c1O 770282354 UNDMGHSRHYFXAP-LBPRGKRZSA-N 433.310 2.312 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1F 774188801 JXETZYSPBVPAHT-UHFFFAOYSA-N 442.900 2.172 10 20 IECD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774363347 JBTYSJWHUBXHDK-OAHLLOKOSA-N 425.485 2.410 10 20 IECD COc1ccc(N2CCN(CCCN[C@@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 774375382 DYVBSUJNTGDIMT-SFHVURJKSA-N 432.590 2.206 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOc3ccccc3)cc2F)C[C@@H](C)O1 774855938 BFTNGLPXBJTOQI-CALCHBBNSA-N 429.492 2.251 10 20 IECD COc1c(F)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 777908231 HPUKSXXEKKRPRJ-UHFFFAOYSA-N 425.438 2.058 10 20 IECD CCN1CC[C@H](N(C)C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 778287452 MQCDTHDQOOKCJS-PCXBEVNGSA-N 428.577 2.231 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 784649065 DLCBSMRMPFWZDL-UHFFFAOYSA-N 444.557 2.182 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cc(F)ccc2N2CCOCC2)cc1 788928966 PWARVCQUJAYRQM-UHFFFAOYSA-N 442.535 2.441 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](N3CCCC3=O)C2)c([N+](=O)[O-])c1Br 790795107 QYLRCXICSCUYAT-SECBINFHSA-N 429.227 2.475 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)c1 798334042 LCOLXFJUURILAA-SECBINFHSA-N 429.292 2.302 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)Oc1ccccc1F)c1ccc(N2CCOCC2)cc1 803311283 SZUMZUZZPYRCTB-SJORKVTESA-N 429.492 2.423 10 20 IECD COc1cc(OC)nc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 804373680 XQVYMDSGBPSWKV-UHFFFAOYSA-N 425.468 2.362 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 807095888 AWTVHEQAJROLIF-IBGZPJMESA-N 436.556 2.346 10 20 IECD COCc1ncc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)s1 809464502 GNHDCVAQJHEISU-UHFFFAOYSA-N 429.502 2.239 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 809660689 SYGSFTYETRRWHT-UHFFFAOYSA-N 427.549 2.256 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918311471 RPIXDTPEWSHVEY-UHFFFAOYSA-N 438.528 2.178 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 1320275683 RWCOYAFETBUZMF-UHFFFAOYSA-N 446.573 2.009 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1ccc2c(c1)OCCO2 1320393680 LIBNIUWYSMWONK-HNNXBMFYSA-N 433.482 2.252 10 20 IECD CNC(=O)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1 1325005734 DZLCSGIAXOYHKZ-KHPPLWFESA-N 436.512 2.207 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1782003499 RTGKCAUUMZXBIO-FQEVSTJZSA-N 449.916 2.192 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cn1 1795301375 USVTYYQCIZKSQK-FJYVKWIBSA-N 427.432 2.303 10 20 IECD O=C(Cc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931918 SBGKPWVBOGMKAG-FNLKRUPLSA-N 431.496 2.055 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H]1C[C@@H]1C1CC1 1814762897 HDSDYUMMMUXQTL-IPYPFGDCSA-N 447.586 2.308 10 20 IECD COc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1822093784 YCTRFPMJFJGSDA-CYBMUJFWSA-N 440.481 2.498 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2Cl)C1 1843286083 PLDMFHXGABKNQQ-UHFFFAOYSA-N 427.848 2.105 10 20 IECD C[C@H](Nc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501666 NPGLHAKXHHJJKD-ZDUSSCGKSA-N 430.892 2.464 10 20 IECD CC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)C(C)(C)C 1847704274 MCFVLAXYLPVNQK-MPGHIAIKSA-N 437.924 2.117 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1 24429098 UUSCJBLPUPJEQF-UHFFFAOYSA-N 425.576 2.214 10 20 IECD Cc1sc2ncn(CC(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)c(=O)c2c1C 27672792 HZCAZMKGXYNHTQ-UHFFFAOYSA-N 442.541 2.343 10 20 IECD Nc1ccc(CC(=O)N2CCN(CC(=O)Nc3ccc(OC(F)(F)F)cc3)CC2)cc1 237891040 GBDCXTFHYOELNN-UHFFFAOYSA-N 436.434 2.493 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCN(C(=O)c2ccncc2)C1 303988005 HWLBIBPBNCJLBV-IBGZPJMESA-N 426.492 2.226 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 438811148 LPERDIMFVILQAV-GDLZYMKVSA-N 427.507 2.217 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)n(C)c2ccccc12 555682037 HUMNOTGMZAUPRF-HXUWFJFHSA-N 434.540 2.120 10 20 IECD O=C(CCc1nc(-c2nc[nH]n2)no1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726626041 VBASURSBYZNCLI-UHFFFAOYSA-N 433.419 2.174 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3(S(=O)(=O)c4ccccc4)CC3)cc2)C1 731339677 DZYNOGSOYXESFF-SFHVURJKSA-N 441.553 2.011 10 20 IECD Cc1cc(C(=O)N2CC[C@H](S(N)(=O)=O)C2)c(C)n1-c1cccc(Br)c1 732663862 CZOXVVJTXRFZTG-HNNXBMFYSA-N 426.336 2.360 10 20 IECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 733224915 CXRHRQZIABHMJT-RYUDHWBXSA-N 444.465 2.264 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc1 734214230 USTBEYBSFKQUPN-UXHICEINSA-N 445.608 2.154 10 20 IECD C[C@H](Oc1cccnc1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 735431443 FKWMVVKIEFRTIX-KRWDZBQOSA-N 436.491 2.421 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 736985837 YDIIMFRKEDPVQJ-SFHVURJKSA-N 439.516 2.343 10 20 IECD Cc1nc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)n[nH]1 737132047 UGVLMLZSJMSQKG-UHFFFAOYSA-N 448.527 2.244 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)cc1 743278665 SPGBOUAJYQEOQC-UHFFFAOYSA-N 432.546 2.042 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(CC(F)(F)F)n3)CC2)cc1 746154126 VXCRISLQJZSOTD-UHFFFAOYSA-N 426.443 2.398 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)c(F)cc1O 756706440 QWTCVQJOYIHRFB-NWDGAFQWSA-N 439.347 2.433 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 759369105 GXEKXDVCIKETDT-KRWDZBQOSA-N 431.558 2.241 10 20 IECD C[C@H]1[C@@H](C)OCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 765690187 ODLHIMYLJJVBQK-DLBZAZTESA-N 428.512 2.261 10 20 IECD C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 768950596 BVKHBIVXPHLMQX-WBVHZDCISA-N 433.553 2.101 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775260007 MIWCJVHHTGEGKS-WZONZLPQSA-N 437.540 2.300 10 20 IECD COC(=O)C1(c2ccc(S(=O)(=O)N3CCN(c4ccc(OC)cc4)CC3)cc2)CC1 776301313 RUKLQRUCRKAHGD-UHFFFAOYSA-N 430.526 2.411 10 20 IECD C[C@@H](OC(=O)c1cccc(C(N)=O)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781725259 ZUXIVMCRYCQZRW-GFCCVEGCSA-N 443.415 2.140 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccnc1N1CCOCC1 783315943 JADDNDFGIWAUBF-UHFFFAOYSA-N 425.533 2.360 10 20 IECD O=C(NC1CCC(CO)CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 783646056 ZQRVLTFFZZYMPE-UHFFFAOYSA-N 449.485 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC([C@@H]4CCCO4)CC3)CC2)cc1 784624252 KZCGTUKREYUJPZ-BVGULUMVSA-N 427.545 2.318 10 20 IECD COc1ccc(C[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789799747 LBOZPROLQJMBDA-QGZVFWFLSA-N 443.519 2.282 10 20 IECD CC1CCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789823712 FETVFGBIIXYUJZ-GUDVDZBRSA-N 448.583 2.292 10 20 IECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793806698 GJGYBEQHDKGVPG-FQEVSTJZSA-N 449.511 2.105 10 20 IECD O=C(N[C@@H](CO)CC1CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794122818 KPUQRVKECNSHHX-OAHLLOKOSA-N 449.485 2.382 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803297830 HQWJRBVSTWKFSH-PZJWPPBQSA-N 436.556 2.486 10 20 IECD O=C(NCc1cccc(CO)c1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448619 UWMZMCOBOIPEJY-UHFFFAOYSA-N 433.455 2.182 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)c3cccc(C(F)(F)F)c3)nc12 803809377 XYVAWXIWFGWOPU-OAHLLOKOSA-N 439.346 2.407 10 20 IECD CC(C)OCCCNC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807672781 HWORSBYZHWYTKH-GOSISDBHSA-N 446.592 2.100 10 20 IECD CC(C)(C)CN(CCO)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769154 SKUGLMWOXYGMFY-HNNXBMFYSA-N 427.492 2.240 10 20 IECD CCNC(=O)COc1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 916677722 IQMLIHIUIHTUPW-UHFFFAOYSA-N 430.480 2.499 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 920189326 OLFMRIPPFBESPC-UHFFFAOYSA-N 449.454 2.082 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)Cc3ccccc3)cc2)C1 920222472 UTVPOEOMTJMEHW-JTHBVZDNSA-N 448.567 2.238 10 20 IECD C[C@@H](NC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2)c1ccc(N2CCOCC2)cc1 1318659981 IQZSZQZJPZZYIR-OAHLLOKOSA-N 429.542 2.150 10 20 IECD O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1320543347 JGOSCYDLPZXEQP-DLBZAZTESA-N 434.518 2.161 10 20 IECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CC12CCS(=O)(=O)CC2 1323043405 VCWSDGIULZHEPZ-IRXDYDNUSA-N 426.966 2.341 10 20 IECD O=C(c1ccnc(F)c1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003162 DRMBPRMTSHICIQ-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(CN1CCSCC1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1785822187 JWYTTWGUBUMQDN-UHFFFAOYSA-N 442.541 2.289 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ncccc1F 1789055378 BUGLZFHURIVLBR-BNLOLNQZSA-N 449.866 2.192 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1F 1797221770 GZKNSHMHPRZJGZ-BPQKRJORSA-N 427.432 2.303 10 20 IECD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1)c1ccccn1 1799770489 XZSHIMOSCRCPHN-FIIQBIKZSA-N 445.903 2.153 10 20 IECD Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1804659777 POZBPAWXWOUDHN-MBSDFSHPSA-N 447.495 2.154 10 20 IECD CC(=O)CCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809113596 DIASWYYQPBJKOG-VMPITWQZSA-N 430.501 2.417 10 20 IECD CC(C)[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811796766 KZSLEQGMQKDKRM-CCKFTAQKSA-N 447.919 2.483 10 20 IECD CN1CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CC1 1817842779 NWZQVHCNVOHZLT-KRWDZBQOSA-N 442.520 2.254 10 20 IECD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)n1cccc1 1826590579 DZIXACPLFBKIHD-WCQYABFASA-N 427.486 2.238 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428356 WELOAYAHJXMCAL-LJQANCHMSA-N 441.532 2.309 10 20 IECD CN(C)C(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736351 CYDVIICIHKREPH-MRXNPFEDSA-N 437.924 2.073 10 20 IECD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)cc1 1847396177 UKEYWWOJINPZQO-JENIJYKNSA-N 446.887 2.309 10 20 IECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cn(C)nc1-c1cnn(C)c1 445561174 KOGNFEQEHBTDDZ-UHFFFAOYSA-N 442.545 2.054 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCCCN3CCN(C)CC3)cc2F)C[C@H](C)O1 728949958 XBAQPALRKWGATJ-OALUTQOASA-N 435.588 2.266 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ncn3nccc3c2=O)c(C)n1-c1ccc2c(c1)CCC2 732862429 AVQWDDMLOKBLPY-UHFFFAOYSA-N 445.479 2.213 10 20 IECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NCCCSc1nccs1 749729832 BBFWEDVEJBRZID-UHFFFAOYSA-N 427.573 2.233 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCn2cncc2C1 750853038 CRIGDKQSELNLDE-GOSISDBHSA-N 435.507 2.018 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752096850 JTWMGCUDHBEKKZ-GOSISDBHSA-N 426.469 2.254 10 20 IECD CC(C)(C)OC(=O)N(CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CC1 753108710 SZNPSMYOMDIBPX-KRWDZBQOSA-N 430.549 2.404 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3C[C@@H](O)c3ccco3)CC2)cc1 754063005 YRIAUKHLSGSUBC-FUPPJEDESA-N 429.561 2.359 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(=O)Nc4cc(F)ccc43)CC2)cc1 754064518 RQIHXBLUQWFUCZ-LJQANCHMSA-N 428.508 2.166 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](c4nncn4C(C)C)C3)CC2)cc1 754072368 UISDCZHPNMTEJY-RBBKRZOGSA-N 442.608 2.230 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4cc(F)ccc4oc3=O)CC2)cc1 754592230 KKTSGNULPCOABE-UHFFFAOYSA-N 440.427 2.446 10 20 IECD COC[C@@](C)(NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)OC 757012879 RXLZIEUGNUXQTB-LVMGUKCRSA-N 442.584 2.424 10 20 IECD CCS(=O)(=O)N1CCC(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 758449944 PIMSVUWNMNHMAL-UHFFFAOYSA-N 438.594 2.025 10 20 IECD O=C(NCCc1cscn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 767937379 GKJOQOKKNWUQQM-UHFFFAOYSA-N 441.536 2.441 10 20 IECD CC(C)[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768520747 ADRSVYXSPNWPLO-ZCCHDVMBSA-N 434.512 2.022 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 772996193 CETHYTINJQKBRN-KSSFIOAISA-N 433.578 2.371 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21 773746002 SNNJOMODSUFQMX-CQSZACIVSA-N 431.514 2.006 10 20 IECD O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775031444 AFONPBUFVHPWCW-FCHUYYIVSA-N 437.540 2.291 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)N3CCC[C@@H](C(=O)O)C3)c2C)cc1 777367282 FNXANPNPCSVHTG-QGZVFWFLSA-N 427.501 2.498 10 20 IECD Cc1cc2c(N3CCN(C(=O)C(=O)NCc4ccc(N(C)C)cc4)CC3)ncnc2s1 785429304 ZOORGLJAVIZYIM-UHFFFAOYSA-N 438.557 2.031 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCCN3C(=O)c3ccco3)cc2)CC1 786655028 BSOGGFJYIVYVFK-OAQYLSRUSA-N 438.528 2.259 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@H]1CN1CCCCC1 789855707 WXVUFYDASFFXBA-NRFANRHFSA-N 430.618 2.333 10 20 IECD C[C@H](CC1CCCCC1)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793733630 NLGVGJRQFIJYLF-XLIONFOSSA-N 428.577 2.480 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1 799527956 VSZBFBKTCHPOAK-UHFFFAOYSA-N 425.532 2.341 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1ccccc1F 803311281 SZUMZUZZPYRCTB-IAGOWNOFSA-N 429.492 2.423 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)CCc3ccccn3)cc2F)CC1 805007459 RYSLPSZBRSHLEK-UHFFFAOYSA-N 441.551 2.070 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc(OC)c1OC 807652618 XOVALMDJIYTVIM-KZNAEPCWSA-N 445.560 2.446 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 810112550 XZUZGNXWNZRXDH-QLFBSQMISA-N 440.521 2.296 10 20 IECD O=S1(=O)CC[C@@H](NS(=O)(=O)c2ccc(NCc3c(O)cccc3Cl)cc2)C1 863992782 IITGZWXINGIZHP-CYBMUJFWSA-N 430.935 2.123 10 20 IECD O=C(NC1CC1)C(=O)N1CCN(Cc2c(O)ccc3cc(Br)ccc23)CC1 917468991 NJWPZUHKIWEYFN-UHFFFAOYSA-N 432.318 2.231 10 20 IECD CC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n(C)c1 919028234 NRZIKKLJNLQNFH-GASCZTMLSA-N 445.491 2.454 10 20 IECD O=C(CCN1C(=O)COc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971531 POUZGDYFMRIPDT-UHFFFAOYSA-N 427.476 2.219 10 20 IECD CCN1C(=O)C(=CNC[C@@H](c2ccccc2OC)N2CCCC2)C(=O)N(CC)C1=S 920980356 KCTAQAKWANNHMF-SFHVURJKSA-N 430.574 2.301 10 20 IECD Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782007367 FYQDLEXMLXOKTH-OAQYLSRUSA-N 434.876 2.339 10 20 IECD CCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795212639 WCHXOAYKDQSYGS-JHDGKUDLSA-N 425.529 2.334 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1OC 1796601494 QALVYHVCWARKLR-MUJYYYPQSA-N 427.457 2.076 10 20 IECD O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806515403 MURRVCGKQUJNMD-WZONZLPQSA-N 432.480 2.450 10 20 IECD O=C(/C=C/c1ccoc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721426 KMIUVHSFGLXCCN-HJFNVNOESA-N 426.454 2.482 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc(Cl)ccc2F)C1 1841175672 ARDCXCLITUQUSA-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CSCC(C)(C)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441097 MFGYLTJVHZSELE-UHFFFAOYSA-N 428.558 2.372 10 20 IECD CC[C@@](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)(C(=O)OC)c1ccccc1 731842293 BDRWJAXBTHSRPC-DEOSSOPVSA-N 425.529 2.412 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ccccc3OC)CC2)cc1 742948505 VIJNJKBFXQSCKV-UHFFFAOYSA-N 428.533 2.204 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 751097191 HYBKDIZHLGDYRA-IHPCNDPISA-N 428.577 2.289 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3c(OC)ncnc3N(C)C)cc2F)CC1 754450627 JRTMPZUFNLHNIP-UHFFFAOYSA-N 431.516 2.154 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](CC(C)C)N3CCCCC3=O)CC2)cc1 756580760 QWXBXPDUXVMUPT-OAQYLSRUSA-N 445.560 2.314 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccnn1Cc1ccccc1 756764527 LGTHKFMGHAYWIQ-UHFFFAOYSA-N 433.512 2.365 10 20 IECD COc1cc(N2CCN(C(=O)CN3C(=O)CCc4ccccc43)CC2)cc(OC)c1OC 759226148 VSVPBQKBRWOEKW-UHFFFAOYSA-N 439.512 2.340 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 760206325 YCPWEJWZNKQQNT-GOSISDBHSA-N 435.484 2.428 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cn1C 760508645 FBUGBVGFEATVFO-UHFFFAOYSA-N 429.520 2.073 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Br)c(O)c1 763945178 KJYZRPQBDDYPGE-UHFFFAOYSA-N 439.331 2.320 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccncc3Br)CC2)cc1 764136053 UFKJDOVEHIVGKK-UHFFFAOYSA-N 434.290 2.358 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C 768073697 GXLQYVPWDYOJJD-UHFFFAOYSA-N 438.528 2.097 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)O)c(Br)c1 775286389 GNRCBVXIHFZKBJ-UHFFFAOYSA-N 430.232 2.440 10 20 IECD Cc1sc2ncc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c(=O)n2c1C 775765919 UYEJPZURCBJXTH-UHFFFAOYSA-N 430.505 2.403 10 20 IECD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccc(O)c(O)c1 779479516 NRKQXSBBSGLVRN-ONNFQVAWSA-N 425.485 2.435 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)o1 785644352 CGZOLZPHWXGTKX-XLIONFOSSA-N 428.533 2.021 10 20 IECD Cc1cc2c(cc1C)O[C@H](C(=O)OCC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 786393192 GNWUPRJKCZFMJS-QFIPXVFZSA-N 442.487 2.442 10 20 IECD CCCC(=O)Nc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788016241 RJGUBRSJDGRADD-UHFFFAOYSA-N 438.528 2.194 10 20 IECD CCc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789823757 FXVUEZCHQNXPOL-ZIAGYGMSSA-N 434.537 2.391 10 20 IECD Cc1cccc2c1CN(C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 789843579 AGWYJMYMWSZHAI-UHFFFAOYSA-N 425.504 2.296 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(C2CCCCC2)CC1 789862944 YTLKTVFFXDJNOB-UHFFFAOYSA-N 430.618 2.333 10 20 IECD CC(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793723899 OGQDACDPMHAGLD-VQTJNVASSA-N 428.577 2.289 10 20 IECD C[C@@H](c1ccccc1F)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734594 UWMCNLAMFMTEFQ-FUHWJXTLSA-N 440.519 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3COc4c(C)cccc4C3)CC2)cc1 794167461 IQYNYPOXPHIXEM-JPMGXVIASA-N 435.524 2.328 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3S[C@H](C)C(N)=O)cc2)CC1 800952772 JEJHSQHRPQWSEU-MRXNPFEDSA-N 440.569 2.251 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)ccc1F 801252947 JXXDUKKFJLIIQH-UHFFFAOYSA-N 431.283 2.474 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803145855 AMPMNMNHMBRMFF-LJQANCHMSA-N 427.501 2.400 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)CN1CCOCC1 803676582 AIYHNEWTENYZPK-LJQANCHMSA-N 430.593 2.156 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)o1 804315901 UZVPCHADMYDHJA-HXUWFJFHSA-N 429.517 2.440 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3c(C)cccc3F)cc2F)CC1 805006719 CJJDWFVGFUCBSH-UHFFFAOYSA-N 430.499 2.348 10 20 IECD C[C@@](O)(C1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)C(F)(F)F 807289746 HKKLAEBKTKYLKQ-HXUWFJFHSA-N 425.451 2.231 10 20 IECD CCc1cnc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 807770889 UWYDMMYVKBQGII-UHFFFAOYSA-N 441.601 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@](CO)(Cc4ccc(F)cc4)C3)CC2)cc1 808795774 YBDJTHPTIGXQFG-VWLOTQADSA-N 441.547 2.410 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccnc4-n4cccn4)n3)CC2)cc1 809465841 ZRKULBDKQSJVFB-UHFFFAOYSA-N 445.483 2.217 10 20 IECD CN1CCC(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 813421315 FHYNGUBUDBKJET-UHFFFAOYSA-N 426.540 2.290 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H]1CN(Cc2ccccc2)CCO1 918179399 PJXJZXXDTYFHFJ-OAQYLSRUSA-N 442.535 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1 920253159 SBYPPQCXVJOFBB-SEYXRHQNSA-N 436.512 2.241 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3ccncc3)cc2)CC1 1324998931 ORDRZSZSSXWUQO-XMMPIXPASA-N 435.572 2.421 10 20 IECD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)ccn1 1779518436 ARTLBGGPBMRZFE-OAQYLSRUSA-N 431.876 2.212 10 20 IECD CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)CCCC1 1783639902 OPEPBOGZDCDQKO-ONQJJZRUSA-N 444.528 2.377 10 20 IECD Cn1cc(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)cn1 1792314095 ROXGDCDWBLLLMZ-UHFFFAOYSA-N 443.554 2.028 10 20 IECD CC(=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 1798418182 BGMQNUQMHPYPQO-XMTFNYHQSA-N 447.532 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnn2cccnc12 1800718063 KRPXVAMNDNYYHL-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1 1802211563 SKUMVKFGSDQVKX-FLXSYLCISA-N 443.594 2.289 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1C[C@H]2CC[C@@H]1O2 1804291547 LYLXRZKNXQWDDJ-JNAKVWCCSA-N 428.485 2.022 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccc(F)nc3F)C2)CC1 1804678461 GLHCFXAVTBRAPM-UHFFFAOYSA-N 432.427 2.325 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)c3ccc(O)nn3)C2)CC1 1807947964 DXXYPTNWGSWRIZ-UHFFFAOYSA-N 446.891 2.405 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997874 GCXYMVHNOJNQGC-FOTGTACZSA-N 434.855 2.132 10 20 IECD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1810999172 LEWICKQBCHFGGK-VBKZILBWSA-N 437.456 2.072 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1CCC(O)CC1 1822546682 MWDCHRCVBWUYPN-PXCJXSSVSA-N 429.477 2.073 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@H]1CCOC1 1822957584 PADWBCQFGDKIJU-ZCGHOXCVSA-N 442.472 2.269 10 20 IECD Cc1occc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823495804 CDVRHMKHVBJFIO-AWEZNQCLSA-N 447.542 2.477 10 20 IECD CNC(=O)c1cccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 741909546 JRJNFORJIKNIQC-UHFFFAOYSA-N 448.502 2.232 10 20 IECD C[C@H]1CCCN1CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 746111164 ZLPKWPXPWMOSLM-VZWMTCDZSA-N 433.555 2.217 10 20 IECD O=C(Nc1cnn(Cc2ccncc2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 746363082 LALUYCVMZKPPSE-FQEVSTJZSA-N 435.484 2.178 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC(C)(C)C(=O)Nc3ccccc3)CC2)cc1 754063730 MBZIICWVCUCXJH-NRFANRHFSA-N 426.561 2.185 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4ccc(OC)cc4CC3)CC2)cc1 754074879 KROSBBQGFONWMU-HSZRJFAPSA-N 425.573 2.288 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ccncn3)cc2F)C[C@H](C)O1 755633767 PHJKCLUMRHOXEW-HOTGVXAUSA-N 430.480 2.022 10 20 IECD COc1ccc2c(c1)[C@H](NC(=O)/C=C/c1cnn(C)c1)CCN2C(=O)/C=C/c1cnn(C)c1 760651209 YPRKGCRHGCDUJW-OZXXFMRTSA-N 446.511 2.483 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(CC(F)(F)F)nc3C)nc12 764187715 IFVJCPLARKDRKS-UHFFFAOYSA-N 427.339 2.036 10 20 IECD COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@H](C)c1cc(OC)ccc1O 775368819 GOEKTAHHBOWARO-VLIAUNLRSA-N 425.485 2.433 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)cc1OC 775648031 NBHXROKCBSFKBX-UHFFFAOYSA-N 438.572 2.414 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN3CCc4ccccc4C3)CC2)cc1 778236075 MOEYNQDDFOLNDZ-KHPPLWFESA-N 448.567 2.075 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H]3CN3CCCCC3)CC2)cc1 778257423 SAMWBEOKDJPWBP-LEQVUBRHSA-N 440.588 2.377 10 20 IECD COc1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1-n1cnnn1 784108387 IDWUJSIMEMPCKP-UHFFFAOYSA-N 435.488 2.415 10 20 IECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)cc1 785600434 SKXXENITAVMNLC-NRFANRHFSA-N 433.487 2.457 10 20 IECD C[C@@H]1CN(C[C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H](C)O1 788934607 WMVQAVNMDRYCCV-WOIUINJBSA-N 428.577 2.003 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CSc2ccccc21 789845280 VNBDADOMRWVAAD-GOSISDBHSA-N 429.517 2.366 10 20 IECD NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(N2CCCC2)cc1 791320562 AWLVYYIRODDVLX-LJQANCHMSA-N 428.920 2.230 10 20 IECD O=C(Cn1ccnc1C(=O)c1cccs1)NCc1ccc(N2CCOCC2)c(F)c1 795230247 GKPRBBYVVJQIEO-UHFFFAOYSA-N 428.489 2.468 10 20 IECD Cc1csc(NC(=O)CSCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 799891160 AZBITIKXGGLKEN-UHFFFAOYSA-N 438.550 2.415 10 20 IECD C[C@H](NC(=O)C(=O)N1CCSC[C@@H]1c1nccs1)c1ccc(N2CCOCC2)cc1 803298720 DTGZWMAODGIGQN-MAUKXSAKSA-N 446.598 2.474 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(N2CCOCC2)cc1 803311166 MMFRDISNOJKXMV-GOSISDBHSA-N 436.556 2.399 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(OC)cc3)cc2F)CC1 805007767 PMYSEVUKTJYRJD-UHFFFAOYSA-N 442.535 2.251 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](N4CCCC4=O)C3)cc2)CC1 805020501 VYAMHUSQINBIJM-NRFANRHFSA-N 426.561 2.153 10 20 IECD COCc1csc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 807008537 DNGIPBMKVKSKSV-CQSZACIVSA-N 438.937 2.368 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 807095889 AWTVHEQAJROLIF-LJQANCHMSA-N 436.556 2.346 10 20 IECD CCc1cnc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)s1 807291349 HGPHEXNKBHUXDV-UHFFFAOYSA-N 425.558 2.047 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)ccc1C 807511819 WONHXFVSKBZOOB-UHFFFAOYSA-N 446.312 2.170 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H](N2CCCC2)C1 807768606 MXFBJQWYYNWYNI-WMZOPIPTSA-N 436.503 2.070 10 20 IECD Cc1nn(C)cc1S(=O)(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 808527274 DCOXNRFGUIRUOC-UHFFFAOYSA-N 427.533 2.024 10 20 IECD O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NCc1cc(Cl)cc(Cl)c1O 813684634 TUMMRSBZYNUKBN-MRXNPFEDSA-N 430.332 2.029 10 20 IECD CN1CCN(C(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)CC1 864049503 FFLONASAQWKDGS-GXDHUFHOSA-N 440.388 2.424 10 20 IECD NC(=O)CNC(=O)c1ccc(CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 915681988 LZZOPJHCHISSMG-UHFFFAOYSA-N 425.489 2.090 10 20 IECD COC(=O)CNC(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917087157 SRZUQMJPZMKWJX-UHFFFAOYSA-N 446.435 2.085 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccccc3Cn3cncn3)cc2)C1 918050663 VBZHPQCKAOTREO-LJQANCHMSA-N 433.516 2.350 10 20 IECD CN(C)C(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918117233 AWTWTELHJXXAJH-FQEVSTJZSA-N 437.544 2.090 10 20 IECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918440963 XSGRHWJNHDGDOM-UHFFFAOYSA-N 436.541 2.290 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(Cl)cc1F 1783695070 DOXQQSUNHVEMEQ-KCTSRDHCSA-N 449.866 2.192 10 20 IECD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1)c1ccccn1 1799770491 XZSHIMOSCRCPHN-NFWAQSGPSA-N 445.903 2.153 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2cccn2)cc1)c1cc(O)nc(O)c1 1800485107 SHLQJXGAEFIYNY-GGPHIMKMSA-N 433.468 2.244 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc2[nH]ccc2c1)c1cc(O)nc(O)c1 1802095467 YGMPQEGYFLKTED-BCDXTJNWSA-N 435.484 2.254 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808470220 UJBJGJBFJXTKHC-UWJYYQICSA-N 449.486 2.382 10 20 IECD CC(C)[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811796770 KZSLEQGMQKDKRM-KYNGSXCRSA-N 447.919 2.483 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ncon2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806336 KNDJVKHRMLNKFM-LRDDRELGSA-N 443.847 2.163 10 20 IECD CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814191239 JDJRTYSXCMWVOI-SCBMPYLRSA-N 446.598 2.160 10 20 IECD CCC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823475951 MKAKIKIEPVFOPW-RCQQVGEISA-N 428.445 2.211 10 20 IECD CC[C@@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708305 QYEGUCYDWXBHMA-JOYOIKCWSA-N 425.894 2.204 10 20 IECD CN1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1823805719 HJDAWRAFJTZTSI-IBGZPJMESA-N 430.549 2.068 10 20 IECD COC[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195005 HCNQNLCQGWOUGB-GRPWJJFYSA-N 447.513 2.168 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2cccc(Cl)n2)C1 1842114770 ZMVZBUHNOJJUKV-SOFGYWHQSA-N 443.887 2.311 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735519754 UEUBUJWNMBPISD-QGZVFWFLSA-N 435.484 2.404 10 20 IECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520176 XJHFAUFNVDZAJT-UQBPGWFLSA-N 449.507 2.293 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(F)c1 737132281 YJODYMKXTRWADB-UHFFFAOYSA-N 443.475 2.076 10 20 IECD COc1cccc2c1OCC(C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)=C2 751347761 ZYUXYZIXVPDMFM-UHFFFAOYSA-N 428.510 2.022 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 751385271 JMAMBLRSENMXQP-JTAQYXEDSA-N 432.609 2.067 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@]3(O)CCc4ccccc43)CC2)cc1 752641273 NOQVLAGTFHDKSW-VWLOTQADSA-N 438.572 2.341 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCN(c3c(F)cccc3F)C2=O)c1 756387313 JTHCIBXVFKBPIF-HNNXBMFYSA-N 426.397 2.004 10 20 IECD O=C(COC(=O)[C@@H]1CCc2n[nH]cc2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 757807291 JWVGGOPRQQHNIZ-CYBMUJFWSA-N 429.432 2.472 10 20 IECD CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 758988987 UGLIGVQBKMXHLU-KRWDZBQOSA-N 430.549 2.309 10 20 IECD CC(C)N1CCC(O)(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 761636643 FZUKANGCEBWKHE-ROUUACIJSA-N 436.572 2.474 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765903779 LLPULCURLJMPLX-UHFFFAOYSA-N 441.303 2.203 10 20 IECD CC(C)C[C@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768512574 QXXLINFAVIYWQZ-RVKKMQEKSA-N 434.512 2.022 10 20 IECD C[C@@H]1CN(S(=O)(=O)N2CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)C[C@@H](C)O1 768779829 YHOQISIJVATKPZ-CHWSQXEVSA-N 438.377 2.171 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CSC[C@H]2C(=O)Nc2cccc(F)c2)c1 769766309 NMIHDQNPPJVENR-HNNXBMFYSA-N 439.490 2.057 10 20 IECD CN1CCC[C@@H](N(C)C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 769913769 RMZHUYPJWNMAOP-MRXNPFEDSA-N 448.501 2.267 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3cc(C(=O)NCC(F)(F)F)n(C)c3)ccc21 775702477 XDTPKSPAZIKIKB-UHFFFAOYSA-N 444.479 2.178 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3c(Cl)ccnc3Cl)c2)CC1 777931259 SDYKNPNCUHEBID-UHFFFAOYSA-N 436.342 2.424 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)Nc3cccc(Cl)c3)CC2)cc1 779219627 VZODXCOHHUBIMD-OAQYLSRUSA-N 446.979 2.402 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3ncc(Cl)n3C)CC2)cc1 779332025 XDJLXZPXYOSVET-UHFFFAOYSA-N 434.972 2.436 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4cccc(F)c4)cc3O)cc2)C1 785920887 NOCUNRZGSIESFK-INIZCTEOSA-N 437.475 2.349 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 787993824 YRFCFDNHABZUIP-GOSISDBHSA-N 441.528 2.042 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)cc2F)C[C@@H](C)O1 789824562 IYEVOERECABEAC-NROPHMHMSA-N 447.551 2.375 10 20 IECD O=C(NCCc1ccc2[nH]ccc2c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833541 GOQCSAFCPXRPIN-UHFFFAOYSA-N 438.503 2.243 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(CCC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 803303068 GWDBSULJGMOZHM-IBGZPJMESA-N 430.593 2.281 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 803557199 KLXPSJUGIVIXCQ-OAQYLSRUSA-N 439.512 2.217 10 20 IECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C2CC2)cc1 803660912 IYHDACVUAHNDCQ-UHFFFAOYSA-N 426.492 2.059 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc3c(cc2OC(F)F)OCO3)cc1F 803662015 DMTSRXJFWHMRCV-UHFFFAOYSA-N 439.390 2.154 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C 803949561 MZOAAZOXYAWNEG-IBGZPJMESA-N 449.548 2.280 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN(C)Cc3ccc(F)cc3)CC2)cc1 804317455 DGJUYEOKZFWUHD-UHFFFAOYSA-N 442.535 2.168 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1)c1ccc(N(C)C)cc1 804521035 LDLGPNGOBNCFKK-GOSISDBHSA-N 438.572 2.203 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 808058249 LCQDKLJGBLVBSV-XZOQPEGZSA-N 436.556 2.043 10 20 IECD CC(C)Oc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccn1 808794145 HCOKQCKDTRYXAT-LJQANCHMSA-N 427.501 2.398 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@@H](c2ccco2)C1 808853724 CUMDKSULAUVCBO-OAQYLSRUSA-N 436.556 2.444 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 809232831 UBRJYDRRIYCNRM-LLIZOXFYSA-N 436.574 2.096 10 20 IECD CCCc1nc(C)c(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 817045577 GMPMCFKWVAJHEQ-ZHACJKMWSA-N 426.517 2.465 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 915083727 ISHQZIVHBUNLLY-DEOSSOPVSA-N 436.512 2.379 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(Cn4cncn4)c3)cc2)C1 918050752 VWECNODRQKMWGG-LJQANCHMSA-N 433.516 2.350 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc([N+](=O)[O-])c1 920906247 TUDHMHXQAPISAN-UHFFFAOYSA-N 431.420 2.352 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cc2)C1 921283157 ZCLZTEDPDMMEOP-QGZVFWFLSA-N 448.483 2.412 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c(C)o1 1777848013 YXAGRJGOGJLSLU-VGOFRKELSA-N 429.473 2.144 10 20 IECD CC(C)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1788700073 DSACWQFYFKRCLK-SDCOAXJVSA-N 440.924 2.158 10 20 IECD COc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1OC 1796604785 NKMZADNNAPGSLP-BTTYYORXSA-N 445.447 2.215 10 20 IECD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1800699946 NJIKGYCYHIZURX-BTTYYORXSA-N 444.419 2.414 10 20 IECD Cn1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c1=O 1800712264 FDHPZKPDQZVNAG-BTTYYORXSA-N 431.876 2.016 10 20 IECD CO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1801041748 NFQYYKCFAPQUQT-RPUPUWCGSA-N 425.529 2.332 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)no1 1807994299 GJYMPASCKKRXQB-IWAYSELLSA-N 449.467 2.217 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccn(C(F)F)n3)CC2)C1 1810546508 HHIDTQHYBCTUPU-UHFFFAOYSA-N 435.431 2.243 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814185995 WKAXITFREPRNLH-NBQZKYEYSA-N 448.614 2.384 10 20 IECD CNCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814965632 TUHRRUFVBIUAGB-NSHDSACASA-N 438.937 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(NC(C)=O)cc3)CC2)cc1 7226401 NUYLVNJJYJUPMA-UHFFFAOYSA-N 425.485 2.088 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCCN(C(N)=O)C3)c2C)cc1 10598697 NFXAKYZUVPRKAW-QGZVFWFLSA-N 441.484 2.397 10 20 IECD Cc1cc(C(=O)N2CCCN(CC(N)=O)CC2)c(C)n1-c1cccc(Br)c1 725886524 OVHLHYBBHRMRCA-UHFFFAOYSA-N 433.350 2.490 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(-c2ncon2)cc1 727038249 MNJQRXSRLGEYNS-UHFFFAOYSA-N 439.447 2.092 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727991001 DGXOQQQAOSDJNY-GIVRCXRQSA-N 444.601 2.262 10 20 IECD CCOCc1cc(CN[C@@H](C)C(=O)Nc2cccc(S(=O)(=O)NC)c2)ccc1OC 730017316 BDBFKVDIHDTXBO-HNNXBMFYSA-N 435.546 2.257 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC4(CC3)C[C@H]4C(=O)OC)cc2F)CC1 733847710 PUXDKMFBCZWUQE-SFHVURJKSA-N 432.540 2.452 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccc(O)c(OC)c3)CC2)cc1 734212636 AFEHMGVZKFHHIM-UHFFFAOYSA-N 442.560 2.463 10 20 IECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1 742654893 QREPCHKQRMNFPP-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1F 746804118 UQBLTLUBWHKGIQ-UOMAQRANSA-N 438.503 2.311 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3scnc3C3CC3)CC2)cc1 763111310 GWSPTZSIGLMJKI-UHFFFAOYSA-N 443.573 2.296 10 20 IECD COc1ccc([C@@H](CO)N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764369154 NKOYOFGRYFFSJR-HSZRJFAPSA-N 442.560 2.201 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c1 768061920 VMHXKKCKOWCUIV-LBPRGKRZSA-N 425.445 2.333 10 20 IECD COc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nccn1C 769647856 RTIVUJFTJDOFFI-SFHVURJKSA-N 430.486 2.025 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C(=O)Nc1cc(OC)ccc1OC 773612365 RIEPAJWVTMOOHZ-UHFFFAOYSA-N 436.848 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 773741806 YMRHUTXUJGZERS-OAGJVSPASA-N 439.512 2.059 10 20 IECD COc1cccc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)c1OC 775663953 HQPCEDZZNVFBDR-UHFFFAOYSA-N 438.572 2.414 10 20 IECD COC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 778302417 QJPXAOWDFGVELT-CFGKVWFZSA-N 427.501 2.305 10 20 IECD COCC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccco1 781041634 KENBTEJGMSGYIN-XTXLJPNXSA-N 427.501 2.387 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)O2 781999842 LYCASWJPOATSBF-AWEZNQCLSA-N 433.464 2.363 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@@H](N2CCNC2=O)C1 782971764 NKIZYOIROHMFOV-NVXWUHKLSA-N 437.491 2.456 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc2)CC1 786258789 HJRQSPPXTVRARV-UHFFFAOYSA-N 448.483 2.379 10 20 IECD CC1CCN([C@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C(C)C)CC1 787616446 MDCVBVYQBZOHNO-JOCHJYFZSA-N 430.593 2.012 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 789813846 WEWDUHJLRUZZHY-NRFANRHFSA-N 445.466 2.018 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCOC2(CCCC2)C1 789843717 NZJPAZHSRWGVEU-QGZVFWFLSA-N 433.524 2.011 10 20 IECD CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789845102 KDWQCAUHUFZVLI-UXHICEINSA-N 435.540 2.065 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CC[C@H](CS(C)(=O)=O)C3)c2C)cc1 795090847 POZPAXLCYHYTSQ-KRWDZBQOSA-N 432.542 2.430 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)NCc1ccc(C)cc1 798337521 RSOXAMCJXRGHGM-UHFFFAOYSA-N 433.892 2.355 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCSC[C@@H]1c1nccs1)c1ccc(N2CCOCC2)cc1 803298714 DTGZWMAODGIGQN-CRAIPNDOSA-N 446.598 2.474 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 803304956 GFUXJTOTIINDSO-UXHICEINSA-N 438.572 2.337 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3ccc(C(F)F)cc3)CC2)cc1 803746653 JPZBYUFSTLHBIE-UHFFFAOYSA-N 446.498 2.187 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C2CC2)cc1 804004553 NBGMLQLDXLUAFQ-JOCHJYFZSA-N 434.540 2.161 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3cnccc3C)cc2F)CC1 805007092 MUUHHKCXUWMYRG-KRWDZBQOSA-N 427.524 2.165 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](Cn1cccn1)c1ccccc1 806164767 CCUVADARWVVCIX-HSZRJFAPSA-N 447.539 2.236 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 807095530 BSRZCOKNDGEOML-UHFFFAOYSA-N 427.501 2.081 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1 807099594 AIDSYCAWSCPDBJ-MOPGFXCFSA-N 431.558 2.090 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808854904 NKWGPCGKEICYAN-NRFANRHFSA-N 430.618 2.189 10 20 IECD O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(N2CCSCC2)cc1 810161861 VCQFOEKUOWBEKD-UHFFFAOYSA-N 439.990 2.488 10 20 IECD C[C@@H](COC1CCCC1)CS(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 814996333 XCLGYPGIQHTOKG-PKOBYXMFSA-N 437.606 2.403 10 20 IECD Cc1cc(C(=O)COC(=O)COCC(F)(F)F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 915551561 CRBFCIIIPWOFIZ-UHFFFAOYSA-N 448.419 2.046 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCc3nc(O)c4cnn(C)c4n3)cc2F)C[C@@H](C)O1 917715600 ROQJPXWPBJKISV-OKILXGFUSA-N 442.495 2.071 10 20 IECD C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918672752 KSMCRRJPNYJSMY-YJBOKZPZSA-N 442.947 2.476 10 20 IECD COc1ccc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 920890278 SSSOEBIRBHLVQD-INIZCTEOSA-N 427.501 2.148 10 20 IECD O=C(COC(=O)c1c[nH]c(Br)c1)NCc1ccc(N2CCOCC2)c(F)c1 1322186411 KNLTXXQGHDYORY-UHFFFAOYSA-N 440.269 2.226 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cncc(OCC(F)F)c3)CC2)cc1 1344665748 YLERUXFORKTNQK-UHFFFAOYSA-N 435.427 2.240 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ccncn3)cc2)CCC1 1788702891 ZFUMYOVKKCVWNV-UHFFFAOYSA-N 441.538 2.085 10 20 IECD Cc1noc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283974 SIZVSPFVZYBMNG-SEDYWJOHSA-N 427.457 2.373 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1)c1cc(O)nc(O)c1 1817844572 DTUKLQQRUWQSLL-OAHLLOKOSA-N 426.408 2.370 10 20 IECD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1844995755 PSQTWXOHFGYVEN-UHFFFAOYSA-N 433.505 2.068 10 20 IECD Cc1cccc(/C=C/C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n1 1847034285 HGSHHIYRKBTBHG-AMMQDNIMSA-N 435.480 2.437 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1S(=O)(=O)N(C)C 108194759 GAJSFZFAGPZSSB-UHFFFAOYSA-N 449.598 2.429 10 20 IECD Cn1nc(Br)c2c(NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ncnc21 116644833 CLWCUKTUTKPKPS-CYBMUJFWSA-N 444.337 2.440 10 20 IECD CCn1cc([C@@H]2CS(=O)(=O)CCN2C(=O)NCc2c(C)c3ccccc3n2C)cn1 472221272 HHJIDEGIBSXFGF-FQEVSTJZSA-N 429.546 2.384 10 20 IECD Cc1ccc(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(O)c1O 727005497 RERGMIGMKGJENH-UHFFFAOYSA-N 448.497 2.376 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNC(=O)NCc1ccc(Cl)cc1 727548212 SUSCPJJLLKGWLN-UHFFFAOYSA-N 446.935 2.407 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](N3CCCCC3=O)C2)c1 732796819 JBBQNUOJLFOTSV-JOCHJYFZSA-N 429.561 2.404 10 20 IECD CNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 734269309 CZOFWVPWWRNLOT-HNNXBMFYSA-N 428.455 2.210 10 20 IECD CCc1cc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)on1 741273540 UUYFSWLTPWNTHB-UHFFFAOYSA-N 439.495 2.492 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1OC 745978122 MVSWCAUHSFAKQG-UHFFFAOYSA-N 432.451 2.095 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C(C)(C)CO)CC1 747840957 WAWUYULBPYMIGM-INIZCTEOSA-N 435.524 2.178 10 20 IECD CCCN1CCC[C@@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749576512 IYSDNYYHGDJXQG-OAQYLSRUSA-N 426.540 2.433 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(OC[C@H]4CCCO4)CC3)CC2)cc1 751607516 OZIDBGIXAOQYLI-HSZRJFAPSA-N 446.592 2.187 10 20 IECD O=C(CNC1(C2CC2)CC1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 754356906 ANZOKJBYOXXXGZ-YVLHZVERSA-N 445.566 2.265 10 20 IECD COCCOc1ccccc1N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 761185360 NLTGEWAMZLENOE-UHFFFAOYSA-N 426.561 2.216 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1cnn(C)c1 764348762 BUAAZZQDOPKUME-GFCCVEGCSA-N 445.457 2.326 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncc(Br)s1 765228547 SPOXBPANEYZVDL-UHFFFAOYSA-N 430.349 2.070 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-c4ncco4)cc3)cc2)C1 766576794 LABASFZOONLMDK-GOSISDBHSA-N 447.495 2.298 10 20 IECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)ccc21 767382297 CMPUSMKIBJBNIG-UHFFFAOYSA-N 435.528 2.492 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3CCN4C(C)=O)CC2)cc1 769631078 SAIWGARMUKUFRR-KHPPLWFESA-N 448.523 2.448 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)c1 772627757 XKLCGEBLUQAUQO-LBPRGKRZSA-N 427.548 2.418 10 20 IECD CCOCCOC1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 777717527 YPYKLYLSFMMTCU-UHFFFAOYSA-N 431.455 2.489 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C4CCCCC4)CC3)CC2)cc1 778382186 PXDLOKDZCZAQTL-QXMHVHEDSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccccc4OC)CC3)CC2)cc1 779215117 GMLCUQVKZDGCPQ-QFIPXVFZSA-N 440.588 2.009 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cccc(C(F)F)c3)cc2)CC1 780767037 OOCGSFWOXXVIJV-UHFFFAOYSA-N 430.498 2.338 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(OC[C@@H]3CCOC3)CC2)c1 783999257 MSHPPJQWYXWJJD-LJQANCHMSA-N 432.561 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)C[C@H](OC)C4)CC2)cc1F 784743408 FEDSPZHRCANOKX-LJQANCHMSA-N 427.476 2.235 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786120131 IRQCIXYNLLCPAS-UHFFFAOYSA-N 446.529 2.012 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)Cc3ncnn3CC(F)F)cc2F)CC1 787208630 OWKVNBDIWPUFBN-UHFFFAOYSA-N 439.486 2.166 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCN(C2CCC2)C1 789813276 RNRFLPRSJRYOLJ-HKUYNNGSSA-N 446.567 2.048 10 20 IECD O=C(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Nc1ccccc1 789859387 CZVWWBYLPGQIRZ-UHFFFAOYSA-N 426.542 2.001 10 20 IECD C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793729455 ADJJVOXZVHAUGH-IMFGXOCKSA-N 428.577 2.336 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)cc2)C1 793734657 VDFZSFGOZLDJSK-MTQWCTHYSA-N 426.561 2.090 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)Cc3ccccc3)cc2F)C[C@H](C)O1 796270859 WIIKJTVRSINXME-HOIFWPIMSA-N 444.503 2.202 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3[C@H](C)C[C@H]4CCCC[C@H]43)CC2)cc1 803747685 TYXYEINXVCXHFO-WOIUINJBSA-N 428.577 2.113 10 20 IECD C[C@@H]([C@@H](C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)N1CCOCC1 804771786 NZLICGAXOZYQFB-MOPGFXCFSA-N 442.560 2.100 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 805067653 YGJPYSKUMWCERM-OAHLLOKOSA-N 425.576 2.480 10 20 IECD CN(C)Cc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 806042544 WEXDRTAAIGTTNI-HXUWFJFHSA-N 443.519 2.417 10 20 IECD COC[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccco1 806774999 OFBOWCIWEPRFQV-YOEHRIQHSA-N 437.443 2.470 10 20 IECD COc1cc(N2CCN(CN3C(=O)C4(CCC4)[C@H]3[C@@H]3CCCO3)CC2)cc(OC)c1OC 811763992 MPDLRSQTMJVXDR-PGRDOPGGSA-N 445.560 2.352 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc1 917759795 ZSJXXBSMOPYWFG-UHFFFAOYSA-N 432.546 2.160 10 20 IECD Cc1cccc([C@H](CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)NC(N)=O)c1 917834950 VECRAIXTMCDAEX-CTNGQTDRSA-N 437.544 2.113 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918443638 XOAYVXOAOFGDMX-UHFFFAOYSA-N 443.475 2.076 10 20 IECD Cc1cc(N)nc(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1 920425863 XSNNWSZPKYOWFV-UHFFFAOYSA-N 431.543 2.397 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1 920787212 JYFVXZPTRTUMFC-UHFFFAOYSA-N 436.512 2.437 10 20 IECD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)n1cccc1 1791516790 AZVGSENIUOQSQR-DFHZNHDVSA-N 447.919 2.407 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1c(Cl)ccc2c1OCO2 1796601351 WQYOBOGGSBKUQR-CLLJXQQHSA-N 445.859 2.441 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(O)c(O)c(Cl)c1 1796604239 UMCITQLARWJYTI-CLLJXQQHSA-N 433.848 2.123 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1N(C)C 1799994533 XCJNQYGFWAETNV-BJWYYQGGSA-N 440.500 2.133 10 20 IECD CC1(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CCC1 1802427629 XLBSTKFGHWKZFK-CRAIPNDOSA-N 446.598 2.138 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1C 1808726119 YNDYOBZKIDEDOH-KKSFZXQISA-N 435.484 2.168 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(O)c(F)c1 1823311412 ZGXRHHSEGBZJFH-NSHDSACASA-N 444.444 2.334 10 20 IECD CC(C)(F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498362 PYGNFPCNULMGMP-NSHDSACASA-N 427.527 2.010 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1827425135 XYTZRDFMHNHGOZ-QAPCUYQASA-N 431.533 2.277 10 20 IECD O=C(C1CC(O)C1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874528 BKCVVIWKQTXYCG-XIXLEAKQSA-N 444.528 2.207 10 20 IECD O=C(c1ccccn1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898158 CIYCGZPMGZSNEE-QGZVFWFLSA-N 446.598 2.175 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 732053778 FISJZXYWGRSYQJ-HSZRJFAPSA-N 442.604 2.349 10 20 IECD CC1CCN(c2ccc(CNC(=O)CCN3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2)CC1 732093635 KHLVBIAUQSRHES-QHCPKHFHSA-N 442.604 2.252 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 734470830 HMULHNUQXHSXQO-FQEVSTJZSA-N 431.558 2.448 10 20 IECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)cc1 734501570 HASWNDAVLFPPQV-UHFFFAOYSA-N 440.587 2.353 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCN(Cc2ccccc2)C1=O 744877901 KRIBYWFQQQOYAF-NRFANRHFSA-N 440.519 2.387 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3cccc(OCC(N)=O)c3)cc2F)C[C@@H](C)O1 745649856 ZRCNFFNVKWEWIL-HZPDHXFCSA-N 444.507 2.303 10 20 IECD CN(CC1CC1)C[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 746413662 HFCGMWJCVNXRCN-NHCUHLMSSA-N 427.593 2.262 10 20 IECD CN1CCOc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc21 746787881 XPKSOANJGGVBNT-UHFFFAOYSA-N 426.542 2.323 10 20 IECD O=C(CSc1nncn1CC(F)(F)F)NCc1ccc(N2CCOCC2)c(F)c1 748040107 IAWMSHPQOHEIMA-UHFFFAOYSA-N 433.431 2.225 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCNC(=O)Cc1cccc(F)c1 749014295 GRJUUZNGMPJZCQ-UHFFFAOYSA-N 428.508 2.163 10 20 IECD COC(=O)c1ccccc1CS(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227233 FXZBTUMTZTWBGZ-UHFFFAOYSA-N 436.505 2.193 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 751817549 JTQGFERERGVJCC-KRWDZBQOSA-N 438.528 2.349 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c(Cl)cc1F 755959451 SRSZGMTVIQQOLH-UHFFFAOYSA-N 436.870 2.438 10 20 IECD COc1cc(N2CCN(CC(=O)NC(=O)N[C@@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 759872377 IIOFPJXXSVAXHX-FUHWJXTLSA-N 448.564 2.239 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3cc(S(N)(=O)=O)ccc3C)sc2n1 759875826 HAVGHHKFHNYJEP-UHFFFAOYSA-N 448.526 2.247 10 20 IECD O=C(Nc1ccn(Cc2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 768029723 NLVQDNFFXQCVHP-IBGZPJMESA-N 435.484 2.178 10 20 IECD CN1CCC[C@H](N(C)C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 769913766 RMZHUYPJWNMAOP-INIZCTEOSA-N 448.501 2.267 10 20 IECD Cc1cc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1S(N)(=O)=O 775226763 VKQAMJKOZCQKHG-SFHVURJKSA-N 433.530 2.239 10 20 IECD C[C@@H](NCC(=O)NN1C(=O)N[C@@](C)(CCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 775832349 ZHRNYROBFUXULP-OSPHWJPCSA-N 437.544 2.378 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(F)(F)c1ccc([N+](=O)[O-])cc1 778248130 RWJZUWHTTNJLJL-UHFFFAOYSA-N 439.440 2.238 10 20 IECD COc1ccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1[N+](=O)[O-] 786254649 GMCKBDZQIDIQGL-UHFFFAOYSA-N 426.473 2.131 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)cc1 787289406 HEAWHCVYCPNUQP-UHFFFAOYSA-N 438.572 2.298 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1N1CCCCC1 788294163 JFMBPEGMICXPIQ-UHFFFAOYSA-N 436.556 2.446 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cccc2c1OCCCO2 789864114 LZKZKAYDIWMUQY-UHFFFAOYSA-N 441.553 2.334 10 20 IECD CC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCCCC1 793728334 YBJKXPSJPKADID-IBGZPJMESA-N 428.577 2.481 10 20 IECD COCCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 793800350 FTSXYLQUNSWGPQ-SFHVURJKSA-N 441.528 2.042 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C3CC3)ccc21 803687187 WUPJHYPXLPBGTC-SFHVURJKSA-N 430.549 2.105 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc4c(c3)OCCO4)CC2)cc1 804315983 XBNNGCHSFJELBF-UHFFFAOYSA-N 439.512 2.210 10 20 IECD Cc1nc2n(n1)C[C@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CC2 804361963 NKSMBWLMQQGJFA-RHSMWYFYSA-N 444.967 2.224 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OCCN3CCCC3)CC2)cc1F 804851707 LSJADLWWUQWIRK-UHFFFAOYSA-N 448.583 2.392 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1 805755827 KQLFKJVSWFPOPI-GOSISDBHSA-N 438.528 2.002 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1Cc2ccc(Cl)cc2C1 808324542 LKDRUGNVTPLZSZ-FQEVSTJZSA-N 427.932 2.419 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3CCCN(CC(C)C)C3)CC2)cc1 808836425 MATIJKLHWYQTCH-FQEVSTJZSA-N 430.593 2.218 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCOC2(CCCC2)C1 808854167 RPFSNZHRUGSJSD-UHFFFAOYSA-N 440.588 2.006 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3CCCc4ccc(S(N)(=O)=O)cc43)cc2)C1 810210948 IEXXEVBBPQDLSH-XMSQKQJNSA-N 442.585 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@](CO)(C(C)C)C3)CC2)cc1 819036310 DHTNBGQGZRRWHW-OPSAWKISSA-N 429.561 2.157 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 916234788 RWXOUUZJWOPLFE-JOCHJYFZSA-N 437.588 2.391 10 20 IECD COCC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918295702 SSJKVVIAILKEED-IBGZPJMESA-N 441.484 2.123 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(Cn2cncn2)c1 918440424 RFGVFFJNNHEFHI-UHFFFAOYSA-N 436.541 2.135 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2cccnc12 918464124 QZUYUFFAGAKOHJ-SFHVURJKSA-N 445.523 2.500 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](c3ccccc3)n3cccn3)CC2)cc1 920910844 TYUJZRYQRRZDAY-HSZRJFAPSA-N 434.496 2.373 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1NC(C)=O 920926466 PIXJWMAFDROTRH-HNNXBMFYSA-N 440.500 2.306 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccnn3C[C@@H]3CCOC3)CC2)cc(OC)c1OC 1324158589 IXTZTZIRVZEGSD-INIZCTEOSA-N 445.520 2.300 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3ccncc3)cc2)CC1 1324998930 ORDRZSZSSXWUQO-DEOSSOPVSA-N 435.572 2.421 10 20 IECD O=C(Cc1ccccc1O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1783241604 ZWLFFCARRCZKGW-JOCHJYFZSA-N 446.887 2.143 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(F)cn1 1805985135 YGJHHRUXYWMSQK-VBKZILBWSA-N 437.431 2.055 10 20 IECD CC[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876820 ZLOSGAFCWXKMJA-VGSQKHLPSA-N 432.517 2.207 10 20 IECD Cc1ncsc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837494327 GLGPDEUIBUAONK-UHFFFAOYSA-N 446.529 2.184 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)C3(F)CC3)CC2)CC1 1838736616 LJHKATRSMFXKDM-DUXPYHPUSA-N 448.491 2.317 10 20 IECD COc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)ccc2c1 1843249357 BVNLANPVCYIOPW-UHFFFAOYSA-N 434.452 2.180 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2c(Cl)ccc3c2OCO3)C1 1843706210 QDJOZEBJYMJAFW-UHFFFAOYSA-N 431.832 2.006 10 20 IECD Cc1nn(C)c(C)c1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 10197642 NDOGVGBRNFGCLW-UHFFFAOYSA-N 444.513 2.132 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)C1 740919534 ZXSGSLFYWNLBKB-SFTDATJTSA-N 439.604 2.395 10 20 IECD CN(CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncnc2[nH]cnc12 742799582 LTYKHSDGUXBWCI-CYBMUJFWSA-N 431.447 2.176 10 20 IECD NS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 743835001 CUMSTYBMCPIJQJ-AWEZNQCLSA-N 425.457 2.334 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 749730661 AQVNFVMLLYSLFW-UHFFFAOYSA-N 432.527 2.424 10 20 IECD O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)Nc1c(-c2ccccn2)nc2ccccn12 751302927 RIUYULXEFIUUTJ-LJQANCHMSA-N 448.527 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N4CCOC4=O)cc3)CC2)cc1F 754209562 APSCDRNQRWFHDB-UHFFFAOYSA-N 442.447 2.078 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)ccc1C 756335749 JGILSZBYQTYVIU-LJQANCHMSA-N 447.557 2.228 10 20 IECD COCCCn1cnn(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1=S 758953923 IYNFVXCWQKYTEA-UHFFFAOYSA-N 437.566 2.256 10 20 IECD COc1cc(N2CCN(C(=O)C3CCN(C(=O)C(C)C)CC3)CC2)cc(OC)c1OC 759221200 NWDWITLRJNXZLL-UHFFFAOYSA-N 433.549 2.256 10 20 IECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CN(Cc2ccccc2)CCO1 761608014 JREGAIFDEZRBRU-FPOVZHCZSA-N 447.557 2.173 10 20 IECD Cn1cc([C@@H](O)CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 762526514 MBJKSVRTUOBPGJ-GFKDLEGOSA-N 436.584 2.313 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)c(F)c3)CC2)c1 768213847 UXTLJHJTJCCYDM-UHFFFAOYSA-N 441.550 2.246 10 20 IECD O=C(CN1CC[C@]2(C1)OCc1ccccc12)NCc1ccc(N2CCOCC2)c(F)c1 770673140 GJDIAKIFSXREEX-XMMPIXPASA-N 425.504 2.410 10 20 IECD O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 774189624 YVUQJNRVLYTJHN-OALUTQOASA-N 433.534 2.300 10 20 IECD CCCCCCNC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 774519827 LPPBCUHPFNRYLG-UHFFFAOYSA-N 442.539 2.255 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1 775404312 UROFPPFOZDVNEO-UHFFFAOYSA-N 433.408 2.072 10 20 IECD COc1ccc(N2CCC(NC3CN(S(=O)(=O)c4ccc(OC)cc4)C3)CC2)cc1 779170608 CZWVRUYMNJTPLF-UHFFFAOYSA-N 431.558 2.335 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCC(=O)N3Cc3ccc(C)cc3)cc2)CC1 786660094 VEUAZWYVJZJERO-XMMPIXPASA-N 448.567 2.471 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(-n3ccnc3C)nc2)cc1F 787475654 APONVDCIUJOWNG-UHFFFAOYSA-N 438.507 2.494 10 20 IECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789843805 CUIDKRJCIXHEEV-SFHVURJKSA-N 432.634 2.483 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1c(C)nn(C)c1C 789877771 HWDQAZXCIXFLGT-UHFFFAOYSA-N 437.338 2.212 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnnn1C1CC1 791930341 YGWRKNCOXQYTQB-SNVBAGLBSA-N 434.503 2.067 10 20 IECD COc1ccc(CCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 793759119 BHKCZNRACBHNIA-UHFFFAOYSA-N 425.529 2.239 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])c(NCCCN2CCN(c3ccc(OC)cc3)CC2)n1 798216503 DXBZKLCZYYDSDD-UHFFFAOYSA-N 429.477 2.409 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 803309252 SMWHFDANLSJLNZ-QGZVFWFLSA-N 426.517 2.201 10 20 IECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448926 IJDABAUAIJXYSJ-GDBMZVCRSA-N 425.476 2.399 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688806 BMXMZPDMAVFGHG-VQIMIIECSA-N 430.549 2.058 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc(OC)cc3OC)CC2)cc1 804315373 HLLXQICEVOTFRP-UHFFFAOYSA-N 441.528 2.456 10 20 IECD CCc1nc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cs1 805010033 RXTOXXPRIRYKRS-OAHLLOKOSA-N 447.580 2.480 10 20 IECD C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H](C)C1 806877606 AZMYZSBMUNUZHZ-IXDOHACOSA-N 426.508 2.353 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 807289561 ZRFGVRHJAKPSNF-KRWDZBQOSA-N 426.467 2.352 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1Cl 807387219 DQSADEWPPQEKLZ-UHFFFAOYSA-N 440.681 2.423 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccccc3-c3cnn(C)c3)CC2)cc1 808356214 YTDDJHVZCCWJAR-UHFFFAOYSA-N 447.539 2.451 10 20 IECD CC(=O)C(=O)COC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 808544387 ZKLDDEJRYWGNDJ-UHFFFAOYSA-N 440.817 2.364 10 20 IECD COCc1ncsc1-c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809464141 AJHXXQHRLHCFSL-UHFFFAOYSA-N 429.502 2.239 10 20 IECD O=C1CC(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)(c2ccccc2)C1 811271238 JHIAAEPSAPMBLN-UHFFFAOYSA-N 440.471 2.123 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3COc4ccccc4[C@H]3O)cc2F)CC1 812033532 XXHNUWSVMGHMEC-DENIHFKCSA-N 428.508 2.261 10 20 IECD Cc1nn(C)c2cc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc12 812959197 WELBWVAWZMVLPY-UHFFFAOYSA-N 435.528 2.345 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)c1 815471229 ZUBVNOGGZBUAHK-LBPRGKRZSA-N 427.436 2.304 10 20 IECD NC(=O)[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1 841885454 AQVLTZPKPFHKHV-GOSISDBHSA-N 429.388 2.327 10 20 IECD COc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2C)cc1 917833526 ABSUTXRAXVFVFY-GOSISDBHSA-N 448.527 2.216 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 918141065 RWCJQHSKRVWYEP-HUUCEWRRSA-N 444.463 2.394 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(F)c(F)c1F 918441176 XLQWNENRSGQEAC-UHFFFAOYSA-N 425.382 2.459 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COCC(F)(F)F)cc2F)C[C@@H](C)O1 919154507 KPJWRZQUCNDNPO-CHWSQXEVSA-N 436.402 2.178 10 20 IECD COC(=O)c1cc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2o1 920196024 HJWGRVLOKJJVPD-UHFFFAOYSA-N 437.452 2.311 10 20 IECD COC(=O)N1CCN(c2ccc(NCc3ccc(N4CCN(C)CC4)c(F)c3)cn2)CC1 1324492401 VLRDCTJTCTZZKY-UHFFFAOYSA-N 442.539 2.473 10 20 IECD Cc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778222568 VVJRHBVUOUOAFS-IIBYNOLFSA-N 431.514 2.304 10 20 IECD COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1 1817842503 CUASVMPLOCJANR-OAHLLOKOSA-N 438.444 2.239 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nn[nH]c2c1 1821606495 SUOFHMGGKZFVEH-MRXNPFEDSA-N 448.443 2.107 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1cc(O)nc(O)c1 1828153838 YJOLIZJVCQEPRG-JQWIXIFHSA-N 434.543 2.318 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cc(C)nn3-c3nc(C)cc(C)n3)CC2)cc1 105169391 PUANTNMCEYFQRS-UHFFFAOYSA-N 435.532 2.357 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCn3c(nnc3-c3ccccc3)C2)n(C)c2ccccc12 518244038 KKMSSKBVJCRKMQ-UHFFFAOYSA-N 428.496 2.404 10 20 IECD NC(=O)[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(F)cc1 727465162 UWPUHFODUZPQRQ-NRFANRHFSA-N 438.482 2.398 10 20 IECD CCc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1S(N)(=O)=O 731899312 XFIZMFZNLYSVBW-UHFFFAOYSA-N 446.573 2.427 10 20 IECD COc1cc(N(C)CC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc(OC)c1OC 741795977 XSLUVJGOGNVAHP-UHFFFAOYSA-N 427.501 2.357 10 20 IECD CCNC(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 741802225 SUIXPHUNTNGFLL-UHFFFAOYSA-N 426.517 2.411 10 20 IECD CCn1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1=O 743974857 JACGMKQHZVQIMB-CQSZACIVSA-N 434.443 2.193 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccccc3CN3CCOCC3)cc2)C1 746147295 NZVFIFCHZSKXGS-NRFANRHFSA-N 436.556 2.151 10 20 IECD CCC(CC)C(=O)N1CCC(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 758211661 XLCGOIJZIJTKEF-QHCPKHFHSA-N 446.636 2.195 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1F 761056311 ZDQRCXZPTIYYRZ-UHFFFAOYSA-N 440.475 2.186 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@]3(CO)CCc4ccccc43)cc2F)C[C@@H](C)O1 766249167 HOOMNSSATNQHRQ-FUMQJTLXSA-N 441.547 2.479 10 20 IECD CCCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n(C)n1 772209783 RZFYVBIXFQFXBQ-GJZGRUSLSA-N 431.512 2.380 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccccc3)CC2)cc(OC)c1OC 774316662 DADAFPVARLKFPR-INIZCTEOSA-N 427.501 2.238 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)N3CCC(C)CC3)CC2)cc1 778249883 FVRXRXCVNMPOEC-NDDJGDGRSA-N 428.577 2.137 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4cccc(C)c4n3C)CC2)cc1 778348245 ROWRQCAJXJXHRR-QXMHVHEDSA-N 447.539 2.412 10 20 IECD C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnnn1C1CC1 785410858 BMTYMYUKPPOZPT-SNVBAGLBSA-N 435.487 2.494 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 788952010 PPHGONZAYNJCRW-UHFFFAOYSA-N 439.516 2.406 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H]1OC 789847523 SNZKIZCWROBQDN-WOJBJXKFSA-N 435.540 2.113 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cccc1NC(=O)N(C)C 792330086 KESUQTHFLTZIMY-UHFFFAOYSA-N 439.516 2.180 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)c(F)c2)cc1 797431001 FIIUKUOELBECAH-UHFFFAOYSA-N 438.300 2.265 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CCCO)Cc3ccccn3)cc2F)C[C@@H](C)O1 805755238 QUZLVEXKDYOIEL-RTBURBONSA-N 444.551 2.335 10 20 IECD C[C@@H]1CC(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 806948230 YXMAZKFDTAEUAD-KFWWJZLASA-N 425.476 2.445 10 20 IECD CC(C)(C)CN(CCO)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769156 SKUGLMWOXYGMFY-OAHLLOKOSA-N 427.492 2.240 10 20 IECD CCC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 807840662 HRLLDWNEEQDESL-DOTOQJQBSA-N 434.968 2.320 10 20 IECD COCC1(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCOCC1 811434339 PUMYKHSDFSNMTH-UHFFFAOYSA-N 437.448 2.387 10 20 IECD CCCc1nc(C)c(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 817045576 GMPMCFKWVAJHEQ-KHPPLWFESA-N 426.517 2.465 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)o2)c(C)n1-c1ccc2c(c1)OCO2 915036179 AZPKVZQRZHKNMZ-UHFFFAOYSA-N 446.437 2.103 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)cc1 917759412 RETIITSYCZNVQA-UHFFFAOYSA-N 442.515 2.434 10 20 IECD CC(C)NC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918337599 NEIUXOHLZYCVLW-UHFFFAOYSA-N 444.557 2.381 10 20 IECD COC(=O)CNS(=O)(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c1 918581842 OERIPOJPJCOMJF-UHFFFAOYSA-N 442.497 2.193 10 20 IECD CC(C)CS(=O)(=O)CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919333228 BGWOYJLKBQFETE-UHFFFAOYSA-N 443.477 2.015 10 20 IECD Cc1nc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)o1 1798823028 GDCSQMVBFWBLST-SEDYWJOHSA-N 427.457 2.373 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccoc1)C2)c1cc(O)c(O)c(Cl)c1 1799770119 ICKMRFBVTCBFPH-CCWDJLKJSA-N 434.876 2.180 10 20 IECD Cc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1807992733 ACFOWDGLPALROH-HXOBKFHXSA-N 447.495 2.154 10 20 IECD O=C1CC(C(=O)N2CC[C@@H](CNC(=O)C3(F)CC3)[C@H]2c2cccnc2)=NN1c1ccccc1 1812457383 VTLDQDUHGSHNRC-LAUBAEHRSA-N 449.486 2.382 10 20 IECD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@H]2C1 1828809122 DGOUQHYBBIDDDB-GEALJGNFSA-N 442.560 2.066 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831906304 QJBRHFJGRNKQGU-UTKZUKDTSA-N 440.544 2.434 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1S(=O)(=O)N(C)C 10588497 CIIGUBQGYJODGI-UHFFFAOYSA-N 446.573 2.115 10 20 IECD CN1CCC(N2CCC(NC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)CC2)CC1 215988164 AYXGQGOAVUZPIB-UHFFFAOYSA-N 429.609 2.223 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(SC)nc3)cc2F)CC1 730391106 HGIGKNSYTXVZPF-UHFFFAOYSA-N 431.537 2.339 10 20 IECD C[C@H](OC(=O)CCCS(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 731259331 QPSVQVSOVBYIMB-ZDUSSCGKSA-N 443.477 2.157 10 20 IECD C[C@@]1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOC1 733344403 VLPLURMNMQEOKF-QFIPXVFZSA-N 428.512 2.168 10 20 IECD CCN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCS(=O)(=O)C1 745903609 HTNBTRPKBODMHQ-ZBFHGGJFSA-N 431.505 2.475 10 20 IECD COc1ccc(CCN2C[C@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc1OC 753640467 QTRMCXUSSXMFRU-MAUKXSAKSA-N 442.512 2.253 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)NC4(CCCCCCC4)C3=O)CC2)cc1 758196458 CVWRKUBHBAJCFI-HXUWFJFHSA-N 444.576 2.213 10 20 IECD COC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c(C(C)=O)c1 758230102 GKHLHQMFUCCNPO-HXUWFJFHSA-N 442.512 2.246 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1OC 759091480 UCWYWUQCRRNOGJ-UHFFFAOYSA-N 446.478 2.183 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759101750 JOQNIKXZNNFBRG-UHFFFAOYSA-N 437.518 2.017 10 20 IECD COc1cc(N2CCN(C(=O)c3cn(C)nc3C(F)(F)F)CC2)cc(OC)c1OC 759221126 MNBHROQIXJDLGJ-UHFFFAOYSA-N 428.411 2.427 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N(c1ccc(F)cc1)[C@H]1C=CS(=O)(=O)C1 759596088 MCPJIKGOEWBNFY-AUEWMVCUSA-N 447.440 2.137 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cnn(CC2CC2)c1 769024780 QPELGPBPNIKYPG-UHFFFAOYSA-N 436.560 2.080 10 20 IECD COC(=O)C[C@]1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCCOC1 770697715 KJLBCQCBFZRHDV-XMMPIXPASA-N 436.464 2.102 10 20 IECD C[C@@H]1C(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(=O)N1c1ccccc1 772874966 HVQOWJGEHDOSJQ-MRXNPFEDSA-N 440.475 2.136 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@H]2CNC(=O)CCNC(=O)OC(C)(C)C)c(O)c1O 775918805 GLMHTNOPCFJPFG-HNNXBMFYSA-N 435.521 2.432 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(C(=O)NC4CC4)cc3)CC2)cc1 778222682 AWNUDQUHCYKEJU-OUKQBFOZSA-N 448.523 2.431 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778313205 QAUUGSVPCFQLRV-QNJAVHLESA-N 447.601 2.096 10 20 IECD O=C(COC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)c1ccc(O)c(O)c1 782913067 JJTACLOPXWZRQB-UHFFFAOYSA-N 434.401 2.406 10 20 IECD O=C(NCCOc1ccccc1Cl)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786874906 BWEBVGYLNJCEGP-UHFFFAOYSA-N 449.910 2.252 10 20 IECD CCCN(CCc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797594 BFEXTKAJQBNNSN-UHFFFAOYSA-N 428.508 2.155 10 20 IECD Cc1ncsc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822543 XCJWBFGVVSWDRT-OKILXGFUSA-N 434.537 2.479 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnnn3-c3cccc(F)c3)CC2)cc1 789874907 MIMKRYFQFYYJLR-UHFFFAOYSA-N 438.507 2.357 10 20 IECD C[C@@]1(C2CC2)NC(=O)N(c2cccc(NS(=O)(=O)c3cccc4nonc34)c2)C1=O 790084481 YIEUZKKNLWWCGK-IBGZPJMESA-N 427.442 2.249 10 20 IECD COc1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)c(O)c1 794372498 ABAWMZVMFUMFEY-FQEVSTJZSA-N 435.839 2.277 10 20 IECD CN(C)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1 800912306 URQQEYMAMCHRBP-UHFFFAOYSA-N 428.917 2.323 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 806276377 NWAHTJWCAUNSBE-INIZCTEOSA-N 427.592 2.318 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 806887102 XQJOKADVTJFXGE-HNNXBMFYSA-N 442.516 2.497 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 807254306 YUUYWFSNZZZOKQ-UHFFFAOYSA-N 436.556 2.380 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 807291815 IAWAXNYJDODJFL-YKSBVNFPSA-N 448.567 2.085 10 20 IECD CN1CCC(CN(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768765 BFTLLIULLPYNJR-KRWDZBQOSA-N 438.519 2.173 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 808619335 YLMAQMHCJSTQTO-IBGZPJMESA-N 446.910 2.391 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)c3noc(COC(C)C)n3)CC2)cc1 811869578 RSUMSEQGPRFHJE-KRWDZBQOSA-N 446.552 2.186 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCN(C)C(=O)C3)c2C)cc1 912704581 OPSFRZWQWXMHAN-QGZVFWFLSA-N 426.469 2.475 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCCN1C(=O)CCC1=O 913360405 KAWFRKVAKFPYPM-QBFSEMIESA-N 438.552 2.422 10 20 IECD O=C(CN1CCN(Cc2cccs2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917030915 PZELDRABRIRXJX-UHFFFAOYSA-N 432.565 2.158 10 20 IECD Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917930914 ZIHNHENCVRQQJX-INIZCTEOSA-N 432.502 2.083 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3Cc3ccncc3)cc2)C1 1116025962 WQSQJUVGWNHELW-GMAHTHKFSA-N 435.572 2.454 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cnc(Cl)cc3Cl)c2)CC1 1116489990 YELKERCGUYLJRK-UHFFFAOYSA-N 436.342 2.424 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ccccc12 1797362992 ZJWZYAYHEGVNDV-FJXIAYRNSA-N 448.479 2.416 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc2ccsc2[nH]1 1804336430 XQCARZKTXHFOLY-CLLJXQQHSA-N 448.595 2.342 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1CCCC1 1806188605 FKYRPSDKCGXAHR-LPHOPBHVSA-N 446.598 2.138 10 20 IECD O=C(c1ccn2ccnc2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547107 OXOOXHZLBAEURW-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CN(C)c1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)o1 1827426799 HVEWLJPABWETOV-INIZCTEOSA-N 443.504 2.094 10 20 IECD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428235 SMLUGGWPRHHIRE-INIZCTEOSA-N 443.460 2.276 10 20 IECD O=C(c1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877171 XFFCNLOGZFVWLA-FZMUQLTDSA-N 440.500 2.473 10 20 IECD C[C@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccccn1 1843442238 IHENTOFNNNXEIS-KRWDZBQOSA-N 431.496 2.181 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1 1847607471 RIMAPZAIKOGCAO-USJZOSNVSA-N 429.423 2.390 10 20 IECD CCOc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1S(=O)(=O)N(C)C 19095879 CEJXDPFARSVFHL-UHFFFAOYSA-N 442.544 2.141 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 726976747 OIXINUPGKNQZRN-UHFFFAOYSA-N 438.571 2.025 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)n2)c[nH]1 727247620 GHSGPWGLQUSVSQ-UHFFFAOYSA-N 434.499 2.427 10 20 IECD CCCN(CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)Cc1ccccc1O 727831127 JHOLRYPSZNGCFY-UHFFFAOYSA-N 431.558 2.137 10 20 IECD COC(=O)CSCCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729856191 NFSZQOJALLIBPP-UHFFFAOYSA-N 435.468 2.247 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCCOc1ccc2c(c1)OCO2 732203609 YLJJAKPVQDOAOB-LJQANCHMSA-N 428.485 2.297 10 20 IECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCc1ccc(N2CCC(CO)CC2)cc1 736195492 HNRAPSBNPIKWHK-ONTIZHBOSA-N 446.617 2.237 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-n4nc(C)cc4C)nc3)CC2)cc1 742920420 OYCDQAFSCVPHEY-UHFFFAOYSA-N 434.544 2.445 10 20 IECD C[C@@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2N(C)C1=O 745985620 PFOAMAFXFLCPAD-QGZVFWFLSA-N 440.519 2.398 10 20 IECD CN(C)C(=O)Cn1cc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 747553252 OCIHCKLQSGWOME-UHFFFAOYSA-N 436.463 2.363 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCC1CCOCC1 749702642 OJZWLBUKEIMHKZ-UHFFFAOYSA-N 428.512 2.168 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 750538424 ISWQUPTYMMVJRF-CQSZACIVSA-N 444.918 2.018 10 20 IECD Cc1nnc2n1C[C@H](C(=O)OCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 750671323 BAWLNEGLYYEXLJ-CQSZACIVSA-N 444.447 2.106 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccccc3S(C)(=O)=O)CC2)cc1F 753856635 DHQPLRNAZWQYCJ-OAHLLOKOSA-N 435.521 2.387 10 20 IECD COc1ccc2c(c1)N(CN1CCN(c3cc(OC)c(OC)c(OC)c3)CC1)C(=O)C2=O 758963745 GYCLRMYPKKSWNP-UHFFFAOYSA-N 441.484 2.030 10 20 IECD COCc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759099605 KSCSPSYZVCYYNJ-UHFFFAOYSA-N 436.530 2.370 10 20 IECD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 767770969 CMVPLGWWOWDQOI-JTQLQIEISA-N 433.258 2.204 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC([C@@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904711 GEPALKLRDJJNLH-TZIWHRDSSA-N 445.526 2.203 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccnn1-c1ccccc1 768033835 GODWKYYDUZQOHA-UHFFFAOYSA-N 437.475 2.227 10 20 IECD O=c1cc(CN2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)nc2sccn12 768215755 YCNOQSDQZKTUHL-UHFFFAOYSA-N 435.893 2.341 10 20 IECD O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775031455 AFONPBUFVHPWCW-VXKWHMMOSA-N 437.540 2.291 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1 784029866 KJUYSWSWRHKJME-UHFFFAOYSA-N 433.530 2.456 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cc1 785295097 RDJPNXLQXAOAOY-MRXNPFEDSA-N 440.544 2.314 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 789813274 RLBTUJWLPFWHQV-UGKGYDQZSA-N 441.503 2.173 10 20 IECD CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@H]1C 789950316 OCQVEXVXKSFTKO-KDOFPFPSSA-N 443.466 2.042 10 20 IECD COC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H]1CCCO1 790281215 PAFFHFMTBIAHBN-ZBFHGGJFSA-N 426.516 2.178 10 20 IECD COCCOc1ccccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 793804007 UQVHYHBVOXZYAF-UHFFFAOYSA-N 441.528 2.122 10 20 IECD C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451445 LDJBJYWPMOMFRP-BEFAXECRSA-N 438.519 2.172 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@@H](N3CCOCC3)C(F)(F)F)CC2)cc1 805847556 CEAKPEBULRJEIZ-GOSISDBHSA-N 430.471 2.226 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292800 ZDHLXBBNNCYWEL-IEBWSBKVSA-N 428.533 2.052 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCO1 807768793 BPQDAOMUPPKSGL-FHLIZLRMSA-N 425.476 2.447 10 20 IECD CC[C@]1(C)CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768800 BQEJOMHJFUFXGE-QVKFZJNVSA-N 425.476 2.401 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCC(n2ccnc2)CC1 807769826 IPIMGJBSKLJFDL-MRXNPFEDSA-N 447.486 2.433 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H](C)O)cc1 813685085 BTGXKVWEBXKDRD-ZBEGNZNMSA-N 447.340 2.352 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Nc2ncccn2)c1 916677266 UYLMTKIFCAFSCP-UHFFFAOYSA-N 437.525 2.385 10 20 IECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 920495833 GCVQZYYWFGFSAE-YADARESESA-N 437.496 2.367 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(OC)c1 1796601470 LYXRBWRHBDFRLG-QDMKHBRRSA-N 427.457 2.076 10 20 IECD Cc1cc(C)nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c1 1799768192 MMBZVXAQVKJXLJ-CCWDJLKJSA-N 445.903 2.280 10 20 IECD CC(C)CCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189986 NILLTWMZNBYNLA-UZLBHIALSA-N 448.614 2.384 10 20 IECD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820992279 BGSVIHQMVOVTJC-MRXNPFEDSA-N 439.476 2.104 10 20 IECD Cc1c[nH]cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902537 QAAFRBDOIDDBAT-QGZVFWFLSA-N 448.614 2.417 10 20 IECD CC(C)/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435692 YHRUJZISTFNDJZ-SHTLVRLNSA-N 438.908 2.033 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726728607 WKPZXRAIJUEUKY-UHFFFAOYSA-N 425.485 2.134 10 20 IECD CC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 734809370 XRDFJKDVHQLCKP-UHFFFAOYSA-N 448.516 2.297 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)c3ccccc3)cc2F)C[C@@H](C)O1 740946640 YXZHACHICMFRQB-ZMPRRUGASA-N 430.476 2.332 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(S(=O)(=O)Cc2ccon2)CC1 742806094 WKEDBLGWZORJCX-UHFFFAOYSA-N 434.543 2.431 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccccc3S(C)(=O)=O)CC2)cc1 743286631 ONVHACVXGKROHO-UHFFFAOYSA-N 432.546 2.042 10 20 IECD Cc1ccc(N2CC[C@H](NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1 745692247 SVYSFTNAPKVLLW-KNQAVFIVSA-N 449.555 2.301 10 20 IECD COC(=O)c1c(F)ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1F 749167045 MCWDPQOZADRTRO-UHFFFAOYSA-N 426.441 2.271 10 20 IECD COc1cc(N2CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)CC2)cc(OC)c1OC 759399286 JCXPIKACMFZEPK-UHFFFAOYSA-N 435.521 2.228 10 20 IECD Cc1cc(C(=O)CN(C)[C@H](C)C(=O)OC(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759791332 DIWDTJYELPBMKH-MRXNPFEDSA-N 435.546 2.196 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN=c3c(Br)c[nH]cc3[N+](=O)[O-])cc2)C1 766401289 IKZGRGRYLRNLAD-ZDUSSCGKSA-N 434.294 2.488 10 20 IECD COc1ccc(S(=O)(=O)N2CCCN(Cc3cc(OC)c(OC)cc3O)CC2)cc1 768461407 CHPJOJPSMBERPA-UHFFFAOYSA-N 436.530 2.315 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1Br 768917174 CFKLASCMPBHVBA-UHFFFAOYSA-N 429.292 2.041 10 20 IECD COCCO[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 781699768 ISHXONDFQJDAAR-AWEZNQCLSA-N 426.516 2.132 10 20 IECD CC[C@@]1(CO)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 784721732 NPVCYGSLNXHSBQ-FQEVSTJZSA-N 449.485 2.478 10 20 IECD O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NCc1ccc(N2CC=CC2)cc1 786377519 LGWXXEMDRLWCBE-UHFFFAOYSA-N 432.524 2.231 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1O 787306123 SKRSTVLQADKERF-HUUCEWRRSA-N 445.491 2.086 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)ccc21 788426487 SWMCREMUGBQUGN-UHFFFAOYSA-N 430.549 2.201 10 20 IECD CSc1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccn1 789828948 ZMEPMMHBLRQCFW-HUUCEWRRSA-N 446.548 2.489 10 20 IECD Cc1ccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789837236 XFKZWAGAAKGNJZ-QGZVFWFLSA-N 443.519 2.295 10 20 IECD CCc1nc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 789840455 IPFCYSCYILXAHM-ZDUSSCGKSA-N 434.537 2.299 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@H]3CCC[C@H](C)C3)CC2)cc(OC)c1OC 793936996 AJAQJDDBHIEHIU-IRXDYDNUSA-N 433.549 2.304 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc(N2CCOCC2)cc1 803308156 BEPFPAHOPRXKKR-AUMHUTNHSA-N 443.569 2.096 10 20 IECD CO[C@H]1CCC[C@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451780 WATGBKZCZXRZKB-KSSFIOAISA-N 425.476 2.304 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(C(=O)NCc2ccccc2)CC1 806282821 VINODXILSNCJNO-UHFFFAOYSA-N 446.598 2.297 10 20 IECD COc1ccc2c(c1)nc(CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)n2C 806667479 ZHVRPYHCLWDCRG-UHFFFAOYSA-N 435.528 2.455 10 20 IECD C[C@H](COC1CCCC1)CS(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 814996330 XCLGYPGIQHTOKG-MJGOQNOKSA-N 437.606 2.403 10 20 IECD Cc1cc(C)n2nc(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)nc2n1 917151501 PZFISIGFHLWVRV-UHFFFAOYSA-N 430.509 2.125 10 20 IECD C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919379599 HVMPBGGNZXBMNZ-GFCCVEGCSA-N 448.391 2.137 10 20 IECD CC1(C)CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)C1 1792218132 RDFDTIVALLICQC-USDOSNGCSA-N 444.528 2.233 10 20 IECD Cc1occc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792218555 LKAGNPJBKJYSMH-CASRODDKSA-N 442.468 2.012 10 20 IECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cc(O)n1 1796934559 MSZSJUCNVBNKPA-GGPHIMKMSA-N 447.495 2.140 10 20 IECD CNCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799619968 BSIQRCSFLPHRIE-RUMRUAAYSA-N 438.572 2.297 10 20 IECD COC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)CCC1 1803423677 LOXSMFVHNQGGIU-BJKLQHCMSA-N 430.501 2.414 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1 1804331265 AIDHHDGYFXZGDV-BJWYYQGGSA-N 431.583 2.036 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cnccc1F 1807824740 IGOZNIVKMXOGFD-VLIAUNLRSA-N 437.431 2.055 10 20 IECD COc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1808298126 VCUCEOUVDCCMNY-UHFFFAOYSA-N 426.473 2.055 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1cc(O)nc(O)c1 1817844831 MMYBYSNJGVECMJ-AWEZNQCLSA-N 448.443 2.107 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)C2(F)CCC2)CC1 1832507197 MBRPCLWKYMXKOZ-HNNXBMFYSA-N 441.594 2.359 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccc3c2OCC3)C1 1843631286 XWTPVIASCZNUDJ-UHFFFAOYSA-N 444.491 2.231 10 20 IECD COc1ccccc1CC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039505 XCJIDJGYTRBRRK-CSKARUKUSA-N 438.480 2.271 10 20 IECD CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 725904226 RDZBWBQCBKUEMQ-CQSZACIVSA-N 427.523 2.235 10 20 IECD COCCCNC(=O)C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 726713232 LHWTYQWVVPYHFN-UHFFFAOYSA-N 432.565 2.238 10 20 IECD COC(=O)[C@H](C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 726843439 DYTLRPQVROOCMF-ZACQAIPSSA-N 435.540 2.329 10 20 IECD C[C@@H](CN1CCN(C)CC1)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 730127360 QBQVWSIYJQVOGA-INIZCTEOSA-N 425.524 2.192 10 20 IECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cccc1S(=O)(=O)NC1CC1 741095285 JTRNKMYJZMYJBG-UHFFFAOYSA-N 444.557 2.099 10 20 IECD Cc1ccc([C@@H](C)[C@H](O)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 745759507 TZBLYQIFHQANBM-HXOBKFHXSA-N 444.503 2.295 10 20 IECD CCC[C@H](C)NC(=O)[C@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 747835686 RSDCTCGTNHKRJC-PMACEKPBSA-N 430.593 2.361 10 20 IECD O=C(CN1CCC(N2CCCNC2=O)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749546937 UOWAINFASYPRQX-UHFFFAOYSA-N 446.507 2.280 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(F)c(OC)cc3OC)CC2)cc1F 756196278 NVSCZVMYLFSCAE-UHFFFAOYSA-N 435.427 2.278 10 20 IECD COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc(C(=O)OC)c1 759595034 PHPAAICHIOVYLB-SMYYYNMVSA-N 443.408 2.255 10 20 IECD COCCn1c(C)c(C)c2cc(-c3nc(CCN(C)S(=O)(=O)N(C)C)no3)ccc21 763351173 GKGLONYIUHKEQA-UHFFFAOYSA-N 435.550 2.235 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 764356128 CUCSPXOVVVSGND-QGZVFWFLSA-N 446.573 2.382 10 20 IECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 770255743 FOZDMYXQJLDNDD-UHFFFAOYSA-N 437.544 2.422 10 20 IECD C[C@H](NCC(=O)NCCOc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 775254672 MFVGNLCASKWGOB-KRWDZBQOSA-N 427.501 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)cc1 778256277 JNVJEUWOPVNXLG-VOTSOKGWSA-N 446.511 2.179 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccccc1CN1CCOCC1 785440593 ASGFWOCFMUWNNH-UHFFFAOYSA-N 436.556 2.052 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 785563106 YYCXHULOOSUOIQ-CVDCTZTESA-N 438.572 2.428 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\C(=O)Nc3ccc4n[nH]cc4c3)cc2)CC1 787321786 JSJAJNIZAKFUTF-HJWRWDBZSA-N 446.511 2.043 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccccc2)N2CCOCC2)cc1 787976129 DHDRHHHJGHZEOP-HSZRJFAPSA-N 438.572 2.339 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 789812617 NPYVFESKRJCKCW-YADHBBJMSA-N 441.503 2.315 10 20 IECD Cc1cc(F)ccc1CCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844372 GALGOVDMJJTEQC-UHFFFAOYSA-N 431.483 2.209 10 20 IECD COC(=O)[C@@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCC1 792344207 IKUGRKXKCIMVMQ-IXDOHACOSA-N 435.540 2.472 10 20 IECD COc1c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc(Cl)cc1C(=O)N(C)C 792947374 DGFHOSWTHADXMU-UHFFFAOYSA-N 432.908 2.371 10 20 IECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 799836253 DGWZIKIBZJPYLX-UHFFFAOYSA-N 449.529 2.043 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1)c1ccc(N2CCOCC2)cc1 803310147 HIBCNNUHJWXURE-GOSISDBHSA-N 445.523 2.474 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1F 803663651 VWWOMXXLDMADLI-UHFFFAOYSA-N 444.463 2.486 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)n1 803685205 CMLPGPOLUHHBLA-HXUWFJFHSA-N 449.555 2.266 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804316657 HLJQFSJYURTXRT-QGZVFWFLSA-N 445.560 2.218 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCN1CCCCC1=O 804778781 FGMSVUCFLCHUFJ-UHFFFAOYSA-N 440.338 2.022 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc1F 806634052 HSMSFXKDVVAWKM-UHFFFAOYSA-N 434.537 2.410 10 20 IECD O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809494017 XZIWXQPZGWIFDK-KGVIQGDOSA-N 434.558 2.071 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCNS(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 917709424 ICECWLPKCPNHEV-CALCHBBNSA-N 449.548 2.424 10 20 IECD O=C(O)c1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917918319 NXXXKLDUIILGRF-UHFFFAOYSA-N 428.869 2.492 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc4c(c3)OCO4)cc2F)C[C@H](C)O1 918140382 MJLXHGHUYVOMMR-GJZGRUSLSA-N 443.475 2.214 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(c4ncccn4)CC3)cc2F)C[C@@H](C)O1 918221695 RGBSXDVEBBPCBV-CALCHBBNSA-N 428.512 2.261 10 20 IECD Cc1cccc(-n2nnc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2C)c1 918338114 TUEIYNMQUAEFGP-UHFFFAOYSA-N 439.541 2.049 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2cc(F)c(F)cc21 918441350 YUHDSYBUNGYNEH-UHFFFAOYSA-N 433.430 2.271 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CSCCS3)cc2F)C[C@@H](C)O1 918985630 DKWUYPXWNQNLNO-QWQRMKEZSA-N 442.578 2.447 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)c1 920348547 AMYCWLYWBNJVNA-NSHDSACASA-N 449.312 2.240 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 1319368310 IXQJNGBOHNTQDV-OKILXGFUSA-N 448.447 2.292 10 20 IECD Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)[nH]1 1781119212 CPLYVCIHCHWKCL-DYESRHJHSA-N 448.907 2.224 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc2nccn2c1 1804285882 KIZYMLOUNJWEOQ-KJZRSFJVSA-N 448.479 2.416 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ncc(Cl)cn3)C2)CC1 1807896306 VKCADEHPKUMTNP-UHFFFAOYSA-N 431.880 2.095 10 20 IECD Cn1nccc1C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1808421352 UENNXQXPARNXNG-UHFFFAOYSA-N 448.527 2.058 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ncccc1F 1811120819 CRYPHZJMYCHMLI-VLIAUNLRSA-N 437.431 2.055 10 20 IECD CCc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816722056 BYQHEFYNXUJTHI-ZDUSSCGKSA-N 439.497 2.446 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844073 ONMAUTNIYNNXBE-XJKSGUPXSA-N 439.476 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncon1)CC2)c1cc(O)c(O)c(Cl)c1 1823712716 VHAULTOAOBGCDA-QMMMGPOBSA-N 435.849 2.130 10 20 IECD CC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199180 OWKNGDYQVRMQAH-QGQQYVBWSA-N 445.497 2.255 10 20 IECD O=C1Cc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)ccc2N1 1844005968 NYIFKKWJORKKEX-UHFFFAOYSA-N 441.871 2.377 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CN(Cc4ccccc4)CCO3)cc2F)CC1 303811603 CTBNXURVDAYSEN-XMMPIXPASA-N 440.563 2.485 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)n(C)c2ccccc12 553402436 BDWSOTUPVIEHSI-UHFFFAOYSA-N 448.567 2.376 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CCC(N)=O)C3)cc2F)C[C@@H](C)O1 727157461 IUMIKFCUBAADTB-KURKYZTESA-N 434.556 2.033 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc(Br)ccc2F)SC1=S 727178612 YGIRWJSYAQAUFS-XFFZJAGNSA-N 439.353 2.339 10 20 IECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 728207142 GMDWRKKSISYDSL-AWEZNQCLSA-N 439.491 2.098 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)N[C@@H](C)c3cc(OC)ccc3O)C2=O)cc1 728980887 PJXOXUDRMYVEFN-XMHCIUCPSA-N 427.457 2.054 10 20 IECD O=C(COC(=O)C1(C(=O)NC2CC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729715862 HUWUFIXFYFKORM-UHFFFAOYSA-N 432.432 2.003 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)cc2)CC1 731131552 KWEXHXJJPSLQGQ-UHFFFAOYSA-N 434.496 2.404 10 20 IECD C[C@@H](NC(=O)N(C)[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732885118 PMPMEGKBPDEFFU-PBHICJAKSA-N 428.455 2.389 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1N1C(=O)CCC1=O 733048887 QSUVIGDKWXHFPZ-UHFFFAOYSA-N 434.496 2.286 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)c1 734018896 MIMHIEGTWAUYQQ-MRXNPFEDSA-N 442.534 2.256 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@H]2c2cccs2)c1 743384673 UBJDDJFLZZPLET-HXUWFJFHSA-N 429.542 2.162 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 743619297 OTPYDSLTABZJHG-UHFFFAOYSA-N 447.557 2.195 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(S(N)(=O)=O)cc1 743809384 RQMKVDGKJLKQLL-UHFFFAOYSA-N 427.320 2.393 10 20 IECD C[C@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 747615885 BFCCEIWYUNLQME-UONOGXRCSA-N 449.485 2.334 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)c1 751415617 VAORDNIWMNGBRR-UHFFFAOYSA-N 428.264 2.224 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O 752388835 GWBJKDGVDGGMQE-UHFFFAOYSA-N 441.303 2.155 10 20 IECD CC(C)[C@H](NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nc(-c2nc[nH]n2)no1 752659226 GFIXMRIRUJYMEY-PBHICJAKSA-N 440.508 2.449 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3nnc4ccccn34)cc2F)C[C@@H](C)O1 754583352 LCVJKEHDZAFVGC-IXDOHACOSA-N 440.523 2.449 10 20 IECD CC(C)C[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCCC1=O 755210931 LPRDJCRXABXMKN-FPOVZHCZSA-N 428.577 2.432 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 756171205 LOQCHWXZOFEDRM-CQSZACIVSA-N 431.464 2.495 10 20 IECD CC[C@@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 765240473 SOFMFMRJAPXLLD-OAQYLSRUSA-N 431.606 2.340 10 20 IECD CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 765255069 OUSPXALQGBOXOK-VQIMIIECSA-N 430.574 2.147 10 20 IECD C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 766966680 OENQYSSNIDZOKV-NSHDSACASA-N 448.391 2.288 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c1 769530755 PRHRSALEWFJMSO-FQEVSTJZSA-N 446.525 2.463 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCC(=O)N1CC(=O)Nc2ccccc21 771209832 VEMHMMQNEXLKIY-UHFFFAOYSA-N 436.512 2.247 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@H]3c3ccc(C)o3)CC2)cc1 778283297 FDUXQOJFROOMFF-YUQDSPFASA-N 439.512 2.402 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 782842585 VDOXSAPFNSGROX-LBPRGKRZSA-N 432.424 2.456 10 20 IECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1Cl 784048057 NJFQJNCWBPXYTC-UHFFFAOYSA-N 434.253 2.352 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(F)cc1 787638512 NKRKTXKGAXWWFN-LEWJYISDSA-N 443.519 2.458 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C2CC2)cc1 788787131 ZAEZZDSHWUBPFY-INIZCTEOSA-N 426.483 2.244 10 20 IECD Cc1ccccc1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832721 CVDOUADZMYVZKE-KRWDZBQOSA-N 427.520 2.459 10 20 IECD COc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840878 PLAUWLVYOQEKEI-UHFFFAOYSA-N 429.492 2.036 10 20 IECD Cc1ccn(C[C@@](C)(O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)c1 790801737 RRFNDMJQEGYHPR-OPAMFIHVSA-N 435.471 2.294 10 20 IECD CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734023 OWMHJAHISBQEGF-JBACZVJFSA-N 428.577 2.336 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 804958239 PJCXXFRLYIXZFE-VXGBXAGGSA-N 442.538 2.333 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCc2ncsc2C1 807768427 JJRIFBFYGNWIOR-CYBMUJFWSA-N 436.484 2.414 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCCCN4C(C)=O)n3)CC2)cc1 809465587 XTOHYJKVRALIPP-LJQANCHMSA-N 427.505 2.043 10 20 IECD Cc1nc2c(cnn2C(C)C)cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676826 VCPCSFPUHIFBAM-UHFFFAOYSA-N 441.557 2.485 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](c4nnc5n4CCCCC5)C3)nc12 917090766 NTWGBDNDIIZQLL-OAHLLOKOSA-N 439.520 2.309 10 20 IECD COc1cccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1OC 918014147 LHYOAVBSWQUZKQ-IBGZPJMESA-N 440.544 2.447 10 20 IECD CNC(=O)c1ccc(CN(C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918219465 LLJSQNIFZBNKDY-UHFFFAOYSA-N 428.508 2.488 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccnc1N1CCOCC1 919777299 IKIJDMAGUUCCPM-UHFFFAOYSA-N 429.496 2.340 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N3Cc4ccccc4C[C@H]3C(=O)OC)CC2)cc1 1320024681 WVHUNLKDNMHTFY-QHCPKHFHSA-N 437.540 2.334 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320089323 VGIVWZJGNXGGNJ-NOZRDPDXSA-N 435.572 2.291 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C)C(=O)NCC(F)(F)F)cc2F)C[C@@H](C)O1 1337686458 UTXRQRSUMUPRDK-JHJVBQTASA-N 434.434 2.306 10 20 IECD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)no1 1790245036 NEGHUAACNBJYSS-MIUNTBIASA-N 449.891 2.209 10 20 IECD O=C(Cn1cnc2ccccc21)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550534 NAIXJLCLEUNBBA-UHFFFAOYSA-N 449.511 2.388 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cocn1)CC2 1828199463 UGXPNDCHVQJVFV-GSQGTZRGSA-N 442.453 2.187 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CC=CCC3)CC2)CC1 1838030282 JNLQMRIQCZNKJW-INIZCTEOSA-N 429.517 2.461 10 20 IECD CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 730074352 BIYMXMRLLLHYRC-IEBWSBKVSA-N 446.617 2.342 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@H]3CN3CCCC3=O)cc2)C1 732447770 CFXSUEHXVOCNTD-CTNGQTDRSA-N 441.576 2.075 10 20 IECD COC(=O)[C@@H]1CC12CCN(CC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 733795631 FAYCZVGXCDNIHE-SCTDSRPQSA-N 447.551 2.331 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 737819811 XZCWPHZIONOQID-UHFFFAOYSA-N 434.518 2.330 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(F)cc(N4CCOCC4)c3)ccc21 748470949 OLEUKRLAGWVTMM-UHFFFAOYSA-N 426.492 2.300 10 20 IECD CCC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 751212189 AAUIFFMIGNPRLJ-UHFFFAOYSA-N 437.543 2.071 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc([N+](=O)[O-])c(C)cc3C)cc2)CC1 755136185 PDJPRTCIYWUOME-UHFFFAOYSA-N 446.529 2.359 10 20 IECD CNc1nc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cs1 762214619 KZLTWCPDKMMRSF-UHFFFAOYSA-N 427.509 2.371 10 20 IECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nn1 773244182 IDYMQSOBYAGBNI-UHFFFAOYSA-N 433.516 2.475 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc4c3OCCC4=O)CC2)cc1F 780059333 KVXDGKPSDXHLMK-UHFFFAOYSA-N 427.432 2.087 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1 780688819 JKXZDHFNGIUBEE-UHFFFAOYSA-N 437.587 2.404 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 781481184 BSUVSGJGMHBYJW-UHFFFAOYSA-N 441.484 2.214 10 20 IECD CCO[C@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 788783804 VMMJVHUIXYIWQU-NZQKXSOJSA-N 436.572 2.333 10 20 IECD Cc1csc([C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)n1 789814276 ZVNVAEUIWNOPDZ-GOSISDBHSA-N 432.521 2.311 10 20 IECD COc1cccc2c1CC[C@H]2NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840420 HMMZEYRKHYJFPP-HXUWFJFHSA-N 441.503 2.215 10 20 IECD CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793716313 BZDQWBSMHQBINS-NLWGTHIKSA-N 446.617 2.185 10 20 IECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)Cc1ccccc1 793841942 ZENFQHGGOHYSRB-NRFANRHFSA-N 425.529 2.148 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298154 QDWNTHQZNRRXNS-WMZHIEFXSA-N 437.540 2.171 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)CN1CCOCC1 803676581 AIYHNEWTENYZPK-IBGZPJMESA-N 430.593 2.156 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCC(C)(C)c3cccs3)CC2)cc1 803747202 OBGCREIPRPOIJG-UHFFFAOYSA-N 444.601 2.089 10 20 IECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 804082891 FUJBQTJJNSMLFY-HXUWFJFHSA-N 434.540 2.330 10 20 IECD C[C@H]1CSC[C@@H]1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977645 VMMSRKIYIVENBZ-YJBOKZPZSA-N 430.553 2.493 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)[C@H]1CN(Cc2ccccc2)CCO1 806282260 JGPLRDBMAQEMTO-SJLPKXTDSA-N 448.614 2.147 10 20 IECD CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 806501959 NEILDFCFEICHPX-LZLYRXPVSA-N 438.519 2.362 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 807098700 XYKDAFXJJGPXGZ-VXKWHMMOSA-N 425.529 2.028 10 20 IECD O=C(NC[C@H](N1CCOCC1)C(F)(F)F)N(Cc1ccccc1O)C[C@@H]1CCCO1 807540670 BIYYOTPNSUOAHR-WMZOPIPTSA-N 431.455 2.346 10 20 IECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915663775 RAFRCGQSODBULB-UHFFFAOYSA-N 443.456 2.290 10 20 IECD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971249 NOLYZRMXRIUSIX-UHFFFAOYSA-N 427.436 2.361 10 20 IECD Cc1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1NS(C)(=O)=O 928993639 OLIQSCSHHRTCOZ-UHFFFAOYSA-N 433.530 2.248 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc(O)ccc2n1)c1cc(O)nc(O)c1 1797380233 XTILSWRTRFOSIR-MUJYYYPQSA-N 434.452 2.312 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(O)CC1 1802572152 OXAKIHNLQATKBY-SGYUAVSYSA-N 430.501 2.006 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1804282847 FCYATYCRCJPNJU-YKMDKHMNSA-N 439.468 2.172 10 20 IECD Cc1ncsc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991039 MXDQBOLSGVIPSX-KDOFPFPSSA-N 439.497 2.286 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@@]1(F)Cl 1813154151 XQINSIYZBHYSRH-IFOLCDHMSA-N 434.855 2.132 10 20 IECD Cn1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1Cl 1817845994 FXEKURDOVHLILN-CYBMUJFWSA-N 445.867 2.223 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1cc(O)nc(O)c1 1817847237 PPPKVKFTNRHFTI-INIZCTEOSA-N 437.456 2.470 10 20 IECD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1834116030 HEJOITZIJQTLCF-UHFFFAOYSA-N 444.557 2.362 10 20 IECD O=C(c1ccc2c(c1)OCO2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441613 LPCRBPVMUPKITC-UHFFFAOYSA-N 446.463 2.025 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CN3C(=O)c4ccc(C)cc4C3=O)cc2F)CC1 303295151 LSAWBTVYVFBYAZ-UHFFFAOYSA-N 438.503 2.188 10 20 IECD COC(=O)CN(CC(=O)Nc1cccc(C(=O)N(C)C)c1)Cc1cc(Cl)ccc1O 731847780 YZRGKAJYWNLTBU-UHFFFAOYSA-N 433.892 2.361 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3c[nH]c4ncccc34)CC2)cc1 734151389 PEGIXKBSNMRFLL-UHFFFAOYSA-N 429.546 2.062 10 20 IECD CCCNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738903137 KAFLPCIQDURAKB-UHFFFAOYSA-N 444.557 2.383 10 20 IECD COC(=O)c1ccc(CCNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743359784 XDCYDNZLGLSDMV-UHFFFAOYSA-N 440.544 2.146 10 20 IECD CCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 747980052 PQCMDLVZNSPXCT-WOJBJXKFSA-N 443.592 2.226 10 20 IECD O=C(Cn1c(-c2cccnc2)noc1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749358482 RGHZHKOXWBBHBP-UHFFFAOYSA-N 426.388 2.312 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1OC 751236366 IJSOIAQYYMOMKT-UHFFFAOYSA-N 448.541 2.169 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)CC2)cc1F 753738679 RFJXTIVFEXIMAE-UHFFFAOYSA-N 437.493 2.174 10 20 IECD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761983451 RUZXYELWDMZELC-DOTOQJQBSA-N 431.986 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@]4(CCCC(C)(C)C4)C3=O)CC2)cc1F 768569497 AJVYUFIUAUAXKE-HSZRJFAPSA-N 446.523 2.374 10 20 IECD COc1ccc([C@@H](C)NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 771727223 ROAAZHCWTZIGGH-GFCCVEGCSA-N 446.485 2.242 10 20 IECD CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778928778 BIGPQFYACRXBMK-JICACKBISA-N 436.555 2.426 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1 787119260 XHNHSCXCIMZTTG-QFIPXVFZSA-N 430.593 2.249 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCn2c(nnc2-c2ccccc2)C1 788931333 DIAZUKSZKWEFKL-UHFFFAOYSA-N 430.512 2.204 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCOC2(CCCCCC2)C1 789812146 JDVAWBMKLJAJTE-UHFFFAOYSA-N 433.524 2.230 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C3CCC(CO)CC3)cc2F)C[C@H](C)O1 789837302 YOYXTTUAPOCXDI-XNYRCJLNSA-N 435.540 2.065 10 20 IECD C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949514 JJEMOXBTQMYOIN-CABCVRRESA-N 443.466 2.090 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1cccs1 793733012 KFZTXLZSPIWLIO-FUHWJXTLSA-N 442.585 2.061 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CN(C(=O)OC(C)(C)C)C1 804752040 JJQKIXCPQRWMQC-UHFFFAOYSA-N 430.549 2.371 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCC3CCC(OC)CC3)cc2F)CC1 805007671 WNYCNXQCZBINNA-UHFFFAOYSA-N 448.583 2.295 10 20 IECD CCN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1)CC(F)(F)F 807101121 QGXOAFATPDZJLW-INIZCTEOSA-N 428.499 2.410 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1F 807387484 LLKYTNDRPAFSOO-UHFFFAOYSA-N 425.210 2.335 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807617320 MIFUDCIAHUDFNF-SFTDATJTSA-N 426.513 2.274 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 808058248 LCQDKLJGBLVBSV-PKTZIBPZSA-N 436.556 2.043 10 20 IECD COC[C@H](C)NS(=O)(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1 863991801 MIBNHQYPFBLCGR-SFHVURJKSA-N 432.590 2.364 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CN3CCCNC3=O)c2C)cc1 915433582 JSWRIMBXXARKBV-UHFFFAOYSA-N 427.457 2.022 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 920196243 MTAWEGHWPZYBDO-UHFFFAOYSA-N 429.345 2.474 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)cc1)C2)c1cc(O)nc(O)c1 1777852756 RYMYIJAQTZYESQ-VGOFRKELSA-N 429.448 2.073 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCN(C)C)CCO3)C2)cc1 1781752960 CPRGUYAAECESIO-VWLOTQADSA-N 438.572 2.489 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1 1785070254 ZIDSHAYYBXJUOA-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ccncn3)CCC2)cc1 1792315172 MNYDDCYHEBGXEY-UHFFFAOYSA-N 441.538 2.085 10 20 IECD CC(C)=CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796481193 UASNQXLOYAELKD-FEJSZKPUSA-N 438.528 2.115 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2ccnc12 1798112783 JCDRFEPXHOSVAX-BJKLQHCMSA-N 448.479 2.416 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)C(=O)C1CC1 1803060650 GJLLJEXPHLSLKB-KBXCAEBGSA-N 443.887 2.445 10 20 IECD Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cs1 1805962345 XLEANOMHSXGUHA-LIRRHRJNSA-N 439.497 2.286 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ccno1 1816440898 YWXBPSDNDKHEFK-KRWDZBQOSA-N 447.455 2.497 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847142 MFNOPHFRHQEHEV-RHSMWYFYSA-N 444.536 2.500 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2nc[nH]n2)CC1 1827351946 YAYATSNJVZMKSI-HNNXBMFYSA-N 433.896 2.416 10 20 IECD C[C@H]1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987036 BJYKTVYEQCVTPA-HNAYVOBHSA-N 430.549 2.114 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2CCC(F)(F)C2)C1 1841014579 OQIBBIAXPUPVAX-HNNXBMFYSA-N 430.455 2.418 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)COc2ccccc2F)C1 1846075774 RYWIJADNRZMNOW-VQHVLOKHSA-N 442.443 2.238 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)c(C)o1 571236923 BXQVOFQGJKJRBS-UHFFFAOYSA-N 436.512 2.297 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)ccc1-n1c(C)ccc1C 729833508 DCLUFUDAPOFVNN-GOSISDBHSA-N 431.558 2.168 10 20 IECD O=C(CNC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCC(CO)CC2)cc1 732272994 HEVAOXNKVJIEEE-UHFFFAOYSA-N 436.556 2.279 10 20 IECD CCO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 745692477 WBUXHARLVRPVLG-DOTOQJQBSA-N 444.536 2.210 10 20 IECD C[C@@H](CNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCN(C)CC1 745862067 GDVMTTVKUMXLPJ-ROUUACIJSA-N 439.551 2.440 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 754072488 ZTNSSWNMUCTRHF-GRYUFTJMSA-N 428.621 2.127 10 20 IECD C[C@H](CO)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 759303755 MVEADUKDRKZVOB-KRWDZBQOSA-N 430.528 2.150 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3c(C)cccc3F)CC2)cc1 763361114 HZGNQHJBRZYYBK-UHFFFAOYSA-N 428.508 2.410 10 20 IECD C[C@H](NCc1ccc(N(C)C)c(F)c1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 765476535 WPPJKGZDLZWPDX-AWEZNQCLSA-N 443.566 2.468 10 20 IECD COc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1C(=O)N(C)C 766199603 GKYSJAISTWADFT-UHFFFAOYSA-N 443.319 2.344 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CCC(N)=O)CC3)cc2F)C[C@H](C)O1 767777542 XCEPMFCNEYPLJI-IRXDYDNUSA-N 434.556 2.033 10 20 IECD COC(=O)CCc1csc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 769014631 ZHZQACYKMVDXMD-HNNXBMFYSA-N 445.545 2.272 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(C)nn3-c3ccc(C)nn3)CC2)cc1 773296464 OIMGOYSMGSLSEO-UHFFFAOYSA-N 449.515 2.011 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 775035966 IAKWDIURWGAHBZ-OAQYLSRUSA-N 436.556 2.125 10 20 IECD CCOc1ccc(NC(=O)CN2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 779531673 DFKHGANLWKEFNV-ONNFQVAWSA-N 425.485 2.293 10 20 IECD O=C(NCc1ccccc1Cn1cccn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785639630 HKIZKMMVRNHCRA-JOCHJYFZSA-N 448.523 2.461 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](CC(C)C)N3CCCCC3=O)cc2)CC1 786656174 LJMJJCRLUUQHBY-QFIPXVFZSA-N 428.577 2.399 10 20 IECD CCC(=O)Nc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 787083372 PBCMOKTVCQLGHV-UHFFFAOYSA-N 438.528 2.445 10 20 IECD CN(CCCOc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310246 JZFYYNBCDUZUHO-UHFFFAOYSA-N 429.492 2.206 10 20 IECD COc1ccc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1 789178174 VFSGEUCMGBOPHI-HOTGVXAUSA-N 445.491 2.245 10 20 IECD C[C@@H](Cc1ccncc1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826230 PAGIVTYVCADGAJ-YESZJQIVSA-N 428.508 2.198 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC(c4ccccc4)CC3)cc2)C1 793721726 RSEDGJOSHKNCFC-QFIPXVFZSA-N 448.567 2.411 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(OC(F)F)cn1)c1ccc(N2CCOCC2)cc1 803301679 WFWDAYMQWDZEEE-CQSZACIVSA-N 434.443 2.013 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 803448419 QUEVVUYDWXCLHW-UHFFFAOYSA-N 432.471 2.435 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1)c1ccc(N(C)C)cc1 807678759 ZNHLRWALMQWMAJ-ZYSHUDEJSA-N 431.558 2.342 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cn3cc(Cl)cn3)cc2F)C[C@H](C)O1 808551617 DNKACVSBXMCSOB-KBPBESRZSA-N 438.887 2.149 10 20 IECD Cc1cc(CC(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c(C)n1-c1ccc(Cl)cc1 916410238 XKAMXFNHZQMWHU-UHFFFAOYSA-N 442.947 2.239 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC 918000461 GDVLRWBLDQATBI-GOSISDBHSA-N 426.517 2.405 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2NC1=O 918032652 GCBCINPVFARUQO-GOEBONIOSA-N 437.500 2.429 10 20 IECD COC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918035908 NRNVSGSTFMEERP-QGZVFWFLSA-N 440.500 2.262 10 20 IECD CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918443561 WSBIQPKMXISFJH-UHFFFAOYSA-N 438.528 2.499 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C(N)=O)cs3)cc2F)C[C@@H](C)O1 920602892 VKAKHTWDOCTWLZ-BETUJISGSA-N 449.504 2.073 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(Cl)cccn12)c1cc(O)nc(O)c1 1796526261 CSHOJRFVDJOHOU-BTTYYORXSA-N 441.875 2.360 10 20 IECD CSCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767033 NKVDSZQIXZIQEL-YWVIFJGQSA-N 442.965 2.344 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cnsn3)C2)CC1 1807606558 UZAJCJMHPGRYSV-HWKANZROSA-N 444.513 2.213 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cncc(F)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807989787 CZMSEZDKUBSGFW-VLIAUNLRSA-N 437.431 2.055 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2cccnc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993867 PAQVNWHYTOTOMO-AVIWDUSBSA-N 445.479 2.316 10 20 IECD COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1816268853 OOYGBBWCNUQCDQ-OAHLLOKOSA-N 438.444 2.239 10 20 IECD CC(C)(F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826772047 MNEMJQYMESQBBW-AWEZNQCLSA-N 429.583 2.215 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1832185520 AYNBYYLDMMQKIU-VQIMIIECSA-N 441.532 2.492 10 20 IECD Cc1ncc(Br)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842186866 DLHHQAKRNUWVJI-UHFFFAOYSA-N 447.289 2.090 10 20 IECD Cc1cc2[nH]c(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)cc2s1 1847055572 MRBGLWDLSZAFLO-UHFFFAOYSA-N 448.595 2.215 10 20 IECD CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)Nc3ccn(C)n3)no2)C1 574197471 HLMNHMOZHNVVJH-UHFFFAOYSA-N 433.516 2.754 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 729626737 DFIJJDGDRFRKSU-PZJWPPBQSA-N 428.577 2.067 10 20 IECD O=C(CN1CCC[C@H](N2CCCC2=O)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 732210633 AZBXESHVCXEJMV-KRWDZBQOSA-N 431.492 2.487 10 20 IECD CCC[C@](C)(O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732886202 ULVPUYXMYWXNIL-QFIPXVFZSA-N 430.528 2.293 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 737156749 DJUOVZKMJPLVFN-AWEZNQCLSA-N 429.448 2.265 10 20 IECD CCc1cccc(CC)c1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737245952 QEOUHWDHPXAYTJ-UHFFFAOYSA-N 443.569 2.301 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC3CCN(CC(F)(F)F)CC3)cc2)C1 742770253 MYHXPDFHZHNBRW-MRXNPFEDSA-N 441.498 2.214 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H]3C[C@@H](N(C)C)CC[C@@H]32)c1 746655071 ZPDFCFCIUWFBBN-RJGXRXQPSA-N 431.577 2.111 10 20 IECD C[C@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2N1C 749918001 ITRTWHDSMWUASS-YJBOKZPZSA-N 435.528 2.095 10 20 IECD Cn1cc(Br)cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1=O 751557174 UXMHLVLEVPFYCN-UHFFFAOYSA-N 439.285 2.445 10 20 IECD COC(=O)C[C@H]1CN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 754067265 NZCVOYVPKQBICT-FPOVZHCZSA-N 439.556 2.345 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccs4)CC3)cc2)C1 757640583 ZYQOZLZHAASTAI-SFHVURJKSA-N 427.574 2.482 10 20 IECD CCN(CC)C(=O)CCCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759219855 FJNAWBXARUOJJF-UHFFFAOYSA-N 436.553 2.193 10 20 IECD COc1cc(N2CCN(C(=O)c3ccccc3S(C)(=O)=O)CC2)cc(OC)c1OC 759238605 BBCQKTIPTQERBU-UHFFFAOYSA-N 434.514 2.078 10 20 IECD COc1ccc(F)cc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759410386 RUQOMZFTIQIBEY-UHFFFAOYSA-N 447.463 2.147 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCN2C(=O)OC[C@@H]2C1 764137602 XMSVNXMSXMZTPP-IGVUGNCQSA-N 437.568 2.393 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)ccc21 767820152 AICGXFZVBUDZIU-UHFFFAOYSA-N 435.477 2.273 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cccc(Br)c2O)CC1 768208127 NSVJWNANVKOLKL-UHFFFAOYSA-N 430.324 2.266 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 773740352 KJNMAKXFTOTQMI-CQSZACIVSA-N 427.482 2.077 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCC3=O)cc2Cl)C1 774473171 SDNCKFTZLPYIQW-MRXNPFEDSA-N 434.968 2.321 10 20 IECD CN(C)Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 788461359 RSXQCQNZXPLDNY-UHFFFAOYSA-N 426.586 2.234 10 20 IECD CNC(=O)CNC(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 800595783 GPBFSJQXZVVSIY-IBGZPJMESA-N 440.500 2.081 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1)c1ccc(N2CCOCC2)cc1 803296336 AZLNYMSJWPQOCM-XXBNENTESA-N 447.539 2.455 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)cc1F 803663550 RZWAQAAGTDXCGS-ICSRJNTNSA-N 434.462 2.348 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(C[C@H]1CCOC1)C1CC1 807771893 YPXZMGIUVYUPGT-HZPDHXFCSA-N 437.487 2.401 10 20 IECD CC(C)OCCN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 808519968 HKWYIVZDACTNAR-UHFFFAOYSA-N 430.593 2.249 10 20 IECD COCCC(=O)N1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 808969019 XJIUEQBOYXVGQL-UHFFFAOYSA-N 445.560 2.197 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(NC(=O)C4CC4)CC3)cc2F)C[C@H](C)O1 917056062 NGDMQIGIOYDHDS-IRXDYDNUSA-N 446.567 2.046 10 20 IECD CN(C)C(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918296016 VMLJAUKESMXSAI-LJQANCHMSA-N 425.485 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccc(F)cc3)CC2)cc1 920254173 FZZGNKIGGPFDIT-ZHACJKMWSA-N 427.476 2.234 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](c1ccccc1)N1CCOC1=O 1116669730 XDBFLGMJQNZTIZ-ROUUACIJSA-N 442.468 2.272 10 20 IECD O=C(CC[C@@H]1CCOC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007223 DXKFWUPIJNRPCX-SPLOXXLWSA-N 438.908 2.011 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cnsn3)cc2)CCC1 1787100204 BUUOLFUODGFXET-UHFFFAOYSA-N 447.567 2.146 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(O)cc1O)c1cc(O)nc(O)c1 1800289437 XYFOVFHWZJPJFH-ZSBIGDGJSA-N 433.848 2.123 10 20 IECD O=C(Cc1ccc(O)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719918 UWOLZSCTAICKQH-QDMKHBRRSA-N 431.876 2.346 10 20 IECD CC(=O)O[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C(C)C 1817845917 BYTZNKGEOKNAQD-BEFAXECRSA-N 445.476 2.110 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818147874 NZYVZHKFWIFGAK-KBXCAEBGSA-N 438.488 2.230 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)sc2C1)c1cc(O)nc(O)c1 1824654088 PQCUQFGFYPGZHZ-DJUAPZDMSA-N 430.511 2.050 10 20 IECD O=C(/C=C/c1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428639 AHIBQIDHUBLTDE-SHCNBLLESA-N 425.489 2.163 10 20 IECD Cc1cc(C(=O)CN2CCCC[C@H]2C2OCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 110990495 VWSVMHBQWCFWMF-FQEVSTJZSA-N 447.557 2.152 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(-c4cccc(C)c4)nn3)CC2)cc1 725967823 VGPQHFCVBUNODC-UHFFFAOYSA-N 435.484 2.090 10 20 IECD COc1ccc(O)c(CNC(=O)c2cccc(C(=O)NCc3cc(OC)ccc3O)n2)c1 734015093 ZBALVAAKCIRIJX-UHFFFAOYSA-N 437.452 2.370 10 20 IECD COc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)NC4CC4)c3)CC2)cc1F 753733335 YHCPUVFSUYFZLM-UHFFFAOYSA-N 433.505 2.237 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)nc(O)n4C)CC2)cc(OC)c1OC 760084190 LRQXNEAHARKHNI-UHFFFAOYSA-N 426.473 2.267 10 20 IECD COc1cc(Br)cc(CN2CCCN(CC(=O)N3CCCC3)CC2)c1O 768252129 XWMFPLJJDCKWCT-UHFFFAOYSA-N 426.355 2.293 10 20 IECD O=C(CCNC(=O)c1cc(F)ccc1Br)NCCc1ccc(O)c(O)c1 770624149 DUORKGJSIRSBRQ-UHFFFAOYSA-N 425.254 2.478 10 20 IECD CCC(=O)N1CCC[C@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771068480 QNDVSRSDRJKJOP-KRWDZBQOSA-N 441.532 2.086 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)N3CCC[C@@H](C)C3)cc2F)C[C@H](C)O1 789823698 FCSIPECICMXXOI-YRXWBPOGSA-N 448.583 2.292 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1nnc2n1CCOC2 791695593 LMNBTMKTRXEVBK-LCYFTJDESA-N 449.583 2.168 10 20 IECD C[C@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 793716399 CYZUUXNSRIGJQR-NQIIRXRSSA-N 436.556 2.267 10 20 IECD CC(=O)N[C@@](C)(C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797607209 IWSRQEFFULAHAG-JOCHJYFZSA-N 431.558 2.166 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1OC(C)C 799262596 DXRUREDQQLQRML-ZDUSSCGKSA-N 430.457 2.358 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(S(C)(=O)=O)CC3)cc2Cl)C1 799994495 BOWAPDGVMWDZHC-HNNXBMFYSA-N 428.986 2.363 10 20 IECD CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 801599924 ICMUYEIYPXWJTO-UHFFFAOYSA-N 430.480 2.361 10 20 IECD CN(CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCCC1 804820352 HXACCJOLIQOWPG-INIZCTEOSA-N 438.519 2.364 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4ccc(F)cc4C3)cc2F)CC1 805008013 XRTWOXPZQBCWKO-UHFFFAOYSA-N 442.510 2.308 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)c2ccccc2C)CC1 807102894 IRUAQLLTBHVSEI-UHFFFAOYSA-N 436.556 2.407 10 20 IECD C[C@H](NC(=O)C(=O)NCCCCn1cc(Br)cn1)c1ccc(N(C)C)cc1 807671221 MHUJNGDMAQEARL-AWEZNQCLSA-N 436.354 2.485 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(c3ncc[nH]3)CC2)c([N+](=O)[O-])c1Br 811840274 WBRAMOADEKHDFY-UHFFFAOYSA-N 427.215 2.324 10 20 IECD O=C(CN[C@H](C1CC1)[C@@]1(CO)CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815289063 WHGRSEJDGRJLAT-RPBOFIJWSA-N 434.492 2.310 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1F 916590105 JMCVHTOMPZSCSP-UHFFFAOYSA-N 425.434 2.307 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccc(-n4cncn4)nc3)cc2F)C[C@@H](C)O1 918204992 XIPSPBGERQHOBR-HZPDHXFCSA-N 439.495 2.414 10 20 IECD CN(C)C(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 918457408 RVCGUOOHFJGTOM-UHFFFAOYSA-N 438.528 2.349 10 20 IECD COCCOc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918780414 IEJLUQMPDGCZCN-HXUWFJFHSA-N 440.544 2.413 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)c1 919810946 YQXQJGPWWGBOMP-MRXNPFEDSA-N 448.501 2.317 10 20 IECD CCOc1ccc(N2CCN(C(=O)Cc3c(C)[nH]c(-c4ccncc4)nc3=O)CC2)cc1 1319871515 VGXKDXVCROCPCW-UHFFFAOYSA-N 433.512 2.430 10 20 IECD CS(=O)(=O)Nc1ccccc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1323720422 BXLJOMNFYQACTI-UHFFFAOYSA-N 446.573 2.266 10 20 IECD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806934374 VLZGPZUQWHQLKW-HTAPYJJXSA-N 440.500 2.024 10 20 IECD CCc1[nH]nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816256092 IPPNABYSVIAGLR-CYBMUJFWSA-N 443.439 2.260 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2ccnc2c1 1819098765 ZMHHKWMWSIMZBF-INIZCTEOSA-N 447.455 2.483 10 20 IECD CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)n[nH]1 1821546419 JPKYNTRWZHVHHU-NSHDSACASA-N 442.501 2.335 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)c2ncc[nH]2)CC1 1825640445 ISBHTRRKMFCNMY-UABRLCRWSA-N 440.500 2.473 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429256 QXKFQOHEPWRKDO-MOPGFXCFSA-N 446.548 2.031 10 20 IECD Cc1ccncc1CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033958 QWXKQMLKFQJZPT-XBXARRHUSA-N 437.496 2.356 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCc2cc(F)ccn2)=NN1c1ccccc1 1848175569 QQQFRXKGPNONDZ-SFTDATJTSA-N 449.486 2.148 10 20 IECD CC(=O)N1CCC[C@@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 10703983 VMFZNCJJLRIKSC-OAHLLOKOSA-N 434.448 2.202 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC)cc3OC)cc2F)CC1 730391149 JUQVOTYWJXQJTR-UHFFFAOYSA-N 444.507 2.240 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cc3OC)cc2F)CC1 730391704 SKNBBXCGRVSOOV-UHFFFAOYSA-N 432.471 2.370 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3cccc(OC)c3)CC2)cc1 732444373 SYMLMZQUDYELLR-HSZRJFAPSA-N 442.560 2.249 10 20 IECD C[C@@H](NC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1)c1ccc(N2CCOCC2)cc1 732571482 DSUFQGJORJMILL-MJGOQNOKSA-N 437.544 2.261 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 735518679 ZNIBWTDEOYLQGH-FQEVSTJZSA-N 432.542 2.305 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(N2CCSCC2)cc1 743896235 DEMFSEYIIMUNSQ-UHFFFAOYSA-N 440.569 2.331 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CN(C(=O)OC(C)(C)C)C3CC3)CC2)cc1 753059257 UWKMEGXYKNHPNI-UHFFFAOYSA-N 432.565 2.333 10 20 IECD C[C@H]1COCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 754581607 SSNPAOLZKMEHKO-QGZVFWFLSA-N 428.512 2.120 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 757769004 SGSDDJIWVZXKHG-IBGZPJMESA-N 437.548 2.140 10 20 IECD CCS(=O)(=O)N1CCc2cc(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)ccc21 759593882 JYLCMDNKXLXHTA-YWEYNIOJSA-N 431.466 2.249 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 761248797 GPHNEOHFECJZAO-UHFFFAOYSA-N 441.575 2.344 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccccc1S(=O)(=O)N1CCOCC1 764896645 GZFBDDYTJFULCF-UHFFFAOYSA-N 431.558 2.436 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1(N(C)C)CCCCCC1 775221898 IQKDXXAUYHPCBL-UHFFFAOYSA-N 430.593 2.252 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3csc([C@@H](C)OC)n3)CC2)cc1 778314753 UTBNPOASNINUAG-HLRDLLSLSA-N 444.557 2.380 10 20 IECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781454637 VEWVMLBMASEYFB-UHFFFAOYSA-N 447.438 2.233 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(CC(N)=O)cc1 785191485 CGFUGOYKZXIHFK-UHFFFAOYSA-N 434.290 2.170 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C(=O)c3cnn(-c4ccccc4)c3)cc2)CC1 786260452 WQLQWDYXALOKPU-UHFFFAOYSA-N 431.496 2.040 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccnc1OCC(F)(F)F 787279303 GJWPUSIGRPACBO-UHFFFAOYSA-N 434.418 2.332 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C3CCC(CO)CC3)cc2F)C[C@@H](C)O1 789837298 YOYXTTUAPOCXDI-GIOYIUAESA-N 435.540 2.065 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@H](C2CCCCC2)C1 789843415 KVFXJTRLNGJIQW-QFIPXVFZSA-N 447.551 2.211 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 789867917 JNWYXSULVLMNDK-AQNXPRMDSA-N 429.586 2.320 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c[nH]c4cccc(F)c34)CC2)cc1 790020245 JXIKFDBHVAMSJL-UHFFFAOYSA-N 432.521 2.416 10 20 IECD COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797389626 QOLJIJWSZHFNMJ-UHFFFAOYSA-N 426.347 2.461 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 801548019 JDFPPRIIZQDYIA-UHFFFAOYSA-N 447.557 2.201 10 20 IECD COCc1csc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 807008536 DNGIPBMKVKSKSV-AWEZNQCLSA-N 438.937 2.368 10 20 IECD C[C@@H]1C[C@H](N(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1C 807770745 NVOHZBNPIWRWDG-SOLBZPMBSA-N 438.519 2.314 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 808586930 XDOMULJCGIDCKP-LJQANCHMSA-N 428.920 2.286 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc(S(C)(=O)=O)c3)CC2)cc1 915334208 DVWIZJTXCHHLIM-UHFFFAOYSA-N 446.573 2.433 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)c4cccc(F)c4)CC3)nc12 917097005 QKMWTFXBCHELEC-UHFFFAOYSA-N 441.463 2.099 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cc1 1324296131 BCOQZDAOIRQPEI-UHFFFAOYSA-N 429.542 2.488 10 20 IECD Cc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336415 WMIHZNLLJBHFJP-BCDXTJNWSA-N 445.610 2.426 10 20 IECD CC(C)COc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)ccn1 1843430213 MTNVWKOFODYMCF-UHFFFAOYSA-N 426.473 2.053 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 116434165 MKUBNHHCKHUKPK-UHFFFAOYSA-N 434.518 2.378 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CCC(N)=O)C3)cc2F)C[C@@H](C)O1 727157460 IUMIKFCUBAADTB-KSZLIROESA-N 434.556 2.033 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 735828809 NWELGPFQGILEFS-UHFFFAOYSA-N 449.548 2.263 10 20 IECD Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741097786 YQAHEESMJXBWMA-UHFFFAOYSA-N 429.480 2.282 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1C(N)=O 743975035 LHXHTUGMNJLRKP-HNNXBMFYSA-N 446.454 2.419 10 20 IECD Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 749736942 SOALKEASLYDFEI-UHFFFAOYSA-N 447.547 2.368 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 754043284 KJBIIFAOIFPEMB-RBBKRZOGSA-N 446.636 2.052 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc([S@](C)=O)cc3)CC2)cc1 754163774 HSOUTMGJBLPVGH-DJAUYKNWSA-N 431.602 2.266 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Oc4cc(C)ccn4)CC3)CC2)cc1 754268012 CUDBNDHJFMZMQK-QFIPXVFZSA-N 440.588 2.425 10 20 IECD CC1(C2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)OCCO1 756679796 FMXATXSKIAFIFC-GOSISDBHSA-N 430.549 2.073 10 20 IECD Cc1cc(O)cc(=O)n1CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 759805365 VAHXZOPFEKLYSW-LJQANCHMSA-N 444.532 2.311 10 20 IECD O=C1C[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CN1CCOc1ccccc1 761473313 CMPMDOWEAWBUOL-KRWDZBQOSA-N 443.887 2.490 10 20 IECD CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 761810403 JNWZHVZDDVTOGE-UHFFFAOYSA-N 427.520 2.494 10 20 IECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)NCc1ccccc1 768235216 XSLSSZXKDODHDU-UHFFFAOYSA-N 426.536 2.096 10 20 IECD C[C@H](NS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1)c1ccc(N(C)C)cc1 773088887 PTJSTEZWEGHSAB-LBPRGKRZSA-N 432.468 2.423 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(-c2ccccc2Br)c1 774363013 PWBHEHCFHPQJMM-UHFFFAOYSA-N 445.273 2.343 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)c1 775370923 JRCJCQFWKRHLJU-KRWDZBQOSA-N 425.529 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CCN(C)C)C(C)(C)C)CC2)cc1 778284511 NWGYOQUEVBAPAU-VIOKTNGOSA-N 430.593 2.383 10 20 IECD CCO[C@H]1C[C@](CO)(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 780189138 WBYOOGIIEAIATD-XUZZJYLKSA-N 448.608 2.073 10 20 IECD COc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c(OC)c1OC 780960551 FTZHWUUSXGLAPZ-UHFFFAOYSA-N 430.457 2.030 10 20 IECD COC[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H](C)O1 784660136 ZTZUQHZFLGNVTR-GXTWGEPZSA-N 426.516 2.130 10 20 IECD COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 785499535 MUDWWMIDTKXUHQ-INIZCTEOSA-N 427.501 2.034 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656122 KRNWEBDMYSRUIM-AYFDUDKQSA-N 444.601 2.229 10 20 IECD CCOCCOCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 787504914 DOBQOLQVCJDFEH-UHFFFAOYSA-N 428.532 2.380 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCn3c(Cc4ccccc4)nnc3C2)cc1 788975609 RSMDRQXQAOFBQA-UHFFFAOYSA-N 446.555 2.374 10 20 IECD COc1nc(Br)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 789570493 MBCQUWUGDBPCFO-UHFFFAOYSA-N 431.290 2.484 10 20 IECD CCC(CC)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)SC 793723772 NBSLUOFFQJQXRZ-KRWDZBQOSA-N 434.606 2.043 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)c3ccc(C)s3)CC2)cc1 793850906 OIKLWMRYTOTULT-KRWDZBQOSA-N 430.574 2.181 10 20 IECD COC(=O)[C@H](CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1)c1ccccc1 795288932 AVTSDNRMYZWBKA-CQSZACIVSA-N 446.934 2.410 10 20 IECD COc1coc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1=O 798673824 CLJYZZPZLRTISQ-UHFFFAOYSA-N 433.372 2.219 10 20 IECD CC[C@H]1CO[C@@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448928 IJDABAUAIJXYSJ-HOCLYGCPSA-N 425.476 2.399 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 807372876 NJDKHSKRUBYSEN-IAGOWNOFSA-N 431.558 2.217 10 20 IECD C[C@](O)(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 807498064 VZOOJEJRWDTPAP-RDPSFJRHSA-N 426.513 2.314 10 20 IECD COc1ccc(N2CCCN(c3nnc(C(=O)NC(C)C)n3C[C@@H]3CCCO3)CC2)cc1 812307449 DXWPSNMGZOWPFJ-FQEVSTJZSA-N 442.564 2.321 10 20 IECD COCCN1C(=O)/C(=C/Nc2ccnn2Cc2ccc(C(C)C)cc2)C(=O)NC1=S 814316996 XZXUPMUJJJXLCV-SFQUDFHCSA-N 427.530 2.240 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)sc1C(C)=O 815471021 SHEGHHISRLRTNI-VIFPVBQESA-N 435.458 2.053 10 20 IECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCC[C@@H]4CO)cc3)cc2)CC1 864044923 NQSIOUWAGBEAQM-JOCHJYFZSA-N 444.601 2.196 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCC(C(=O)NCCC(C)C)CC3)CC2)cc1 916984623 LPZOHBDAYKBQHD-UHFFFAOYSA-N 430.593 2.218 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc4ccccc4oc3=O)cc2)C1 917832621 DHVHSYLNTQCTHU-KRWDZBQOSA-N 434.496 2.139 10 20 IECD COc1ccc2c(ccn2CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337272 IKFYPKWWLULIMT-UHFFFAOYSA-N 427.526 2.201 10 20 IECD COC(=O)c1cc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)oc1C 1317920398 ITDDTEMWWOOQLR-MRXNPFEDSA-N 428.489 2.076 10 20 IECD Cn1ccnc1C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 1319781112 HWTXDBRUHVEBLR-VQTJNVASSA-N 438.576 2.286 10 20 IECD Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)ccc1F 1782004757 MIGKKVWDKHSUCL-NRFANRHFSA-N 449.866 2.351 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)ccn1 1820483294 NCOBNJCLODRHGR-ZDUSSCGKSA-N 425.470 2.192 10 20 IECD Cc1ccc([C@H](C)C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1846057904 SURZBWPYOACQGZ-HNNXBMFYSA-N 431.583 2.162 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 727325542 BAUFDEWRADQXHO-UHFFFAOYSA-N 438.528 2.448 10 20 IECD CCc1ccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 727979842 YAQPRQQHYRPCAG-UHFFFAOYSA-N 433.603 2.499 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1 728980237 YQIOVVPGCQVNSY-GFCCVEGCSA-N 437.518 2.284 10 20 IECD CCc1nnsc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 746273987 UUXFJRAXTGBYIM-UHFFFAOYSA-N 448.526 2.195 10 20 IECD COC(=O)c1ccsc1N1CC[C@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)C1=O 746779387 HYGRGUQPLPTXBW-NHYWBVRUSA-N 433.486 2.415 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO 747579294 CFHXHKPLZFHOLW-LADGPHEKSA-N 438.572 2.205 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)NC(=O)[C@H](C)N4C)CC2)cc1 749930591 KUJGYXOFSOGQRG-KRWDZBQOSA-N 437.544 2.024 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 759982842 HWYYEJPOEVQHAE-IBGZPJMESA-N 432.542 2.441 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)NN1CCCC1=O 762643301 ZLOMICAVFPGXLU-WQLSENKSSA-N 440.344 2.304 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)cc1 763415910 BCPAXJSUQUUIII-UHFFFAOYSA-N 441.506 2.234 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 766268806 GORBBZMCVPNEHJ-UYAOXDASSA-N 436.574 2.033 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)OC[C@H]4CCCO4)n3)CC2)cc1 771067901 PKWMNPMQCBJRQS-VQIMIIECSA-N 430.505 2.226 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCO[C@H](CN4C(=O)c5ccccc5C4=O)C3)ccc21 771545172 IQCXGMPDPQIVKH-IBGZPJMESA-N 448.523 2.276 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnn(CC(F)(F)F)c1 772711674 QSOFANXJPUGXEN-UHFFFAOYSA-N 436.431 2.024 10 20 IECD O=C(NCCc1ccc[nH]1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 772835447 APYDTNDVMFFUIK-UHFFFAOYSA-N 430.442 2.402 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773847759 OPCXCTWWNSSJOA-DFYVNMARSA-N 431.558 2.464 10 20 IECD CN1CCN(c2ccc(CN3CCCN(S(=O)(=O)c4ccccc4)CC3)cc2)CC1 775661547 QGOVYUDJUSBTQZ-UHFFFAOYSA-N 428.602 2.335 10 20 IECD Cc1ccc(C(=O)N2CCC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c(O)c1O 777397764 ZWVCLVSQGZYBCT-HNNXBMFYSA-N 433.505 2.090 10 20 IECD COc1ccc(C(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c(OC)c1OC 779532727 WABDBQBISNZYCN-WEVVVXLNSA-N 442.468 2.121 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCn1cnc2ccccc21)c1ccc(N2CCOCC2)cc1 785410697 HONYYQQACJHZGE-GOSISDBHSA-N 435.528 2.257 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 786497236 NGBRRGXOHYGHTN-OKILXGFUSA-N 434.537 2.179 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1F 787102974 HSDIUTAXHVWDOV-LJQANCHMSA-N 434.556 2.048 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@@H]3c3cc(OC)ccc3OC)nc12 788197940 VPDQLKUMUMKKJN-ZBFHGGJFSA-N 441.440 2.476 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccccc2N2CCOCC2)cc1F 788330146 ASRRCBADVNABHZ-UHFFFAOYSA-N 442.535 2.441 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F 789797575 AUOOTBWVKGULDY-CQSZACIVSA-N 435.446 2.477 10 20 IECD C[C@@H](CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1CCCCC1 789823172 ZFLPLZWAZBRMLG-IPMKNSEASA-N 448.583 2.436 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)[C@@H](Cc4ccccc4)C3)CC2)cc1 792940949 LOLZXJURFLVAGC-DQEYMECFSA-N 438.616 2.037 10 20 IECD COC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 795687429 KRIFCNGSYLIZJB-HXUWFJFHSA-N 444.450 2.354 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 803298793 DWSKURPOOSDDJU-YWZLYKJASA-N 427.549 2.318 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4ccc(F)cc4F)C3)ccc21 803687398 LRUNORIUVUZPJW-GOSISDBHSA-N 428.483 2.359 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN(C)CC(F)(F)F 804137712 BHEUIFXVTIMFAK-UHFFFAOYSA-N 440.260 2.114 10 20 IECD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 804366573 SJWSWPRMQNUENE-OAHLLOKOSA-N 438.488 2.099 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 805202263 OERPLUADZRLCCF-ZDUSSCGKSA-N 438.962 2.317 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)CN(C)C 807605862 XGVPGKWSLRUGGG-HOTGVXAUSA-N 440.535 2.466 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnc(NC(C)=O)s3)n2)c[nH]1 808529090 DLGUPYIREJHETI-UHFFFAOYSA-N 427.489 2.141 10 20 IECD CN(C)CCc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 809801475 XHRCIJQCBLLSBR-JOCHJYFZSA-N 439.556 2.320 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1F 810265969 RZJXEBSQCJYLRN-UHFFFAOYSA-N 444.326 2.249 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(Cl)cn1 816891558 WNWHWXWMYMEPMQ-UHFFFAOYSA-N 441.912 2.169 10 20 IECD CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCc1ccc(O)c(O)c1 917356471 UHXFLBGYPMCQGJ-KRWDZBQOSA-N 438.571 2.165 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2ccccc2)CC1 918217735 LERIXKMSVZUJDI-UHFFFAOYSA-N 426.492 2.330 10 20 IECD O=C(NCC(=O)N1CCCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 920045697 UJHRXZJXVIMSSD-UHFFFAOYSA-N 426.492 2.441 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920865879 QGAMRVBUVJBPDR-MRXNPFEDSA-N 438.571 2.275 10 20 IECD CC(=O)Nc1ccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 920995151 SQHACKVOHOWISC-UHFFFAOYSA-N 432.571 2.366 10 20 IECD CC1(C)Cc2cccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)c2O1 1322628573 MEFIDWPIFZYTGM-UHFFFAOYSA-N 440.499 2.271 10 20 IECD CN(C)C(=O)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1520620245 LMNQVMIAARBZGI-ZDUSSCGKSA-N 437.543 2.195 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccoc4c3)C[C@@H]21)c1cc(O)nc(O)c1 1787294214 KRTCEVGKDIZQDT-IEZWGBDMSA-N 437.452 2.146 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1803342264 LMLMPCWJRVAECA-HIXUMGDSSA-N 443.544 2.328 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843595 SFFXFRAETWVYDU-HOTGVXAUSA-N 428.493 2.006 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cocn2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146627 UOZBQNREITUSKY-GOSISDBHSA-N 447.455 2.497 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCOC2)CC1 1832383852 MGAVUUSUDUDBCU-VRKMBTERSA-N 444.528 2.473 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2)C1 1842716465 UCVMAQQXZNGXJM-WEVVVXLNSA-N 426.444 2.402 10 20 IECD Cc1noc(C)c1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848232456 ZWWXLPBIZOEBNP-LETPOXDLSA-N 441.484 2.256 10 20 IECD Cc1cc(NC(=O)C2=S=C(CCNS(C)(=O)=O)C=C2)ccc1NC(=O)c1ccco1 490157249 ZSMJJHNHQSHPIJ-UHFFFAOYSA-N 447.538 2.366 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cc(F)cc4c3OCOC4)CC2)cc1 730060002 HKQCXCRHLZYHQU-WJOKGBTCSA-N 448.516 2.298 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3N3CCOCC3)cc2)C1 730773107 XANGKLAQWWJSGF-SFHVURJKSA-N 440.519 2.294 10 20 IECD NC(=O)[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN1c1ccc(F)cc1 731859121 RXNHFKNWWQQIIR-QUCCMNQESA-N 440.475 2.159 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F 734702681 BTEOAJCZMVNDKG-UHFFFAOYSA-N 425.457 2.312 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1cccc(S(=O)(=O)N2CCCC2)c1 735315501 ROZMCOQZPZLCGE-UHFFFAOYSA-N 447.629 2.388 10 20 IECD O=C(NCCNc1nccc(C(F)(F)F)n1)NCc1ccc(N2CCOCC2)c(F)c1 738460243 NVZYJIRLTKNALT-UHFFFAOYSA-N 442.417 2.382 10 20 IECD Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741097672 URTFUEJJXZVIET-UHFFFAOYSA-N 448.523 2.099 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 743359770 WQUOLOOJJCJHHD-PMACEKPBSA-N 447.624 2.004 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]3C)nc12 749490611 UZUSWNWIDZLYSB-KBPBESRZSA-N 433.509 2.489 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)cc1 751549663 ZPQZGQYSAIPIBN-MRXNPFEDSA-N 428.536 2.187 10 20 IECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)ccc2O1 751589314 PBOLCTPBFVMFOM-MRXNPFEDSA-N 434.499 2.211 10 20 IECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 753076648 IERHGMPQXIZRLR-KEEVHDRGSA-N 447.630 2.471 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(OC)c(N4CCNC4=O)c3)CC2)cc1F 753732347 SWDNCVKLGYBIQH-UHFFFAOYSA-N 428.464 2.335 10 20 IECD CS(=O)(=O)NC1(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCCC1 760982785 XHNFZUKWVFEMBK-UHFFFAOYSA-N 429.926 2.062 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(O)cc2OC(C)C)cc1[C@@]1(C)NC(=O)NC1=O 761995350 MAIVTYWOQYCTQR-HXUWFJFHSA-N 449.485 2.043 10 20 IECD C[C@H](NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)c(F)c1 765519408 WLMJWDFFSJUPIO-IBGZPJMESA-N 441.551 2.447 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1Cl 765926698 PLJJASDEJHZOJT-UHFFFAOYSA-N 426.654 2.162 10 20 IECD NC(=O)[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)cc1 766749876 GDMUXIMNFLYPKE-SFHVURJKSA-N 447.378 2.466 10 20 IECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n(-c2ncccn2)n1 768117357 KFAUGAJQYOVORM-UHFFFAOYSA-N 433.516 2.423 10 20 IECD NS(=O)(=O)c1cccc2c(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)nccc12 770555039 RNLMZRIJRKKSHH-INIZCTEOSA-N 441.509 2.409 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1 774866637 XICUUQZNEFIINH-HSZRJFAPSA-N 438.572 2.166 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4c3cccc4[N+](=O)[O-])CC2)cc1 778288335 XYVUUVAXNZTFAU-KTKRTIGZSA-N 436.468 2.398 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 778328506 OBUNGUDMFQYGLB-MDZDMXLPSA-N 448.523 2.167 10 20 IECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NCc2ccc(O)c(O)c2)CC1 778926409 CRVCTSZLARQARC-UHFFFAOYSA-N 449.485 2.032 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C)c(F)c(C(=O)O)c3)c2)CC1 780407589 MMDXLUVDUFFNRB-UHFFFAOYSA-N 435.477 2.302 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)O2 781999846 LYCASWJPOATSBF-CQSZACIVSA-N 433.464 2.363 10 20 IECD CCCc1cc(=O)n2nc(NCc3ccc(N4CCN(C(C)=O)CC4)cc3)sc2n1 786074449 QUYQPMKQROILIH-UHFFFAOYSA-N 426.546 2.384 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786275999 QELRLSQBMWBDAI-UHFFFAOYSA-N 443.475 2.023 10 20 IECD CCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 786689955 LBYCZDJSBTZNAS-UHFFFAOYSA-N 442.535 2.299 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1 788939736 VRGPWYHYWODBQW-UHFFFAOYSA-N 441.528 2.288 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3nc(C)c(C)s3)CC2)cc1 789356266 HGYOGQTVBPFHPE-UHFFFAOYSA-N 431.562 2.036 10 20 IECD Cc1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789826302 PIWAUYBAJKEDIG-STQMWFEESA-N 434.537 2.445 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1 792346051 XXODKVLBSYDVLT-UHFFFAOYSA-N 432.527 2.424 10 20 IECD CN(C)S(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 793733089 XDQCUHPHHSVQDH-IBGZPJMESA-N 432.542 2.393 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061659 OAZMPCQHZXFFBI-PKOBYXMFSA-N 431.499 2.220 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450668 NXIGGXMPLLXGBK-UHFFFAOYSA-N 449.502 2.475 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1 806899698 NCKNPBVESAITNS-UHFFFAOYSA-N 426.448 2.108 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 807289264 OEEXFOPSRVJHJU-JOCHJYFZSA-N 427.545 2.256 10 20 IECD O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NCc1cccc(Br)c1O 811459927 SCXXIVZXRBZUHB-UHFFFAOYSA-N 433.711 2.403 10 20 IECD COC(=O)c1c(F)ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1F 811793113 NWVGQIBHGYHKIS-UHFFFAOYSA-N 437.418 2.455 10 20 IECD COc1c([N+](=O)[O-])cc(N2C[C@@H](C)S(=O)(=O)[C@H](C)C2)c([N+](=O)[O-])c1Br 811865546 FPNDVAINJJVRTB-HTQZYQBOSA-N 438.256 2.286 10 20 IECD Cc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nnn1-c1ccn(C)n1 814408137 PHHRHVHDBKPNJJ-UHFFFAOYSA-N 431.447 2.309 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@@H]3CN(CC)c4ccccc4O3)nc12 917064598 JDMRYFILNLMBGS-MRXNPFEDSA-N 425.489 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](C(=O)Nc4ccccn4)C3)CC2)cc1 917397370 SQLRRCVQOKNQCL-IBGZPJMESA-N 437.544 2.090 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccc(F)cc3)cc2)C1 918118117 VYJOKIGAMDXZRD-UXHICEINSA-N 442.535 2.178 10 20 IECD NC(=O)c1csc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 920602293 IRFMHUKOKOKKPX-UHFFFAOYSA-N 434.429 2.418 10 20 IECD CCN1C(=O)c2ccc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc2S1(=O)=O 920882661 VUMVNPLNYORWFB-HNNXBMFYSA-N 443.525 2.179 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(N2C[C@H](C)O[C@@H](C)C2)ccn1 1116812574 HERQHSBQYYWMJO-DOXZYTNZSA-N 443.500 2.011 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)CC2)cc1 1253863602 LFBWAXZSUWKSCR-DEOSSOPVSA-N 436.512 2.201 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(F)c1F)C2)c1cc(O)nc(O)c1 1777852206 HWPSIZNYRVWQMS-OPAMFIHVSA-N 447.438 2.212 10 20 IECD C[C@@H]1C[C@]1(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1780622271 JUFVMGQFGBSNNL-HHAVMSMESA-N 444.528 2.377 10 20 IECD COc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1793327069 WLFMWTSRVGKSIV-BCDXTJNWSA-N 425.485 2.386 10 20 IECD CN1CCC[C@H]1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806422014 YGINSQFPRFZZGK-IWHGQQBYSA-N 443.544 2.142 10 20 IECD CC(C)n1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)n1 1821674685 YBXGVPAISOUJHK-LBPRGKRZSA-N 442.501 2.266 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1845789851 DGAKJFBEDRCBNX-LLVKDONJSA-N 426.853 2.130 10 20 IECD CCOC(CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)OCC 1846478834 IZVQJJOWRHGRLQ-UHFFFAOYSA-N 426.897 2.357 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H](C)NC(=O)C3CCCCC3)nc12 727530392 ADEZKQYVETYLSX-ZDUSSCGKSA-N 432.477 2.130 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c1 729534911 FPJCTJDSITZGPB-LLVKDONJSA-N 436.515 2.488 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cc(S(C)(=O)=O)ccc3F)cc2F)CC1 730194209 AFOWYLWEVFPPTN-UHFFFAOYSA-N 437.512 2.440 10 20 IECD CN(CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)Cc1ccc(N2CCOCC2)cc1 741733296 MJNRSZFTWXCTJV-UHFFFAOYSA-N 440.500 2.075 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(CS(C)(=O)=O)cc3)CC2)cc1 746676682 JLKCPPGVDJKRAY-UHFFFAOYSA-N 446.573 2.184 10 20 IECD CCC[C@@H](C)NC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 747836023 YIMHIMPGWKWCKX-UYAOXDASSA-N 448.583 2.295 10 20 IECD CCCNC(=O)[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 747836647 CENPBKFELHOVTD-NSHGMRRFSA-N 448.583 2.294 10 20 IECD O=C(NCCC(=O)N1CCCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065151 NHWZNMYPSAMHQQ-UHFFFAOYSA-N 437.543 2.387 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](C)N3CCc4sccc4C3)CC2)cc1 758208508 GSRLHSQQBYIFRA-DENIHFKCSA-N 444.645 2.276 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)N[C@@](C)(CCC=C(C)C)C3=O)CC2)cc1 758224483 VBDSHSAYSYBUOR-YKSBVNFPSA-N 444.576 2.235 10 20 IECD COc1cc(N2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)CC2)cc(OC)c1OC 760084632 NPGZLDHDYOACGV-UHFFFAOYSA-N 441.444 2.459 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](NC(=O)NC2CC2)C1 760897224 OSHAETLRCRESNP-RHSMWYFYSA-N 446.507 2.325 10 20 IECD O=C(NCc1cccc(Br)c1O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 765348467 PZCUWWNQFMECST-NSHDSACASA-N 429.296 2.033 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(Cc3nc(N)c4ccccc4n3)CC2)cc1F 766919606 URJNVSZCQXSLPZ-UHFFFAOYSA-N 437.523 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 778376415 PEHGWFQCAODQTF-VDZCTEQFSA-N 445.560 2.383 10 20 IECD O=C(NCc1ccc(O)c(O)c1)c1c[nH]c2ccc(I)cc2c1=O 778918660 NARIZOATSMPLFO-UHFFFAOYSA-N 436.205 2.474 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(-c4ccc(F)cc4C)nn3)cc2)CC1 786258309 BVNKOXNBEXMXRE-UHFFFAOYSA-N 436.491 2.313 10 20 IECD CCC(CC)[C@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)N1CCOCC1 787322387 QGCFXMBVQQGUDV-HSZRJFAPSA-N 430.593 2.108 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 787751196 KONBMFJLASLOOL-QHCPKHFHSA-N 436.556 2.093 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Br)cn1 788310223 JKQKELHYHOKKMG-CQSZACIVSA-N 447.333 2.174 10 20 IECD CCOC(=O)c1c(NC(=O)CN2C[C@@H](O)C[C@H]2C(=O)OC)sc(C)c1-c1ccccc1 788604979 YHCFPCFGHHTSJE-HOTGVXAUSA-N 446.525 2.447 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 788938390 RIIZPERCQGYWNW-QFIPXVFZSA-N 434.540 2.210 10 20 IECD COc1ccc(CNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c(O)c1 793032284 XSXAPHLKHHAOGG-UHFFFAOYSA-N 433.530 2.194 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1nc(C)cs1 793721181 QHVVADPRBDQGBZ-WMZOPIPTSA-N 443.573 2.037 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1[C@H]2CC[C@H]1[C@H](CO)C2 794108375 GKJSJWTXPOLKEU-YEWDVWPNSA-N 447.469 2.087 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c(O)c1 797389577 ONLRRPONCCACNA-UHFFFAOYSA-N 431.342 2.330 10 20 IECD CCCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H](COC)C(=O)O 797710128 SRUQGXOSVZWCOQ-DOXZYTNZSA-N 425.501 2.461 10 20 IECD C[C@@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CN1C1CC1 803451094 DPADPPUHAFNPMK-GDBMZVCRSA-N 436.503 2.114 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)c3cccc(C(F)(F)F)c3)nc12 803809375 XYVAWXIWFGWOPU-HNNXBMFYSA-N 439.346 2.407 10 20 IECD O=C(NCCC(=O)N1CCCCCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 804080532 LRTAEOCXIKPDQW-UHFFFAOYSA-N 427.501 2.423 10 20 IECD COCCCN(Cc1ccncc1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804318077 YOYXODGXRHKAIS-UHFFFAOYSA-N 440.544 2.241 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3CN3CCCCC3)CC2)cc1 804319156 JODPSQISGFCKCS-NRFANRHFSA-N 428.577 2.257 10 20 IECD O=C(N[C@@H]1CCCC[C@H]1N1CCOCC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806090353 JVVHGYRNDFMPCH-NHCUHLMSSA-N 441.528 2.274 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)c1c(F)cccc1F 806276070 GFWYOMPAKWTEET-AWEZNQCLSA-N 428.530 2.439 10 20 IECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)[C@@H](C)C1 807953928 BOGAUTZAFIZPFA-HOTGVXAUSA-N 434.968 2.272 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3cscc3C)CC2)cc(OC)c1OC 809407478 BTTGYZKTVGCYKS-UHFFFAOYSA-N 433.530 2.047 10 20 IECD COC[C@@H](C)[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 812623296 QLRWURSQVMQPGH-UKRRQHHQSA-N 436.530 2.386 10 20 IECD COc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CCCC1 916595336 CCBAQDJYELNTNE-UHFFFAOYSA-N 449.481 2.367 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 917832997 JVCRDQXJQDYJHP-HNNXBMFYSA-N 449.960 2.375 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 918284892 UATHDILSYHZQIH-UHFFFAOYSA-N 436.827 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C\c3ccc(OC)c(O)c3)CC2)cc1 919560843 MNXVGCFTPTZUPT-WMZJFQQLSA-N 426.469 2.315 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920922944 LBFJEFPLTWEBEE-MRXNPFEDSA-N 445.541 2.051 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1cccc(C(F)(F)F)c1 1117143997 WUDXRAIMVIEFMJ-WMLDXEAASA-N 427.375 2.441 10 20 IECD Cc1cscc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505547 LCMVQUMTEGFLTO-WTCGPSRQSA-N 444.509 2.330 10 20 IECD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1796932700 SNJOECVGGZVBHZ-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])[nH]1 1799481095 NNTLBKUXHXAMBY-ITJFMEAMSA-N 442.428 2.005 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cn(C)cn2)C3)cc1 1799620628 XWRVWIASXJWJHV-JHDGKUDLSA-N 447.539 2.345 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)N1C[C@H]2C[C@H]2C1 1800718449 YNENQVZHHNNNFZ-NSCXZMNLSA-N 433.936 2.343 10 20 IECD O=C1C[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1830740033 GKPSFERPYHFRRQ-NVXWUHKLSA-N 449.935 2.121 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1 1832096846 BJHXSNIZZYGBIW-WRFKIARRSA-N 425.489 2.163 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441265 JKXFVYXNAXLDEZ-UHFFFAOYSA-N 438.509 2.367 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c(O)c1 1843443279 UVEQMFDEZKSFOB-UHFFFAOYSA-N 432.480 2.311 10 20 IECD O=C([C@H]1COc2ccccc2O1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500772 NFQVRWWUVRHUQT-GOSISDBHSA-N 444.871 2.408 10 20 IECD Cc1cc2cc(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)ccc2[nH]1 1847055653 OETGOVQGEPTJKS-UHFFFAOYSA-N 442.566 2.154 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2ccccc2)CC1 1847525519 LETQDONPTBYQDZ-PMACEKPBSA-N 436.512 2.225 10 20 IECD CC(C)c1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1[N+](=O)[O-] 727177392 HMCNHODOAYBZNW-NTEUORMPSA-N 429.545 2.469 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1C 728760115 ADNUHKRFADUNPS-UHFFFAOYSA-N 425.485 2.468 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC(C(=O)NCCO)CC3)c2C)cc1 728916194 YURCHHOTDXAQLT-UHFFFAOYSA-N 427.545 2.496 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1 729062384 ACIVIUXDKKOQQE-YJYMSZOUSA-N 427.457 2.334 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C(=O)OC)Oc3ccccc32)cc1F 731408642 ALLHVKDXZJNTAR-FQEVSTJZSA-N 443.475 2.255 10 20 IECD Cc1cc(C(=O)CN2CCC(n3ccnc3)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 731847605 XVTXALJMPMVUGH-UHFFFAOYSA-N 441.557 2.458 10 20 IECD CCN1CCC[C@H]1CN1C[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 733131732 HIIXRVVPJVCKPX-FPOVZHCZSA-N 430.618 2.189 10 20 IECD COc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)cc(NS(C)(=O)=O)c1OC 742596989 HVQXTYJRFIONQH-UHFFFAOYSA-N 433.530 2.388 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C)c(C(=O)N(C)C)c3)CC2)cc1 751819518 VPPBGFNOYLVFQZ-UHFFFAOYSA-N 438.528 2.383 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 752727044 SVKHOYQNQVLCAZ-OAHLLOKOSA-N 442.491 2.180 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3N3CCOC3=O)CC2)cc1F 754215904 QLPZJQWOEOZDAJ-UHFFFAOYSA-N 442.447 2.078 10 20 IECD COC(=O)c1nn(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(C)c1Cl 758966498 WSTHTSLDRBJFDM-UHFFFAOYSA-N 438.912 2.437 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)c1 760557112 UVTRAMVCEPBCKF-QGZVFWFLSA-N 435.571 2.111 10 20 IECD CC1(C(=O)OCC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)CC1 761441477 HFZZYMTYGKWPHD-DHDCSXOGSA-N 448.522 2.076 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nccn3-c3ccccc3)CC2)cc1 766036186 YYQABSWCSHFOSH-WJOKGBTCSA-N 438.553 2.478 10 20 IECD COC(=O)C[C@]1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCOC1 770691299 GEWNPULLYUZMJP-XMMPIXPASA-N 436.464 2.102 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nc4c(s3)COCC4)CC2)cc1 778256658 LTQKPYCKYSUKHJ-VOTSOKGWSA-N 428.514 2.068 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnn(CC(F)F)c3)ccc21 778904963 YNGWXBNOQSWLNO-UHFFFAOYSA-N 440.472 2.485 10 20 IECD COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785293736 ICOMWMDFVGGTFF-ZDUSSCGKSA-N 430.457 2.358 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1 785574305 NMUNUNYDOBYNIK-HSZRJFAPSA-N 438.572 2.291 10 20 IECD Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785994803 OWKPABOAHQXISM-CQSZACIVSA-N 425.485 2.232 10 20 IECD COc1cc(N2CCN(S(=O)(=O)Cc3csc(C)n3)CC2)cc(OC)c1OC 790436370 JLHSUBKVSHHDAF-UHFFFAOYSA-N 427.548 2.129 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)cc1C 796710466 UIUZBLXZSLZVMR-SFHVURJKSA-N 438.528 2.269 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn4c(n3)CCCC4)cc2F)C[C@H](C)O1 799587462 ZEPCCQWHKYNTQO-HOTGVXAUSA-N 444.507 2.445 10 20 IECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 799833738 AGTSFHCDRUJMNN-UHFFFAOYSA-N 449.529 2.043 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3S[C@@H](C)C(N)=O)CC2)cc1 801089694 QUYFVQRRQWHKRH-KRWDZBQOSA-N 442.585 2.213 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@](C)(O)CCc3ccccc3)CC2)cc1 801491685 PMXPSVPKOCZRFT-DEOSSOPVSA-N 426.513 2.271 10 20 IECD CN(C[C@H]1CCCC[C@@H]1O)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449008 LEBPIVBUAIHXAN-BEFAXECRSA-N 439.503 2.383 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3nc(C)cs3)CC2)cc1F 804853016 RRSPQZRXBYKJCG-UHFFFAOYSA-N 433.553 2.402 10 20 IECD O=C(NC[C@H](N1CCOCC1)C(F)(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 807540667 BIYYOTPNSUOAHR-AEFFLSMTSA-N 431.455 2.346 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12 807768440 JRAKZYDLDMPDHN-UTRMSSBJSA-N 437.487 2.447 10 20 IECD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1F 810489057 HDRUGOPRYKFDRF-UHFFFAOYSA-N 435.521 2.078 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(F)(F)[C@H](CO)C1 812643038 JONKQMLAGUGVJU-NSHDSACASA-N 432.470 2.344 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(c4ccccc4)C3=O)cc2)CC1 816379165 IUHSCDYSSHWXLN-QHCPKHFHSA-N 434.540 2.415 10 20 IECD C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccc(S(N)(=O)=O)c1 916197510 VVYYOCYBUQTMNV-CRAIPNDOSA-N 433.530 2.491 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc2c1OCCO2 917832773 GTJOVKLAQGJQMI-INIZCTEOSA-N 425.485 2.098 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(OCCN(C)C)c3)CC2)cc1 918461447 CMZZEGWMBSXNAE-UHFFFAOYSA-N 440.544 2.313 10 20 IECD O=C(CCn1cnc2sccc2c1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971131 PXPMLQCJPWCPHY-UHFFFAOYSA-N 430.505 2.265 10 20 IECD NC(=O)NC1CCC(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 920601826 KPNMOPVZIINLDC-UHFFFAOYSA-N 449.463 2.171 10 20 IECD CCCS(=O)(=O)CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 920631372 ZBPDQWVUOBGGDH-CYBMUJFWSA-N 443.477 2.157 10 20 IECD Cc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1780584047 RHYUAQYUVYHJRX-UMESLIDUSA-N 438.480 2.269 10 20 IECD NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788674141 SXFVJOTVMPVRKR-UHFFFAOYSA-N 447.495 2.179 10 20 IECD CCc1[nH]nc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1F 1807844440 LJLVBNLIBRKVPQ-UHFFFAOYSA-N 431.468 2.076 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCSC1)CC2)c1cc(O)nc(O)c1 1816729246 YGDXBMQFWAAPCD-ZYHUDNBSSA-N 434.543 2.318 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847000 GTSVJTNSWZKDJE-BXUZGUMPSA-N 447.448 2.083 10 20 IECD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825300252 WGTFWDCDANZGGQ-CYBMUJFWSA-N 440.481 2.123 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)c2ncc[nH]2)CC1 1825637711 CQPVDDKUTMENNF-HXUWFJFHSA-N 448.527 2.436 10 20 IECD CC(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740778 WMLPTMOLVLFDHD-KRWDZBQOSA-N 437.924 2.121 10 20 IECD CCO/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1832053282 IBQQLDAPESFWIN-RCLKMUNOSA-N 439.603 2.017 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 1847607464 RIMAPZAIKOGCAO-BODMPHMZSA-N 429.423 2.390 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc(S(=O)(=O)N(C)C)c1C 108809442 JQZQJQVJHABTRP-UHFFFAOYSA-N 431.558 2.320 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1 109701876 KUTJEGJKXWEQIY-JTHBVZDNSA-N 449.555 2.380 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1OC 437018856 AEMPJBSFBMUBQA-UHFFFAOYSA-N 434.514 2.359 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1F 498015402 JOJXWKLKSAAJTJ-UHFFFAOYSA-N 443.522 2.241 10 20 IECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c(C(=O)OC)s1 726602132 AASZOJJEAFKMDG-UHFFFAOYSA-N 426.516 2.208 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3COc4c(cccc4OC)C3)CC2)cc1 728396984 JQUMZLMLHIXBKP-LJQANCHMSA-N 440.544 2.129 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)n2)c[nH]1 734975405 CXSOYKRXRTVNEI-UHFFFAOYSA-N 432.483 2.012 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(NCc3cccc(OC)c3O)CC2)cc1OC 735508482 BGZIVOMQKJISIH-UHFFFAOYSA-N 436.530 2.361 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1OC 749144698 ZRYDIYBQECPMEB-UHFFFAOYSA-N 432.451 2.095 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC(C)(C)C)o3)CC2)cc1F 753737546 GBETXPCVPRINKG-UHFFFAOYSA-N 439.509 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc(N4C(=O)CNC4=O)c3)CC2)cc1F 753839826 KKDNIJXWRMDIMG-UHFFFAOYSA-N 427.436 2.245 10 20 IECD CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)n1 753859904 AOLROMDTYMKQRX-UHFFFAOYSA-N 436.509 2.157 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC(C)(C)C(=O)Nc3ccccc3)CC2)cc1 754063732 MBZIICWVCUCXJH-OAQYLSRUSA-N 426.561 2.185 10 20 IECD C[C@H](NC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O)c1ccc(N2CCOCC2)cc1 756946383 DOJWEPXBPRPESP-KURKYZTESA-N 442.560 2.447 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3ccc(S(C)(=O)=O)cc3)CC2)cc1 758216592 MEEBZKAJUMCCPE-GOSISDBHSA-N 436.599 2.374 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)CC2)cc1 764391576 ZFIYZSGNNZXCHU-CVDCTZTESA-N 429.609 2.331 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(Br)nc1 766328272 RJTIJPDZYXUUSW-UHFFFAOYSA-N 437.269 2.075 10 20 IECD CN1CCCc2cc(CNC(=O)NCCOc3ccc(NS(C)(=O)=O)cc3)ccc21 773787942 NKSVATGXMJSUKB-UHFFFAOYSA-N 432.546 2.319 10 20 IECD CN1CCN(c2ccc(CN3CCN([C@@H]4CCN(c5ccccc5)C4=O)CC3)cc2)CC1 775695599 OIQLCGDUGKHYMN-RUZDIDTESA-N 433.600 2.362 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC 784026191 RRJVDCLTTXLFQH-UHFFFAOYSA-N 425.485 2.305 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CC2)cc1 785610499 XSFATDZVXSETOZ-PWRODBHTSA-N 442.604 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](C)NC(=O)C3CCCCC3)cc2)CC1 786262992 RGYYDTCADODXLQ-SFHVURJKSA-N 428.577 2.446 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3nnnc3CCCc3ccccc3)CC2)cc1 788433482 BDWDSZKONVDXJW-JOCHJYFZSA-N 436.560 2.040 10 20 IECD CC(C)C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789847841 WVFGPHCQQSWGMY-IEBWSBKVSA-N 435.540 2.113 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)c2ccccc2OC(F)(F)F)c1 794259064 GJSFYHCFKAHXTO-ZDUSSCGKSA-N 434.392 2.126 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)cc1F 803663910 AJEKHPVAYDSVSQ-UHFFFAOYSA-N 432.540 2.195 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 804317570 IACFZWPTQJRKSI-HBMCJLEFSA-N 427.545 2.244 10 20 IECD CCC(=O)N1CC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 807840800 KFUHANQQTZKQQY-SFHVURJKSA-N 426.517 2.002 10 20 IECD CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H]2C[C@H]21 814338623 RKJDAYSHMHYJHG-CUDHKJQZSA-N 442.560 2.402 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc1 917129039 NTWYMXWSRYRYPQ-UHFFFAOYSA-N 428.964 2.409 10 20 IECD CN(C[C@H]1COc2ccccc2O1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117867 RLVWLORFUVURPA-QUCCMNQESA-N 438.528 2.370 10 20 IECD CCOC(=O)CC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918118312 YICPFJMRFXCOBR-LJQANCHMSA-N 430.549 2.263 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)N2CCCCC2)CC1 918224964 XOBGAEDBNDZVIP-UHFFFAOYSA-N 433.528 2.095 10 20 IECD CSc1nc2nc(C)c(CC(=O)NCc3ccc(N4CCOCC4)cc3)c(C)n2n1 919767117 DBRMSEKVHMHSBE-UHFFFAOYSA-N 426.546 2.159 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCCOC1 919782053 BUYBHEICTPJNBY-SFHVURJKSA-N 428.512 2.168 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 920196334 QDDGHGSYILGTKU-UHFFFAOYSA-N 431.876 2.218 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(C(=O)N(C)C)c3)CC2)cc1 1320344116 HBXCZWLPYMKUOT-UHFFFAOYSA-N 447.557 2.307 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@H]21 1801327184 KUDCAIUGHWJNAO-FJEYYCIESA-N 428.510 2.330 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1F 1803972844 WDRMEAPCMZKYDH-YNFBMLRVSA-N 449.486 2.238 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C(F)F 1816837049 CFGAJCLTOGTATO-HNNXBMFYSA-N 430.415 2.460 10 20 IECD COCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826619112 VSDKBCRBJXKHTQ-IWHGQQBYSA-N 432.517 2.473 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831913186 IMNBWVQRQPHMTC-SBYGZDSISA-N 432.517 2.471 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cn2nnc3ccccc32)C1 1841816720 FNXTXKNZOGPSLS-UHFFFAOYSA-N 441.875 2.013 10 20 IECD CCc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 32413441 JUFAHXGOZBJMKW-UHFFFAOYSA-N 431.558 2.266 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 110469906 FCJFERZSMBBGKV-UHFFFAOYSA-N 432.546 2.072 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCN([C@H]4CCS(=O)(=O)C4)CC3)c2C)cc1 216004971 YUVYRSPLCDBSQW-NRFANRHFSA-N 429.586 2.390 10 20 IECD COc1ccc(C(=O)NCCNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726706758 INLUTWTXJSNWGU-UHFFFAOYSA-N 426.517 2.402 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCO1 727601100 QGSNTKVJYVZUBV-KRWDZBQOSA-N 428.512 2.263 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC3(C(=O)N(C)C)CCCC3)cc2F)CC1 733352912 KADZUASJFJPVJX-UHFFFAOYSA-N 433.572 2.415 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cnc2c1c(=O)n(C)c(=O)n2C 747871884 YXDVHLAOWHRSJH-UHFFFAOYSA-N 435.528 2.107 10 20 IECD CN(C)C(=O)c1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1F 752718354 AIJQGFQJJSXDKO-UHFFFAOYSA-N 448.520 2.084 10 20 IECD O=C(NCC1CCS(=O)(=O)CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 756134659 OEFJMQXNOKKHNQ-UHFFFAOYSA-N 431.505 2.381 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNCc3ccc(-n4ccnc4)c(F)c3)CC2)cc1 758201809 FJYGYVMCLCSPAS-OAQYLSRUSA-N 439.535 2.293 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccn(Cc2ccccn2)n1 759027652 NACWXULUHHTBSR-UHFFFAOYSA-N 436.541 2.135 10 20 IECD O=C(NCc1cccc(Br)c1O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 765348466 PZCUWWNQFMECST-LLVKDONJSA-N 429.296 2.033 10 20 IECD COCc1ccc(NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 772853362 DLRKXIUSIUFORW-UHFFFAOYSA-N 440.544 2.109 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1NS(C)(=O)=O 774278994 YUCGLEPKFYBHPU-UHFFFAOYSA-N 431.514 2.206 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1cc2ccccc2[nH]1 777829369 UYMIWIQZLVSMGO-UHFFFAOYSA-N 429.860 2.459 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780409609 XPGGTRAMEWBGDZ-UHFFFAOYSA-N 431.514 2.333 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1CN1CC[C@@H](O)C1 781797102 YWLCNXYASRSHSH-OAQYLSRUSA-N 442.535 2.228 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccn(CCCOC)n1 785193826 HKZLPMLXIVOMQO-UHFFFAOYSA-N 439.310 2.375 10 20 IECD COC(=O)CSCc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785292841 AUEJRRGPNFDWKB-ZDUSSCGKSA-N 432.498 2.190 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2cncn2)cc1 785398757 ONKWZNGIONSWFT-LAUBAEHRSA-N 449.511 2.358 10 20 IECD Cc1ccc(Br)nc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 786796232 CSOFKHRCRKQYJD-UHFFFAOYSA-N 438.347 2.317 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]1c1ccncc1 789841255 VTASERHRDVKMQT-HXUWFJFHSA-N 426.492 2.162 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)COc3ccccc3)cc2F)CC1 793684413 APOFZZUBUDQXJV-SFHVURJKSA-N 442.535 2.168 10 20 IECD C[C@H](NS(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1)c1ccc(N2CCOCC2)cc1 799765706 IRVRATRWDVNEJN-ZDUSSCGKSA-N 448.936 2.396 10 20 IECD CC(C)(C)OC(=O)NCC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807287901 NQDXREOGMGTQDM-UHFFFAOYSA-N 442.560 2.442 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(CN2C(=O)CCC2=O)cc1 919969223 ZFRUSRXBKWXGFZ-UHFFFAOYSA-N 435.524 2.474 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(N2CCOCC2)cc1 920920650 OYQQHRIFLJYTCU-LJQANCHMSA-N 438.576 2.230 10 20 IECD CN1CCN(c2ccc(CN3CCCC[C@H]3COC(=O)N[C@H]3CCOC3)cc2F)CC1 1261181801 DNSLOLCVJYDOIA-PMACEKPBSA-N 434.556 2.447 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](NC(=O)c1ccc(C)cc1)C(C)C 1321048915 PDCOXKIDXRASGI-RXVVDRJESA-N 442.512 2.451 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)C(=O)NCC(F)(F)F)cc2F)C[C@@H](C)O1 1337686457 UTXRQRSUMUPRDK-FRRDWIJNSA-N 434.434 2.306 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1 1342435956 XLVXRMGDBQCFNP-OALUTQOASA-N 430.476 2.492 10 20 IECD Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cs1 1782004702 KGWDZHLNFCUQDE-IBGZPJMESA-N 437.905 2.273 10 20 IECD CCC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425451 QSKMXBRIBPNLKN-CYBMUJFWSA-N 426.473 2.155 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1F)C1=NN(c2ccccc2)C(=O)C1 1798991178 RSSZIWIMEIAIBK-ACHSLPGTSA-N 435.459 2.265 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H]2C[C@@H](O)C2)C3)cc1 1799620342 FXAVDCHEOSGJBM-UUFWWEFBSA-N 437.540 2.068 10 20 IECD CCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806028389 AEOMXHVMJXGNBJ-VLIAUNLRSA-N 437.456 2.072 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnnc(Cl)c1 1816021738 HIIYCPDZHSASBS-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CC1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362208 QSDMVLZHGMDHHI-LBPRGKRZSA-N 441.488 2.350 10 20 IECD CCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826097366 FYZMBALBZILGKD-KRWDZBQOSA-N 427.505 2.256 10 20 IECD CCCNC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423793 HSWUZAOXGUCOLL-SFHVURJKSA-N 446.548 2.033 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n(C(F)F)n1 1844788537 XEFCRXIRKPWNQL-GQCTYLIASA-N 448.426 2.234 10 20 IECD O=C(c1ccc2[nH]ccc2n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037318 KFXANSYBSYFHGE-XVNBXDOJSA-N 434.452 2.210 10 20 IECD CCOC(=O)c1cnn2c(C(=O)Nc3ccc(NC(=O)C4=S=CC=C4)cc3)ccnc12 486231927 BMPZNMATZAPONS-UHFFFAOYSA-N 435.465 2.374 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)n(C)c2ccccc12 573636658 QASSLQOKSABBSP-OALUTQOASA-N 439.604 2.120 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1 728980261 YZRUDDMPFXNJRJ-WMLDXEAASA-N 434.514 2.349 10 20 IECD CN(C)C(=O)c1cc(=NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc[nH]1 731983946 UMIOLPDNLMTRMU-UHFFFAOYSA-N 435.507 2.073 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)c1 734073787 DAPCEWVOMPUFOA-UHFFFAOYSA-N 432.498 2.372 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](c4nnc5ccccn45)C3)CC2)cc1 738316176 ALCFUJPIQOYADP-IBGZPJMESA-N 434.544 2.266 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](CN2CCOCC2)C1 741811020 XCBSGYCLYBOFCP-ZWKOTPCHSA-N 447.535 2.443 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 745944093 OKZATDYQYUTZMY-IBGZPJMESA-N 432.565 2.285 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](Cc4cnn(C)c4)C3)cc2F)CC1 746759961 JUCMZTJFGLEILR-LJQANCHMSA-N 428.556 2.475 10 20 IECD C[C@H](O)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 747615883 BFCCEIWYUNLQME-KBPBESRZSA-N 449.485 2.334 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3cc(S(N)(=O)=O)cn3)c2C)cc1 749328142 ZNACWBBDKKZTHD-UHFFFAOYSA-N 444.513 2.063 10 20 IECD NC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 752005526 SYJHXBAVQPVWFB-UHFFFAOYSA-N 426.395 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(CCS(C)(=O)=O)C3CC3)cc2F)C[C@H](C)O1 753572327 NIMJVWMJRVVVDI-GJZGRUSLSA-N 427.542 2.158 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC3(C(=O)OC(C)(C)C)CCCC3)CC2)cc1 754070530 ZDFPSDOVPNRWBX-HXUWFJFHSA-N 433.593 2.422 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4ccc(Cl)cc4c3=O)CC2)cc1 758189427 AAUUKWYVCDCRQF-GOSISDBHSA-N 428.920 2.242 10 20 IECD C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765981496 VJMCORPAPYUEGG-CVDCTZTESA-N 428.602 2.317 10 20 IECD CCOc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769022573 FHJUTPBOBIHROX-UHFFFAOYSA-N 437.544 2.267 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 769748712 JXOLIAKDPFCQAZ-INIZCTEOSA-N 435.527 2.226 10 20 IECD CCCCn1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)n1 770493216 APJXVLGNEMWUDZ-UHFFFAOYSA-N 432.496 2.441 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl 772982166 UFKYIXVQSOEYCG-AEFFLSMTSA-N 446.013 2.316 10 20 IECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OCC(=O)N(C)C)c1 773858449 QMKFFHXRQUYDEC-INIZCTEOSA-N 426.517 2.344 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 774750228 IDCPYKFPLYKQHE-UHFFFAOYSA-N 436.556 2.231 10 20 IECD Cc1cc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1S(N)(=O)=O 775226760 VKQAMJKOZCQKHG-GOSISDBHSA-N 433.530 2.239 10 20 IECD CCOCCCN1CC[C@@H](NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 775926782 AGRUFHMIXPOFJX-NZQKXSOJSA-N 432.609 2.070 10 20 IECD C[C@H](c1ccccc1)N(CC(=O)NCCCN(C)S(C)(=O)=O)Cc1ccccc1O 776004414 PFIJVSVCTLRVOM-GOSISDBHSA-N 433.574 2.353 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 779490077 WWRJCOXSXIOACN-QHHAFSJGSA-N 440.880 2.437 10 20 IECD CCN(Cc1ccc(CN(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317893 AILLQODQTGZACK-UHFFFAOYSA-N 438.572 2.250 10 20 IECD CCC(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCCC1 788318951 AGJILJAPYXIWPH-QFIPXVFZSA-N 430.593 2.156 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 788910461 LCZGQUMFCDXNSQ-DHIUTWEWSA-N 437.540 2.254 10 20 IECD CCCN1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789819100 LMDCGUGUQWZSEM-HDICACEKSA-N 448.583 2.294 10 20 IECD COC1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789819483 NLEDUWVLQRJOBD-HNXFYBAISA-N 435.540 2.377 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789855650 VFWLPLQNBGTMCM-CEXWTWQISA-N 432.634 2.339 10 20 IECD CN(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Cc1ccccc1 789856966 ZNARNTOWLPVRFZ-UHFFFAOYSA-N 426.586 2.104 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ncccc3F)cc2F)C[C@H](C)O1 795787543 RNGHZCYAJHHWIU-GJZGRUSLSA-N 433.455 2.376 10 20 IECD CCS(=O)(=O)c1ccc([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 803774814 NBFVFPIGLMBKGV-LBPRGKRZSA-N 426.516 2.048 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@H](CC(C)C)C3)cc2F)CC1 805006813 GYUHGOBXOYIYHK-WOJBJXKFSA-N 448.583 2.294 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 806330264 LNMBPQCVSCXPGE-MRXNPFEDSA-N 426.355 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc(C4CCOCC4)cs3)CC2)cc1F 806934202 CRVMOZHBCXUNRC-UHFFFAOYSA-N 448.520 2.472 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](c2nc(O)n[nH]2)C1 808777916 ZXFXKIPJZPQKOX-KBPBESRZSA-N 445.479 2.492 10 20 IECD CCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854109 QDDAQUISWVANBY-UHFFFAOYSA-N 435.572 2.279 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](O)c3cnn(C)c3)c2C)cc1 809555150 BREOWNNUAAIFSI-FQEVSTJZSA-N 425.441 2.074 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)OC4(CCCC4)C3=O)cc2F)C[C@H](C)O1 810022949 MGZVCOZHGCCKCJ-GJZGRUSLSA-N 433.480 2.347 10 20 IECD C[C@]1(c2ccccc2)OC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 810025879 JNRRZSYZFQYOLI-HSZRJFAPSA-N 441.459 2.173 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CNS(=O)(=O)c1ccc(Br)cc1 810410737 CXYLHDCUVCZERT-UHFFFAOYSA-N 440.363 2.418 10 20 IECD COc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918213462 LOTYKBRUPWPUAS-UHFFFAOYSA-N 428.558 2.478 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc2c1O[C@H](C)C2 918340542 RQWAMPSYGJAKTG-OAHLLOKOSA-N 430.526 2.183 10 20 IECD CCN(CC)c1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 918702243 RIESMBVTSHSIFC-UHFFFAOYSA-N 446.573 2.476 10 20 IECD O=C(COC(=O)CCOc1ccc(F)cc1)NCc1ccc(N2CCOCC2)c(F)c1 919071254 NIQFTEQGVUZKJD-UHFFFAOYSA-N 434.439 2.430 10 20 IECD Cc1ccc([C@@H](C)C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1783309329 AJZHKMHOVNHONP-WAIKUNEKSA-N 425.485 2.048 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2cccnc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995041 WXTVHBFRGFBUHN-MBSDFSHPSA-N 447.495 2.235 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808467659 JFSAAOJNFFDKKJ-HNAYVOBHSA-N 441.438 2.145 10 20 IECD O=C(c1ccn2cncc2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546502 HGWLQNPGUJXCPY-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc(O)nc(O)c1 1817842766 NHMYFYXSDKBYOO-LBPRGKRZSA-N 442.388 2.337 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1C[C@H]2CC[C@@H]1O2 1822212478 QFTUFEVMACGXKC-XOUADPBQSA-N 427.461 2.089 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C1=S=C(NC(=O)c2ccco2)C=C1C 505146502 UJKQXYKWEHMSCR-HNNXBMFYSA-N 446.550 2.374 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1 728985305 WGIUSRSAXNEHIQ-OAHLLOKOSA-N 434.514 2.221 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CNC3(c4ccc(OC)cc4)CCOCC3)nc12 730933477 DQPLBDIVFVYUAC-UHFFFAOYSA-N 426.473 2.416 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(F)(F)Oc3ccc(C=O)cc3)CC2)cc1 731620022 PCYXMZVGUPKYMS-UHFFFAOYSA-N 433.455 2.418 10 20 IECD COc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc(OC)c1OCC(N)=O 731857280 ZAJPLIOAWLSQQJ-QGZVFWFLSA-N 444.484 2.095 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)c1O 737284455 MYXXRSCOZGJWGO-UHFFFAOYSA-N 443.525 2.153 10 20 IECD COCCOc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738912035 CUXXYBWZDAFSRQ-UHFFFAOYSA-N 433.530 2.268 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@H](S(C)(=O)=O)C3)cc2F)CC1 741086036 CIRIXFZSYSNSJV-ROUUACIJSA-N 440.585 2.123 10 20 IECD CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCOCC1 742049899 HMACMLJIYPPRFL-IRLDBZIGSA-N 430.593 2.142 10 20 IECD C[C@H](CCN(C)C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748363240 LHBFJJBKOGKCLN-CYBMUJFWSA-N 436.490 2.171 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3cc(C)cc(C)c3)CC2)cc(OC)c1OC 759406939 YXPBAOMTYPTPFB-UHFFFAOYSA-N 441.528 2.408 10 20 IECD C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 761609729 FIGDGZMLFXSDQE-HUUCEWRRSA-N 449.529 2.260 10 20 IECD CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)cn1 766337352 XCIYLSVLQUBWLY-UHFFFAOYSA-N 429.521 2.235 10 20 IECD Cc1cc(F)cc2c(=O)c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c[nH]c12 768959523 UVDNBRBAINELSN-UHFFFAOYSA-N 443.500 2.140 10 20 IECD CC(C)(C)OC(=O)N1CC=C(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 779273737 SRLPYYXOGNESLY-UHFFFAOYSA-N 425.507 2.061 10 20 IECD COc1ccccc1[C@H](CO)NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 782064307 RTXIVICGYPTDPX-LZJOCLMNSA-N 445.535 2.387 10 20 IECD Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 782105641 BYEGUQMMVKYBSZ-SFHVURJKSA-N 433.512 2.433 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1OCCC(N)=O 783317039 SWWVVMOXIKWCKC-UHFFFAOYSA-N 426.517 2.383 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)C1CCOCC1 788310214 JHSOGTVWSLONAC-QHCPKHFHSA-N 437.540 2.424 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](N4CCCCC4)C3)cc2F)C[C@@H](C)O1 789824203 GWGXQFFTFJLQLD-WSTZPKSXSA-N 446.567 2.142 10 20 IECD CCCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793723821 NLTIVXMZWYGHLD-OAQYLSRUSA-N 436.556 2.443 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743778 RQLODLGYHMBZSR-QHCPKHFHSA-N 438.572 2.209 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)cn1 795586791 GTQGUMGMIIKTBX-UHFFFAOYSA-N 426.498 2.383 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ncccc3F)cc2F)C[C@@H](C)O1 795787544 RNGHZCYAJHHWIU-HUUCEWRRSA-N 433.455 2.376 10 20 IECD COC(=O)Cn1ncc(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1C 796745135 KXXLFHDBKOVIMC-UHFFFAOYSA-N 441.532 2.388 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@H]1NC(=O)OC(C)(C)C 803686992 SLDUTVPJBDYEJW-VQIMIIECSA-N 444.576 2.447 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 804650967 CXUDSDSZXOVDGD-GOSISDBHSA-N 430.476 2.406 10 20 IECD COc1cccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 805477574 LISXJHHDRKUSSE-HXUWFJFHSA-N 434.540 2.473 10 20 IECD CNc1nc(C)cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 805622084 PDJJFVQVZUNXMF-UHFFFAOYSA-N 430.420 2.398 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(N(C)C)cc1 807469630 JNWGFWISIHWPSA-YYDVJCTNSA-N 438.572 2.336 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)CS(C)(=O)=O)cc2Cl)C1 807952539 NKQIQGHEIIVUGL-LSDHHAIUSA-N 443.997 2.084 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918311964 XIEALBPMTHSDJI-UHFFFAOYSA-N 427.501 2.146 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 920869802 ANCIKHAYQSFTBO-KRWDZBQOSA-N 438.594 2.088 10 20 IECD CCN(CC)[C@@H](CN/C=C1\C(=O)NC(=S)N(CCOC)C1=O)c1ccccc1Cl 920979393 KTNNAKFQXOQJBS-VMEIHUARSA-N 438.981 2.086 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnc4c(cnn4C)c3)cc2F)C[C@@H](C)O1 1320440748 PUNIKCDXFRWMHU-OKILXGFUSA-N 433.509 2.200 10 20 IECD Cc1cccc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787294510 UYJGULLSBYMIEQ-SZMVWBNQSA-N 425.485 2.017 10 20 IECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1794634214 IWXCWXHXDTWPPK-CHWIUSCQSA-N 444.509 2.090 10 20 IECD COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1OC 1796604281 YQXOCNDPEIRTDK-MUJYYYPQSA-N 441.484 2.384 10 20 IECD Cc1cccc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1800556272 DENFFPAWMNOCCB-MUJYYYPQSA-N 431.583 2.416 10 20 IECD CCOCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146386 FZRIGVMEGGXEOE-SFHVURJKSA-N 438.488 2.231 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cn2ccccc2n1 1818495627 KTLGEVIKVGIWBK-INIZCTEOSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cnc[nH]2)CC1 1825132996 NBPZCFHTDIXAMW-SFHVURJKSA-N 427.505 2.082 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cnn(-c4ccccc4)c3)CC2)cc1 25643943 GJOYMHJPYNUMPE-UHFFFAOYSA-N 434.496 2.315 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CN3C(=O)[C@H](C)Oc4ccccc43)cc2F)CC1 303313695 PTIXRYVAISLWCL-KRWDZBQOSA-N 440.519 2.398 10 20 IECD Cc1nnnn1-c1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1F 727946300 CQHIXBAKLYOQQH-UHFFFAOYSA-N 437.479 2.306 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4[nH]c(C)cc4c3)CC2)cc1 737159555 UDDCXOWMJGRNLC-UHFFFAOYSA-N 435.528 2.362 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Cc3cc(F)cc4c3OCOC4)CC2)cc1 742927396 QEAWGRCNTIQATD-UHFFFAOYSA-N 429.492 2.182 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1C 746786987 PEBSQPPNVOCZCL-UHFFFAOYSA-N 425.485 2.468 10 20 IECD CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 747095981 MWPMPLSCTGCKQC-UHFFFAOYSA-N 439.560 2.378 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] 751237578 QLMFUAHUZWOPEV-UHFFFAOYSA-N 435.502 2.291 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCO[C@H]([C@@H]2CCCO2)C1 757425493 MHJYULLDGIPZMF-IRXDYDNUSA-N 438.527 2.275 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nc4nc(C)cc(C)n4n3)CC2)cc1 758183564 BANXCXZBUUCPET-GOSISDBHSA-N 428.562 2.025 10 20 IECD COc1cc(N2CCN(c3cc(C(F)(F)F)nc4ncnn34)CC2)cc(OC)c1OC 758940835 MQLRLRYADKMRLT-UHFFFAOYSA-N 438.410 2.496 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cncc4ccccc34)cc2)C1 758979062 JSNDMXQIADSISB-GOSISDBHSA-N 431.496 2.191 10 20 IECD COc1cc(N2CCN(C(=O)c3c(C)nc4ccnn4c3C)CC2)cc(OC)c1OC 759221355 OWFHQODKLQMBMA-UHFFFAOYSA-N 425.489 2.334 10 20 IECD COc1cc(N2CCN(C(=O)NCCCNc3ccccn3)CC2)cc(OC)c1OC 759269160 XYTLYECIVOZWKT-UHFFFAOYSA-N 429.521 2.441 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc(OC)c1OC 760117447 JGJQXXXMLUYWGP-DLBZAZTESA-N 448.564 2.191 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C 773723449 SIXOXBXKWILXIP-NSHDSACASA-N 430.411 2.462 10 20 IECD O=C(NC[C@H](c1ccco1)N1CCCC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 774862023 AJUDXRKFLNCEJP-WOJBJXKFSA-N 441.528 2.446 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1[N+](=O)[O-] 777920875 VPXYTVKTYJOHNS-UHFFFAOYSA-N 426.426 2.457 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3CCN(C(=O)OC(C)(C)C)C3)nc12 778433376 ORAFBHDDWNHADD-ZDUSSCGKSA-N 448.476 2.302 10 20 IECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)c(O)c1O 780855373 JJMWWGXXULVJRC-UHFFFAOYSA-N 428.869 2.345 10 20 IECD COc1ccccc1[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nccn1C 785618158 BAJNHOJHNAFFNI-NRFANRHFSA-N 435.528 2.325 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCCCCC1 786627560 LUHUGEWPQUCPOA-JOCHJYFZSA-N 430.593 2.156 10 20 IECD O=C(NCCOc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 786875817 HARLVAAOOKYUTB-UHFFFAOYSA-N 435.883 2.127 10 20 IECD CCCOCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788322145 GBDJZAVOIMCRPW-UHFFFAOYSA-N 425.529 2.382 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)cc1 788976343 XGGMRNYOXLDSQB-PMACEKPBSA-N 429.517 2.093 10 20 IECD COc1c(C)cnc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C 789862460 TWNCZRZZQFBRQY-UHFFFAOYSA-N 428.558 2.193 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1nc(C(F)(F)F)cs1)c1ccc(N2CCOCC2)cc1 803297593 AZJIUJYBTKDSAW-GFCCVEGCSA-N 442.463 2.492 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(c3ncc4n3CCCC4)CC2)cc1F 803660913 IYPKVNNZWHAVIR-UHFFFAOYSA-N 427.524 2.447 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCN(C)C(=O)OC(C)(C)C)CC2)cc1 803821364 SXKWPPMCJFQXET-UHFFFAOYSA-N 435.521 2.144 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2COc3c(cccc3OC)C2)cc1F 804673607 ITPHUJKCGDFNEA-KRWDZBQOSA-N 429.492 2.417 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(CCN(C)C)C[C@@H]3CCCO3)cc2)CC1 805025654 SLVYERPUSSZJAC-QFIPXVFZSA-N 430.593 2.108 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 807289533 YKCUOIGCUONROO-UHFFFAOYSA-N 434.540 2.427 10 20 IECD Cn1cc([C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c2ccc(F)cc2)cn1 807291509 XKRKCVCTKNYJTI-JOCHJYFZSA-N 433.487 2.457 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C 808095751 RALWWOIJHGAQRH-HSZRJFAPSA-N 428.485 2.493 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc(C(F)(F)F)nc4)n3)CC2)cc1 809464199 BZPDZJVCUMWIQA-UHFFFAOYSA-N 448.405 2.445 10 20 IECD CCc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917930391 RWUUNVNYZFDOGX-GOSISDBHSA-N 445.541 2.127 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920927348 UWWMDXOUHCYRRU-CQSZACIVSA-N 429.448 2.265 10 20 IECD Cc1cc(C(=O)CN2CC[C@@](CO)(C(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1323917086 MUDMGCWNKFAROW-JOCHJYFZSA-N 433.574 2.265 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3ccccc3SCC(N)=O)CC2)cc1 1335868337 WDIYWFSZPLKTGP-UHFFFAOYSA-N 428.558 2.423 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H]4C[C@@H](O)C4)C3)C2)cc1 1778135767 IHMVTGAPTVSVOB-JLRUASKGSA-N 437.540 2.309 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)C1CCCCC1)CCO2 1785509184 UTCYFRNNEWRCQQ-ISGGHPHESA-N 430.501 2.227 10 20 IECD COC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786442554 OYSSJXOSZJTTOQ-CYBMUJFWSA-N 435.571 2.263 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1c(F)cccc1Cl 1789457475 CMFPUSOSWQJMGP-RBOXIYTFSA-N 449.866 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)C1CC(F)(F)C1 1796932164 SYWKZNIKUSIGDT-ACHSLPGTSA-N 430.455 2.463 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCCn2cccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997807 DRFAYHJDWHWDRN-WZONZLPQSA-N 449.511 2.489 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1cc(O)nc(O)c1 1817845609 RPBQLHQZKKJFKD-OAHLLOKOSA-N 426.408 2.370 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1 1828379093 FJTQTVUEXYCZCS-KGLIPLIRSA-N 445.557 2.122 10 20 IECD O=C(NO[C@H]1CCCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 725898284 LVMQVTYFPFDCQX-KRWDZBQOSA-N 437.430 2.289 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(-c4ccccn4)s3)nc12 727887022 JTOISONVHKVKPP-UHFFFAOYSA-N 425.426 2.487 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1 728015017 KKZOSSNPJGYYEO-UHFFFAOYSA-N 429.907 2.397 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3(S(=O)(=O)c4ccccc4)CC3)cc2)C1 731339676 DZYNOGSOYXESFF-GOSISDBHSA-N 441.553 2.011 10 20 IECD CCOC(=O)[C@@]1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCc2ccccc21 735873345 JMTYZHPSUWTQMW-RUZDIDTESA-N 437.540 2.338 10 20 IECD NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)CC1 741100053 QYFOBIRVFYMRLO-UHFFFAOYSA-N 447.539 2.019 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743539718 ZHNJLNJGWXZEMH-UHFFFAOYSA-N 447.557 2.195 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(CS(C)(=O)=O)CC3)cc2F)C[C@H](C)O1 752005538 UJWHVMSFFCCLAU-GJZGRUSLSA-N 427.542 2.063 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCCCSc3nccs3)cn2)C[C@@H](C)O1 758618040 JENDUHKQEFGQHT-ZIAGYGMSSA-N 438.579 2.279 10 20 IECD COCc1ccccc1S(=O)(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759099604 KRMFGGDMXHBHJC-UHFFFAOYSA-N 436.530 2.370 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3nnc(NC(C)=O)s3)c2C)cc1 759507500 DKOVNCHTEYOGOU-UHFFFAOYSA-N 449.514 2.031 10 20 IECD CCOC(=O)C(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 762882764 NZZPOICSRLJZSX-HUUCEWRRSA-N 438.496 2.188 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](S(C)(=O)=O)C1 763913853 BPUJPKBMONTQFC-LSDHHAIUSA-N 440.521 2.298 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 769160482 INPDUPOJFSEQHX-XZOQPEGZSA-N 448.583 2.354 10 20 IECD O=C(CN1CCC(C(=O)C(F)(F)F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 775858114 GYAAIAVGXILAAM-UHFFFAOYSA-N 431.430 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(C)(C)N3CCCCC3)CC2)cc1 778220578 YQSCLLUHPZMZBK-QXMHVHEDSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)CC2)cc1 778408779 BZGXLANGTCXWLC-RYQWKWSKSA-N 447.626 2.396 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)C[C@@H](OC)C4)CC2)cc1F 784743407 FEDSPZHRCANOKX-IBGZPJMESA-N 427.476 2.235 10 20 IECD CC(C)N1CCN(c2cccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2)CC1 785297084 LDSWDKHDHCWQTR-KRWDZBQOSA-N 440.544 2.314 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@@H]3CCC[C@H](C)C3)CC2)cc1 785529813 YLMAVQCLVNJUOX-VQTJNVASSA-N 430.593 2.266 10 20 IECD Cn1cc(-c2ncccc2NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 786208278 BQEQBLBFEXZFJG-UHFFFAOYSA-N 440.529 2.039 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCNC(=O)OC(C)(C)C 786718727 UVERTXSXOYQTBL-UHFFFAOYSA-N 444.326 2.144 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@@H]3c3ncon3)CC2)cc1 787262337 QECZFRZUDBSLPA-CTDFXDFQSA-N 439.516 2.427 10 20 IECD COC(=O)c1cncc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 788595589 LXDKEAGYTFIWLO-ZIAGYGMSSA-N 437.493 2.099 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CSCCS3)cc2F)C[C@@H](C)O1 789817181 GQKGNPQEAVQTQI-LZWOXQAQSA-N 441.594 2.020 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1c(OC)cc(OC)cc1OC 790096803 BKEOBNVABZSVSU-UHFFFAOYSA-N 429.517 2.443 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 795850388 IEGLWZWSLCSSQN-IBGZPJMESA-N 448.541 2.138 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803308674 HSZHVFDWADUPQI-SJORKVTESA-N 448.564 2.120 10 20 IECD CCN(Cc1ccc(C)cc1)C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803751241 SREGTZSKIWKQFK-UHFFFAOYSA-N 438.572 2.291 10 20 IECD CC[C@H](C)[C@H](NC(C)=O)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803946134 AHVKAZNPKOLDEV-ZSEKCTLFSA-N 436.464 2.495 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(c2ncnc3sccc23)CC1 807103019 KQUAQRRCWRIARP-UHFFFAOYSA-N 438.557 2.031 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](C2CC2)O1 807771902 YTYWRHRICDZWRD-IDHHARJASA-N 437.487 2.399 10 20 IECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)N[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1=O 812278581 LYULLJJAGHTJPY-QHCPKHFHSA-N 445.564 2.463 10 20 IECD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)c(F)c1 917707718 XKTQDFLYSSZHQO-UHFFFAOYSA-N 430.436 2.007 10 20 IECD CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194461 DAEKOICQRCJNPM-KPKJPENVSA-N 437.496 2.354 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccc(CC)cc2)C1 1342433833 FOUMLWZIPVJBDG-MJGOQNOKSA-N 440.496 2.304 10 20 IECD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)c(F)c1 1780856146 GNVLPZBCHOGKAP-WZONZLPQSA-N 443.475 2.382 10 20 IECD Cc1nscc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005144 VKDIRSLDHQZFSQ-LJQANCHMSA-N 437.905 2.273 10 20 IECD CC(C)(C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccn1 1846517284 LJQKHZRTJQTLPS-UHFFFAOYSA-N 445.523 2.356 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Cn4cccn4)cc3)CC2)cc1 21921912 FXKKUHLFBFQKIH-UHFFFAOYSA-N 434.496 2.446 10 20 IECD NC(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nn1-c1ccccc1 303486885 RGKIQBPIQGNVFM-UHFFFAOYSA-N 433.512 2.110 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 427629407 IRLDWJMWNILRKQ-UHFFFAOYSA-N 431.514 2.049 10 20 IECD COC(=O)[C@H](C)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 726843434 DYTLRPQVROOCMF-BRWVUGGUSA-N 435.540 2.329 10 20 IECD C[C@H](NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(N2CCOCC2)cc1 728296897 WWOYSEYYGUBZNR-AWEZNQCLSA-N 449.485 2.242 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCC(=O)N4)c2)CC1 740609978 QGHKNOMMRVIPNH-UHFFFAOYSA-N 442.541 2.464 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1F 747012271 OWPLMKSBTSKGAS-UHFFFAOYSA-N 440.397 2.439 10 20 IECD COc1ccc(Br)cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 747474059 GXFQTXLAWVKFMR-UHFFFAOYSA-N 429.292 2.465 10 20 IECD COC(=O)N1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 748043801 VVCIVRIVEZVWFD-UHFFFAOYSA-N 439.515 2.215 10 20 IECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC(F)F)cc3)C2=O)cc1 748198614 BYVGQPRULMDJSU-QFIPXVFZSA-N 446.454 2.437 10 20 IECD O=C(NCCn1cccc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748365994 GPHITCKDAJOPJW-UHFFFAOYSA-N 430.442 2.333 10 20 IECD Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 749625738 NHLMFHBVRUWELO-UHFFFAOYSA-N 439.447 2.276 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](Cn4ccnn4)C3)cc2F)C[C@@H](C)O1 752064669 KKDZHJFFUIOOBS-WSTZPKSXSA-N 444.555 2.059 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](Cn4ccnn4)C3)cc2F)CC1 752666602 VVTGHCWJECNKGG-LJQANCHMSA-N 429.544 2.181 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 754026769 YAMKNAIEXZDCGO-PZJWPPBQSA-N 448.608 2.025 10 20 IECD Cn1nc(-c2ccccc2)nc1Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762409894 HKWVVVGYMRIAQE-UHFFFAOYSA-N 426.458 2.200 10 20 IECD COC(=O)c1cn([C@@H]2CCCN(Cc3cc(Br)cc(OC)c3O)C2)nn1 762792998 ASQZOTAPHYEYEI-CYBMUJFWSA-N 425.283 2.379 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc21 767736650 KVFFMFMROQKGJN-OAHLLOKOSA-N 431.514 2.491 10 20 IECD CC(C)(C)[C@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769788634 KFXSTAVJKNBDFP-KRWDZBQOSA-N 437.474 2.238 10 20 IECD COC(=O)[C@H]1CCC[C@@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771059019 XCYDCPFVRCTPBK-SJORKVTESA-N 442.516 2.416 10 20 IECD C[C@]1(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCOC1 772447541 OTGBOLQAVRQXRL-QFIPXVFZSA-N 428.512 2.311 10 20 IECD Cc1cc(C(=O)COC(=O)COC2(C)CCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 773208506 UPECWOMDQICTSM-UHFFFAOYSA-N 434.514 2.427 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(CCCN(C)C)CC3)CC2)cc1 778407478 KZALCOMCWSJXKK-ZHACJKMWSA-N 442.604 2.480 10 20 IECD O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 779896266 LJAMYJORDBNAMS-UHFFFAOYSA-N 433.530 2.466 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC3(CC2)COC(=O)N3)c([N+](=O)[O-])c1Br 784207574 ACZWRQVAQMCQPH-UHFFFAOYSA-N 431.199 2.353 10 20 IECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 784649104 FLKAMJYVPUWXOF-UHFFFAOYSA-N 427.505 2.184 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCC[C@H]3C(=O)N3CCCC3)cc2)CC1 787326843 ZJYLTDSHWLXNHE-XZOQPEGZSA-N 440.588 2.400 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccsc1 787655794 RKXDCJNCLAHZFI-MOPGFXCFSA-N 431.558 2.380 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789376865 AYXSJIGBIFVIRF-SFHVURJKSA-N 429.546 2.080 10 20 IECD COc1ccc(N2CCN(C(=O)CN(CCNC(C)=O)Cc3ccsc3)CC2)cc1 801558764 UZNWENYGFVCDNE-UHFFFAOYSA-N 430.574 2.044 10 20 IECD CCCCN(CC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801596723 LWYJENQHHUDEIO-PMACEKPBSA-N 438.590 2.189 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3C[C@H](C)[C@@H]3c3ccccc3)CC2)cc1 803751854 XFDZOBKWXHYDMI-WMZHIEFXSA-N 436.556 2.153 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O 808615877 NIQXLWJJZZDION-JOCHJYFZSA-N 436.556 2.061 10 20 IECD N=C(NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCN(c2ccc(F)cc2)CC1 849069902 ZRBPOGJRUWNJHB-LJQANCHMSA-N 438.551 2.374 10 20 IECD COC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 918073548 HAEHKTBYZFXJQM-UHFFFAOYSA-N 430.427 2.136 10 20 IECD Cc1ccc(S(=O)(=O)NCCN(C)Cc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1319948778 SYNRSQRGBVDOPS-UHFFFAOYSA-N 434.581 2.296 10 20 IECD CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1327440746 YKHIOQWYHOJMKF-SFHVURJKSA-N 440.629 2.460 10 20 IECD Cc1noc(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)n1 1329402264 IQHLXLGKBDSIPH-UHFFFAOYSA-N 426.498 2.210 10 20 IECD Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cs1 1816721246 IDNCNPVKMCSPOG-NSHDSACASA-N 445.526 2.183 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccnn23)[nH]n1)c1cc(O)nc(O)c1 1817847357 WXQHERSORWOXAY-INIZCTEOSA-N 447.455 2.483 10 20 IECD COCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708460 AADYISSQSYBKHL-SNVBAGLBSA-N 425.894 2.470 10 20 IECD C[C@H]1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835505617 IISMOMQSSATQNP-HNAYVOBHSA-N 430.549 2.114 10 20 IECD O=C1CC(C(=O)N2CCCC23CN(C(=O)C(Cl)(Cl)Cl)C3)=NN1c1ccccc1 1843442564 RZOZYGXPUFAUJI-UHFFFAOYSA-N 443.718 2.353 10 20 IECD COC(=O)[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1845500582 QYAXSWIBVIYVAU-STQMWFEESA-N 436.892 2.158 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cc1 15409656 HMSAWFKHEGXFRK-UHFFFAOYSA-N 444.601 2.026 10 20 IECD C[C@H](C(=O)Nc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1)n1cncn1 24576926 OYJQZMYYNDRFSF-LLVKDONJSA-N 429.487 2.283 10 20 IECD COc1ccc(N2CCCN(C(=O)C[C@@](O)(c3nccn3C)C(F)(F)F)CC2)cc1 108582363 BDGOKKIOCRXACP-LJQANCHMSA-N 426.439 2.308 10 20 IECD Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 730267159 NDEIVVJCXPFDGY-UHFFFAOYSA-N 438.571 2.022 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccn(-c2ccccc2)n1 738887608 IXRFJDWHTYREON-UHFFFAOYSA-N 425.514 2.429 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1NC(=O)OC(C)(C)C 740928759 SHSFGKNMUQFMFD-WFASDCNBSA-N 427.523 2.139 10 20 IECD Cc1oc(-c2ccco2)nc1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749573767 ZWYQELWALBWFSN-UHFFFAOYSA-N 429.498 2.337 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@]3(C)CCC(=O)N3)cc2F)C[C@@H](C)O1 751523337 XOBQLKFBDUWMAF-LNPFQXMTSA-N 449.523 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-c4nnco4)c3)CC2)cc1F 754210920 BWCAWLSPXJSZIH-UHFFFAOYSA-N 425.420 2.172 10 20 IECD Cc1c(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)c(=O)n(-c2ccccc2)n1C 759591199 ZZDQROJAASJPFZ-PABFRNLHSA-N 437.452 2.479 10 20 IECD CN(CC1(O)CCC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760074326 UYQRGFMZCWHDBP-UHFFFAOYSA-N 435.458 2.088 10 20 IECD CC(C)(O)CN1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 760187146 GKEIBOQJOHENDB-MRXNPFEDSA-N 426.508 2.355 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 762416749 WHLAFICYSYEZKJ-INIZCTEOSA-N 430.432 2.464 10 20 IECD CC[C@@H](C)[C@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771062536 ASLYIZHBBBGGDT-KZULUSFZSA-N 437.474 2.238 10 20 IECD COCCn1nc(C)c(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 772534803 KXRWMAINNMEUPI-GOSISDBHSA-N 428.537 2.170 10 20 IECD CCCNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c2ccccc2O1 773845373 HZKVHOIINWEIGB-IERDGZPVSA-N 438.528 2.250 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1O 774820428 LDAUGUOGUQSPAI-UHFFFAOYSA-N 441.893 2.469 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCC3)cc2F)C[C@@H](C)O1 774865316 KNEOADPOZWPSGR-CALCHBBNSA-N 434.556 2.046 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H]1CCC[C@H]1CCO 779540395 QZWSISPTXRYHEK-AZUAARDMSA-N 442.539 2.293 10 20 IECD O=C(c1ccccc1)N1CCC[C@@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 779613520 MEHVAJPECCRPHS-JOCHJYFZSA-N 443.569 2.247 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2 785192803 PXVMLIMMZJMAIA-UHFFFAOYSA-N 448.273 2.473 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@@H](C)C(C)(C)C3)CC2)cc1 785529745 XAEZGWSALRRHMB-LJQANCHMSA-N 430.593 2.218 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](CN3CCCC3=O)c3ccccc3)ccc21 787736533 KVSLPBKXOAEVEX-NRFANRHFSA-N 434.540 2.165 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC)cc2O)cc1F 795357394 FCGUQHKTJRXUJX-UHFFFAOYSA-N 432.495 2.170 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)NC)cc1F 799770159 PBQRUVDZLDKTEY-UHFFFAOYSA-N 429.539 2.059 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 803303735 UIKCQNHEEUCWJP-MRXNPFEDSA-N 425.485 2.088 10 20 IECD CC[C@H](C)N(C)CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448306 NZLYWLYQJAPLHR-HNNXBMFYSA-N 426.508 2.220 10 20 IECD CCN(C(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCN(c2ccccc2)C1=O 803688946 GLBYFJAAZWIRKR-QFIPXVFZSA-N 434.540 2.339 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(Cc3cccnc3)C3CC3)cc2F)CC1 805007687 XBORTPLFVUKYBM-UHFFFAOYSA-N 439.535 2.170 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)[C@@H]1Oc1ccccc1 807097558 PPIRPRUXQVKZHA-BDTNDASRSA-N 425.529 2.418 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1 807099944 HZHALDPHTULDNE-QFIPXVFZSA-N 436.556 2.488 10 20 IECD Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807636521 XONMGFJIQRRPJX-IBGZPJMESA-N 425.529 2.374 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(Cn4cncn4)cc3)cc2)C1 918003284 NDOMJIGBLDPBKP-OAQYLSRUSA-N 447.543 2.028 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1 920482469 PRTWDHOBOGQBOS-UHFFFAOYSA-N 432.545 2.043 10 20 IECD C[C@@H](NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920865807 NHNGTLWQHPYBLC-MRXNPFEDSA-N 429.542 2.455 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCC(=O)N[C@H](C)c3ccc(F)cc3)CC2)cc1 1320365067 GMWOFHGHHUJPQP-GOSISDBHSA-N 442.535 2.340 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2ncon2)CCO3)cc1 1781754499 XGQRKFJUNMHLQS-QHCPKHFHSA-N 435.484 2.234 10 20 IECD Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007555 TXUVDBXLYWCDNW-OAQYLSRUSA-N 449.866 2.351 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)n[nH]2)cc1 1795693463 WPXFPUXXZSJRRR-OPMZPASUSA-N 449.511 2.040 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cc1F 1799752376 GNEIIOJANFSWJO-CLLJXQQHSA-N 439.509 2.077 10 20 IECD CCc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c1 1799768463 PNHPEQCSFYBBDQ-CCWDJLKJSA-N 445.903 2.226 10 20 IECD CN1CCC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)C1 1827427652 GQUAXPFWWGPXAH-IEBWSBKVSA-N 430.549 2.068 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2nccc3nc[nH]c23)C1 1843291735 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KMXWJMUYGPRZQS-RKRRMPDFSA-N 429.561 2.134 10 20 IECD Cc1cc(O)cc(=O)n1CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 759805360 VAHXZOPFEKLYSW-IBGZPJMESA-N 444.532 2.311 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 760896256 FRLBWWBHHHYADX-GOSISDBHSA-N 446.548 2.384 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)CCCN3C(=O)c4ccccc4C3=O)ccc21 767753165 ZQEHNHQLRMPMKG-UHFFFAOYSA-N 427.526 2.175 10 20 IECD CS(=O)(=O)N(CC(F)(F)F)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769427409 JGNYKWDLXLFYCF-UHFFFAOYSA-N 435.512 2.312 10 20 IECD O=C(CCN1C(=O)CNC1=O)Nc1ccc(NCc2ccc(N3CCOCC3)cc2)cc1 770525224 RZMMPJSAEOUQAU-UHFFFAOYSA-N 437.500 2.016 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nn(C)c4ccccc34)CC2)cc1 774655133 BIAUEVICSGDDOI-QXMHVHEDSA-N 447.539 2.146 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)c1 775376680 XHNDWOPEOSVJSJ-IQMFZBJNSA-N 440.500 2.026 10 20 IECD CCN1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C(C)(C)C1=O 778095551 NJWMQOWNFMVFNH-UHFFFAOYSA-N 435.436 2.453 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)CN3CCCCC3)CC2)cc1 778248273 UTJKGPJSESZKLF-CFGKVWFZSA-N 428.577 2.138 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@H]4C3)cc2)C1 785609129 PEAVCQYVZRPIGH-UWHLTILDSA-N 440.588 2.480 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc(S(=O)(=O)NCC4CC4)cn3)cc2)CC1 786069125 PQQVTYFWRJDNTO-UHFFFAOYSA-N 443.573 2.051 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(C(=O)NCC(C)C)C3)cc2)CC1 786656060 KCBVMNPGEJUVPF-OAQYLSRUSA-N 443.592 2.049 10 20 IECD O=C(NCCN1CCc2ccccc2C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787622100 JTOZMRWZIBKZCX-JOCHJYFZSA-N 437.540 2.074 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(C)cnc3Cl)CC2)cc(OC)c1OC 787893621 IVYATBDMLPPZLK-UHFFFAOYSA-N 448.907 2.357 10 20 IECD C[C@H](NC(=O)C(=O)NCCN1CCCc2ccccc21)c1ccc(N2CCOCC2)cc1 803304135 DFVRIXMFDNQCLP-IBGZPJMESA-N 436.556 2.269 10 20 IECD Cc1ccc2[nH]cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c(=O)c2c1 804276404 ONBNYOUMUJUZES-UHFFFAOYSA-N 425.510 2.001 10 20 IECD C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCCCSc1nccs1 806280910 YRBMRLANAUBOSW-KRWDZBQOSA-N 447.630 2.068 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1 810348719 ZMNRBXSCYXWHHH-NSHDSACASA-N 443.319 2.319 10 20 IECD CCN1CCC[C@@H]1CNC(=N)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 849064311 OGNNYQIBFPJSLP-LJQANCHMSA-N 440.571 2.041 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 918295239 OXULBJDAWQMKNY-QGZVFWFLSA-N 425.485 2.207 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21 918307123 OJQUBAURBMLROA-HXUWFJFHSA-N 425.485 2.068 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccc(N2CCCC2=O)c1 1324827199 DSXQCCQHVPZUFE-SFHVURJKSA-N 426.469 2.058 10 20 IECD CC(C)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CCC1 1782805055 FBSGEZGKCLKMRM-VGOFRKELSA-N 431.533 2.447 10 20 IECD Cn1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)C2)n1 1808005846 OZOPWONRBWZPTR-UHFFFAOYSA-N 433.896 2.038 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)[C@@H](O)c3ccccc3)C2)CC1 1809450357 XEACLHLMXNCVOZ-FQEVSTJZSA-N 425.485 2.071 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814185992 WKAXITFREPRNLH-DKICVRJWSA-N 448.614 2.384 10 20 IECD C[C@H](CC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815299198 MHZMJVVCEJXFJJ-QMTHXVAHSA-N 449.895 2.292 10 20 IECD CCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817844202 SXBJDACMNWNGMA-OAHLLOKOSA-N 425.449 2.052 10 20 IECD O=C(CC1CCC1)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1828120689 PWBWGIWULJFDQZ-LLVKDONJSA-N 438.600 2.106 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3cccnc3[nH]2)C1 1844086597 MXBUCYDPCIWPBQ-FNORWQNLSA-N 434.452 2.210 10 20 IECD COc1ccc(CN2CCCN(C(=O)COC(=O)c3ccc(C)c(O)c3O)CC2)cc1 727005933 XSCPYCVOOFFOGL-UHFFFAOYSA-N 428.485 2.306 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](O)COc3ccc(F)cc3)cc2F)CC1 730133553 YZOLYPKDQHFRJG-IBGZPJMESA-N 448.514 2.346 10 20 IECD O=[N+]([O-])c1cc(CNCCS(=O)(=O)NC[C@@H]2CCCCO2)ccc1N1CCCCC1 732232211 GJANTWNPFLDXCL-SFHVURJKSA-N 440.566 2.163 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 734073655 TZCWYLPCXWOSQB-ZIAGYGMSSA-N 431.464 2.408 10 20 IECD COc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(SC)cc1OC 741303857 ZIDOGNAIWSUIQJ-RIYZIHGNSA-N 448.613 2.176 10 20 IECD COC(=O)c1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)sc(C)c1C 743896837 LHKZBGZACDHPLT-UHFFFAOYSA-N 431.514 2.243 10 20 IECD CCCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 746393578 LBCKCDWFVDROIT-UHFFFAOYSA-N 430.528 2.219 10 20 IECD COC(=O)c1sccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227054 BLVGMWZMIIFFKO-UHFFFAOYSA-N 428.507 2.113 10 20 IECD CO[C@@H]1Cc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2C1 752991810 XYDBEMWQWJJMCM-OAQYLSRUSA-N 429.542 2.357 10 20 IECD COC(=O)c1cccc([C@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)OC)c1 754003617 OSMSZIKFMRPZQB-FPOVZHCZSA-N 439.512 2.179 10 20 IECD 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2.433 10 20 IECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333949 AZFJDBFZPMYUTR-RHSMWYFYSA-N 447.504 2.119 10 20 IECD C[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCN1C 745738070 SMSMJLDPTWWFDR-HKUYNNGSSA-N 441.555 2.224 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N(c1ccc(F)cc1)[C@@H]1C=CS(=O)(=O)C1 759596091 MCPJIKGOEWBNFY-HVEWAWRISA-N 447.440 2.137 10 20 IECD C[C@@H]1COCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762704185 LZCFSEWWZBDPDF-PXAZEXFGSA-N 435.458 2.256 10 20 IECD O=C(O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1I 765095863 QWSNGLHODJRLIY-UHFFFAOYSA-N 445.194 2.326 10 20 IECD CC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 767884918 VSKRXPHUZOVEJE-UHFFFAOYSA-N 435.933 2.463 10 20 IECD C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)c2)C[C@@H](C)O1 774363001 PRPVGCSAEIZHTN-IYBDPMFKSA-N 427.501 2.004 10 20 IECD Cc1cc(Br)cc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)c1O 779608406 SKCBNJSAUCIOJB-MRXNPFEDSA-N 433.368 2.090 10 20 IECD NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)c1 782896486 OTLJKZVCWIPXLN-UHFFFAOYSA-N 449.504 2.479 10 20 IECD C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439424 OZMRIQBQWRVTOY-CRAIPNDOSA-N 448.564 2.246 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785546098 MNUIXJZBYGORBJ-AVBTWRTFSA-N 433.574 2.406 10 20 IECD COc1cccc(CNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 789314445 VUXVUEJDOZRPFC-SFHVURJKSA-N 445.491 2.057 10 20 IECD CCCCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 789799520 IJYNAIOOSVYZOB-WOJBJXKFSA-N 435.540 2.379 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](c4cc[nH]n4)C3)cc2F)C[C@@H](C)O1 789827230 RVCGRMJDDNFIMO-SOLBZPMBSA-N 443.523 2.185 10 20 IECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 790554291 IXYBMENHQWFSMV-STQMWFEESA-N 430.468 2.461 10 20 IECD COc1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c(O)c1 794388901 BPLHUYGCGJJERF-CQSZACIVSA-N 430.457 2.096 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)c(O)c1 797387348 HNRKQVFBLNSVIL-UHFFFAOYSA-N 444.507 2.325 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCOCC12CC2 802297111 DSWSQDSQBHRNDR-UHFFFAOYSA-N 433.442 2.106 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1F 804851982 VUFIHOGEBMVZLQ-VXKWHMMOSA-N 448.583 2.172 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(F)(F)F)[C@@H](CO)C3)cc2)C1 806494457 QMVVUGTWSWRAGF-NUJGCVRESA-N 442.482 2.091 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)Oc3ccccc3OC)CC2)cc1 807635538 RRWGRCNQVAWMBV-GOSISDBHSA-N 441.528 2.326 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 807671448 PESHUCSSBHUFRB-WTOYTKOKSA-N 425.529 2.281 10 20 IECD C[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1(S(C)(=O)=O)CC1 808931189 JSRRCNCAYIXIHU-NSHDSACASA-N 442.449 2.066 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cn(C)nc3C(F)(F)F)cc2F)CC1 815011507 OVDACEIQMWFTIX-UHFFFAOYSA-N 449.474 2.198 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(c4ccncc4)CC3)CC2)cc1 916199053 VTTVOHZFRYAEQW-UHFFFAOYSA-N 438.576 2.134 10 20 IECD CC(C)Cn1nnnc1SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917202165 AQOXNRQWQTYWRL-HUUCEWRRSA-N 436.557 2.490 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3nc(N4CCCC4)ncc3Cl)cc2)C1 917837481 WUWQFTJYGUVKSK-INIZCTEOSA-N 442.951 2.362 10 20 IECD COc1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 920194066 OIVOEYOQKRGEKP-HNNXBMFYSA-N 444.919 2.305 10 20 IECD Cc1nc(N)sc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844794 MHVXLIKSJSGHHE-LBPRGKRZSA-N 443.489 2.183 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2cncc2c1 1819157934 RTQOHDYCRLOKKU-KRWDZBQOSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(Br)ccc2O)C1 1844881837 XATYECHSLXVCQO-UHFFFAOYSA-N 448.273 2.092 10 20 IECD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cn1 1845501123 CDSSBIVNWYICJV-UHFFFAOYSA-N 445.859 2.064 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccnc2Cl)=NN1c1ccccc1 1847172050 TXFOXEOYTRXOLK-ROUUACIJSA-N 437.887 2.343 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)cc1F 1847779032 LIHILRKBWAHBSD-IRXDYDNUSA-N 449.573 2.129 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C=C2)cc1 466297800 OFELJPWNVNJUBB-UHFFFAOYSA-N 425.466 2.297 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 728025162 YTEFSXSNNKQNDM-QZMAKXCISA-N 446.617 2.191 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](C(C)C)N3CCN(C)CC3)cc2F)CC1 730115289 TWHVLHHUXLUNRR-HSZRJFAPSA-N 448.631 2.039 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1 731126154 SECBMTUPJQBRPV-UHFFFAOYSA-N 430.262 2.333 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(=O)N(C4CCC(C)CC4)C3)CC2)cc1 731342966 IGALXYMIKUYDFL-FUHYEJFZSA-N 442.604 2.361 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-n4cccc4)c3)cc2)C1 737139292 NLMGQSJVNCMUST-IBGZPJMESA-N 445.523 2.434 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)C1 746146310 FBMBZIOMLNKRAG-FQEVSTJZSA-N 436.556 2.279 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2)[nH]1 746879894 IOIYSGFJPJPGKU-UHFFFAOYSA-N 434.496 2.194 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(N4CCCNC4=O)CC3)cc2F)CC1 749192210 BONXDFASWNAZAH-UHFFFAOYSA-N 446.571 2.057 10 20 IECD O=C(CN1CCC[C@@H](Cn2ccnn2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 752063316 OBWMFCYPNOPVKK-MRXNPFEDSA-N 429.480 2.404 10 20 IECD COC(=O)C[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CCO1 752336148 IUMBBWICRLTFKB-IBGZPJMESA-N 428.485 2.327 10 20 IECD C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 752633586 ZXHVMJKWCBBODG-STQMWFEESA-N 427.523 2.139 10 20 IECD CS(=O)(=O)CCN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1 753605200 GJZFFRLQFXZARS-UHFFFAOYSA-N 431.505 2.475 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2cnc3[nH]nnc3c2)NC(=O)OC(C)(C)C)cc1 755423593 OKRFPUKPPORDKC-QGZVFWFLSA-N 425.493 2.415 10 20 IECD CC(C)NS(=O)(=O)NCCNC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 758529721 QROFVNDHIWLSHP-UHFFFAOYSA-N 425.599 2.087 10 20 IECD Cc1c(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)c(=O)n(-c2ccccc2)n1C 759591196 ZZDQROJAASJPFZ-HBIYDYFMSA-N 437.452 2.479 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@H]3CSCCS3)CC2)cc(OC)c1OC 760126719 HXUMKMUWFFSQOD-HNNXBMFYSA-N 427.592 2.393 10 20 IECD COc1cccc(CNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)c1O 769502954 CMXXJCLZULKYPN-INIZCTEOSA-N 427.457 2.485 10 20 IECD COC(=O)c1cc(OC)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772905244 WWPDCKYDEUHBGW-UHFFFAOYSA-N 431.464 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3COc4ccccc4C3)CC2)cc1 778220774 CLFPATFAOUBFBT-GNISGLHKSA-N 435.524 2.268 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3cn4cccc(C)c4n3)CC2)cc1 778302642 SJLAKGKVMSCNPD-KTKRTIGZSA-N 447.539 2.215 10 20 IECD CC[C@@H](NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1nccs1 785531304 UNGPSRPGHKRDFU-LJQANCHMSA-N 445.589 2.048 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1F 785602063 XBDDBQYTNNAKIV-IBGZPJMESA-N 427.455 2.286 10 20 IECD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(O)n1 786262412 LBAWVRXIPQXGIJ-UHFFFAOYSA-N 443.573 2.130 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(C(F)(F)F)n1 786285986 HRNSKZUOFBANDW-UHFFFAOYSA-N 440.397 2.456 10 20 IECD C[C@H]1CCCCN1C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321096 SKRUPCWVPWTJDB-RBBKRZOGSA-N 442.604 2.252 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nccs1 789834244 LGEZIUOQVHRPML-RRFJBIMHSA-N 434.537 2.432 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Br)ccc2F)ccc1O 790404795 HUISELGRHGUMHA-UHFFFAOYSA-N 439.284 2.003 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc([S@](C)=O)cc3)CC2)cc1 797800211 ZJCCYOPGVFUSOJ-PMERELPUSA-N 429.586 2.304 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(N2CCOCC2)cc1 803304608 GDEPJKPXEDGMRJ-VGOFRKELSA-N 441.503 2.440 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc4c(c3)OCCCO4)CC2)cc1 803624479 VOCLLWBRPXOALD-UHFFFAOYSA-N 439.512 2.212 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)cc1F 803663317 NAZITDBPVICHJV-UHFFFAOYSA-N 444.482 2.068 10 20 IECD COC(=O)N1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803678098 YADXVFHJDBLOGY-GOSISDBHSA-N 430.549 2.419 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)CC2)cc1 804314878 BOZGRQMRQGEZDZ-QYZOEREBSA-N 435.615 2.276 10 20 IECD CC1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOCC1 804649967 UKHPAIGNNDAODX-HNNXBMFYSA-N 425.476 2.306 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCn4cnnc4[C@H]3C)cc2Cl)C1 807952338 LGATZCIXWIBJES-HUUCEWRRSA-N 430.940 2.387 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@@H]3[C@@H]3CCCO3)CC2)cc(OC)c1OC 811764088 NZNGIHCOTWTGDS-UWJYYQICSA-N 433.549 2.208 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C1(S(=O)(=O)c2ccccc2)CCOCC1 813419836 RGUNAZFEEFPCEV-UHFFFAOYSA-N 444.553 2.163 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)C[C@@H](C)COC3CCCC3)CC2)cc1 815012444 IFMXSAFZMZZIIZ-IBGZPJMESA-N 439.622 2.332 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(C(=O)N(C)C)ccc3OC)CC2)cc1 917828873 UYFCBMOGKKMHQZ-UHFFFAOYSA-N 426.517 2.166 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 918137788 FFYMIOQIJGYBGX-UHFFFAOYSA-N 447.580 2.363 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc21 918311894 WPFAQWDVAILQIQ-UHFFFAOYSA-N 436.512 2.029 10 20 IECD CCc1ncncc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 919390559 KGRSMBDZECNVNW-UHFFFAOYSA-N 442.497 2.134 10 20 IECD CN(C)c1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 919855848 ZDKSZYQOYIHEIN-UHFFFAOYSA-N 435.507 2.333 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(C(=O)O)c2)cc1 920482119 JRCXNTQEOSJOGI-UHFFFAOYSA-N 442.471 2.036 10 20 IECD C[C@H](NC(=O)CCC(=O)N1CC(=O)Nc2ccccc21)c1ccc(N2CCOCC2)cc1 920881295 MMISNDVYYHQRPG-KRWDZBQOSA-N 436.512 2.466 10 20 IECD Cc1ccc(CN(CC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccc3c(c2)OCCO3)s1 1319378413 XDPPLRFIRDUVDU-OAHLLOKOSA-N 436.555 2.138 10 20 IECD CO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799622400 OBBWVVRUAJTPGK-RPUPUWCGSA-N 425.529 2.332 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)C(F)F)sc2C1 1812659948 BUDKCAGXZVDWIS-YUWISIADSA-N 425.413 2.150 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1 1814186509 RBCDMHBDJDKJDK-APWZRJJASA-N 444.582 2.058 10 20 IECD CC[C@H](C)[C@@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)OC 26865175 XWPVWHGAHHVIIX-RNODOKPDSA-N 437.448 2.323 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1 28065275 BPYXKBXNFYAVCW-UHFFFAOYSA-N 446.573 2.009 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CC(=O)N(C)C2CCCCC2)CC1 97549410 RDEHBXOTVYUJIJ-UHFFFAOYSA-N 443.636 2.120 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 470528431 AJRMXZUCGQSCTO-OAQYLSRUSA-N 449.511 2.028 10 20 IECD COc1ccc(N2CCN(CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1 726582919 KHNXSXBGHAYSKJ-UHFFFAOYSA-N 425.445 2.152 10 20 IECD COc1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 727664816 BTYXMDCNJPCVDP-QGZVFWFLSA-N 426.473 2.164 10 20 IECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733311254 QOSXANHFKDMNCS-KBPBESRZSA-N 428.510 2.154 10 20 IECD COc1cc(OC)cc([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 735680124 DOZVGEXVKOGSQT-OAQYLSRUSA-N 433.480 2.212 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743717013 GGYLBJLYDHXJES-UHFFFAOYSA-N 445.541 2.214 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CN(C)S(=O)(=O)c1cccnc1 743809338 TYEKANURIBTFAD-UHFFFAOYSA-N 442.335 2.219 10 20 IECD Cn1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)c1 747944772 VGEBKNLXHJKSOG-UHFFFAOYSA-N 430.442 2.370 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 751097189 HYBKDIZHLGDYRA-DFQSSKMNSA-N 428.577 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)CNC(=O)N3CCc4ccccc4C3)CC2)cc1F 753737612 HDOQAOMYQXQIIZ-UHFFFAOYSA-N 426.492 2.251 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc4c(c3)COC4)CC2)cc(OC)c1OC 759105142 ZXLBJNOIRVIMBS-UHFFFAOYSA-N 434.514 2.254 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1 761057767 LJZONVVYKWGFJI-AWEZNQCLSA-N 439.468 2.256 10 20 IECD COc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc(OC)c1OC 765903773 LKIBVZYIKWSTOP-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)nc12 772328928 YYODKKFMKDCSGC-ZIAGYGMSSA-N 433.509 2.441 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 775046067 WRPYDFBKKKFBLY-SIKLNZKXSA-N 436.556 2.091 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1 775373271 QKGQXJAYNLUWIE-AWEZNQCLSA-N 446.529 2.161 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1[C@@H](C)C1CC1 784637825 HCOMSSHNABFKDV-HNNXBMFYSA-N 429.496 2.393 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@H]4C3)cc2)C1 785609128 PEAVCQYVZRPIGH-PLACYPQZSA-N 440.588 2.480 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(Br)o3)cc2)CC1 786120743 QXFAIFCWXPFZDX-UHFFFAOYSA-N 442.335 2.189 10 20 IECD CC1CCN([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C(C)C)CC1 787613650 BHWMBDQTDFPTIN-HSZRJFAPSA-N 444.620 2.354 10 20 IECD CC1CCN(CCCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 787896721 YKOSKGFBGKNPDN-HXUWFJFHSA-N 430.593 2.329 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@@H]12 788922801 YHCGIIONYKTMGX-VEYVCITQSA-N 429.536 2.344 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2sccc2C1 789724620 QGFXUJQQNZPFFS-INIZCTEOSA-N 426.586 2.310 10 20 IECD O=C(NCCCOc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800727 NZUDCGDYEXDPIW-UHFFFAOYSA-N 433.455 2.003 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCC3CCOCC3)cc2F)C[C@@H](C)O1 789821412 SQOOYHMFQLOOBV-IAGOWNOFSA-N 435.540 2.331 10 20 IECD COc1ccc(CNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c(O)c1 797390685 NAQSSAUOUHQMAC-CQSZACIVSA-N 445.903 2.279 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)c(OC)c1 800599820 XMKFOZUQCCUPAC-UHFFFAOYSA-N 441.528 2.476 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2ccccc2F)C1)c1ccc(N2CCOCC2)cc1 803304657 GODXDKLDZMEIQJ-HTAPYJJXSA-N 441.503 2.440 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@H]([C@H]2CCOC2)C1 803450503 JFHLYXUESKHRDR-HOTGVXAUSA-N 437.487 2.258 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 803451800 WKBZHQNPCUCNMR-VQIMIIECSA-N 437.487 2.447 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(c2cc(F)ccc2F)CC1 807290135 QMTFBJHNOBVTJP-UHFFFAOYSA-N 426.467 2.306 10 20 IECD CCC[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768332 HGDGDELBVIOGDX-MAUKXSAKSA-N 425.476 2.401 10 20 IECD CON(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854071 PCYMZZWEYAJCFD-UHFFFAOYSA-N 436.556 2.425 10 20 IECD CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)c1cc(NS(C)(=O)=O)ccc1O 816866772 XGEZDDHYEJUPEH-INIZCTEOSA-N 439.534 2.283 10 20 IECD O=C(O)[C@@H]1CC(=O)N(c2ccc(S(=O)(=O)NCc3ccc(N4CCCC4)cc3)cc2)C1 915220724 OWWGDBABTULZQA-QGZVFWFLSA-N 443.525 2.203 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1OC 917759085 CKNYDYSKOHOLFY-UHFFFAOYSA-N 432.451 2.095 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(Cl)s1 1785971650 IBZMFCWTAVSEJU-DRZSPHRISA-N 437.905 2.115 10 20 IECD Cc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c(C)c1 1787294542 OWTDNWMIOLTKEF-WDSOQIARSA-N 439.512 2.325 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992415 YCKPSKKQQCTVCL-YVEFUNNKSA-N 443.847 2.163 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cocn3)C2)CC1 1808762819 VOUXXASNBQMTKK-HWKANZROSA-N 427.457 2.350 10 20 IECD C/C=C/C(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1812537952 YFGNISYAFYIFAC-PQRYCNGKSA-N 431.496 2.456 10 20 IECD Cc1nscc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722334 XXHPTDQPFDDGNU-JTQLQIEISA-N 431.499 2.254 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](N)CN)n[nH]2)cc1 1818016820 PVIRHISQZNUUTD-PZJWPPBQSA-N 449.559 2.409 10 20 IECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)c[nH]1 1818333436 QLDFBTPAHPNGJB-AWEZNQCLSA-N 446.558 2.212 10 20 IECD Cc1ccccc1NCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842986362 OUDLEOHRVRQAGC-UHFFFAOYSA-N 445.523 2.403 10 20 IECD O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249395 GGMYFNHGFGRJKY-UHFFFAOYSA-N 428.395 2.383 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(N3CCCC3)c(F)c2)C1 1844713981 MNRKZFSGSYFKTB-UHFFFAOYSA-N 440.475 2.363 10 20 IECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1cccc1C=O 1845500921 FJUSRSACKWIGQI-ZDUSSCGKSA-N 431.876 2.443 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(CC(F)(F)C(F)F)CC1 303552805 JWPVWWQFTBBWDD-UHFFFAOYSA-N 436.425 2.390 10 20 IECD COc1c(C)cc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 726976828 QTEXGFQMDBAULX-UHFFFAOYSA-N 438.571 2.025 10 20 IECD COc1cccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)c1O 727762507 NJMLSDMVIFQDOJ-KRWDZBQOSA-N 438.571 2.426 10 20 IECD CCN(CC(=O)NCC(C)(C)N1CCOCC1)Cc1cc(Br)ccc1O 743871038 NPYKWACRLNZBQE-UHFFFAOYSA-N 428.371 2.204 10 20 IECD CCN(CC(=O)N[C@H](C)C(=O)N1CCCCC1)Cc1cc(Br)ccc1O 743873646 PMJRMCDHJNTZBD-CQSZACIVSA-N 426.355 2.494 10 20 IECD CC[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC1 753010255 SIPZOCJWKSIRQL-YJBOKZPZSA-N 440.491 2.193 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H]4CN(c5ccccc5)C[C@H]4C3)CC2)cc1 754011505 LIWSSJIFTJHQHU-RQTOMXEWSA-N 436.600 2.246 10 20 IECD COc1ccc(C)cc1NC(=O)CNC(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 756337349 UQSOPEJLUMOXPV-IBGZPJMESA-N 441.528 2.445 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(c2nc(F)c(F)cc2F)CC1 758457867 JCXBOBJDBYVDSU-UHFFFAOYSA-N 435.450 2.367 10 20 IECD CN1CCN(c2ncccc2CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 761177380 OGJYOELBGIMBFJ-UHFFFAOYSA-N 429.908 2.157 10 20 IECD CCC(=O)c1cccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 771213016 NNGBDYLEIGNFEW-UHFFFAOYSA-N 438.528 2.165 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccccc3CO)cc2F)C[C@@H](C)O1 787065921 JBNKSLSRGPQLMJ-IAGOWNOFSA-N 444.503 2.334 10 20 IECD CC(C)CN1C[C@H]2CN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CCN2C1=O 787066223 UDOHAZOWJPTDNH-WIYYLYMNSA-N 429.565 2.372 10 20 IECD O=C(NCCN1CCC2(CCCCC2)CC1)C(=O)NCc1ccc(N2CCOCC2)cc1 788324357 UXUQZNFEMQZAPT-UHFFFAOYSA-N 442.604 2.302 10 20 IECD CCO[C@@H]1C[C@](O)(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 788690541 KHBAYRASDPGGIC-QPPBQGQZSA-N 448.608 2.073 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2Cc3c(OC)ccc(OC)c3[C@H](O)C2)cc1 788951554 LXLCIKGLTOGMES-LJQANCHMSA-N 441.528 2.242 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 793910937 KRWYYAYMWJCYLD-RCLSDMTESA-N 431.577 2.382 10 20 IECD CN1CCN(CCOc2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)CC1 799184430 KPNTXNZPTFHKHB-UHFFFAOYSA-N 433.559 2.118 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3c(F)ccc([N+](=O)[O-])c3C)CC2)cc1F 800614390 SJOKYABAZPHHSW-UHFFFAOYSA-N 434.399 2.477 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCS(=O)(=O)CC3)cc2Cl)C1 800720593 UZAWVEFHQJPAHJ-HNNXBMFYSA-N 443.997 2.315 10 20 IECD CCCCN(CC(=O)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801596725 LWYJENQHHUDEIO-VQTJNVASSA-N 438.590 2.189 10 20 IECD CCC[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803449005 LDDHDQMHRQEWCB-GOSISDBHSA-N 425.476 2.401 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cc1F 803663508 QKNNUWFTPFIXFY-QGZVFWFLSA-N 446.910 2.473 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCCCSc3nccs3)C2)n1 806275450 HFDUOMNBBNHFMC-OAHLLOKOSA-N 447.586 2.322 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 807195578 HTIJDJLBJLDDRY-IMJJTQAJSA-N 425.323 2.433 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)c2c(F)cccc2F)CC1)c1ccc(N(C)C)cc1 807675737 AGBZRKXYPZHEMX-HNNXBMFYSA-N 444.482 2.193 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCC[C@@H]1CCO 807771014 QZUHXLDYVAUPKN-DOTOQJQBSA-N 425.476 2.137 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1 808032458 XJOFIXIWXRPGLO-MJGOQNOKSA-N 432.565 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccn(C4CCCC4)n3)CC2)cc1 809073847 CXEHEZUXUZFTJJ-UHFFFAOYSA-N 425.533 2.362 10 20 IECD CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918438539 GRINVIAWZBVEDC-UHFFFAOYSA-N 443.475 2.218 10 20 IECD CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)cc1 1787295361 KAULFPMQCYHBHN-IHPCNDPISA-N 439.512 2.352 10 20 IECD COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1C 1793891720 IFQKGFNZZWJXRJ-BCDXTJNWSA-N 425.485 2.304 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H]1CCCCC1(F)F 1804334241 KNGVIMPZGGZLAJ-CRWXNKLISA-N 445.557 2.310 10 20 IECD Cc1noc(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992236 WTQJVSKWLIZWBI-YWZLYKJASA-N 437.456 2.126 10 20 IECD Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816720297 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432.546 2.468 10 20 IECD CN1CCC(N(C)CCN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 751032125 DMPDVXWBVHKFDG-UHFFFAOYSA-N 448.567 2.358 10 20 IECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NCc2cccc(OC)c2O)c1 751309286 KEEYDPXJBCEJNE-HJWRWDBZSA-N 437.470 2.083 10 20 IECD COC[C@@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(F)c1 754170680 XLOSNCZWQGAUCM-AUSIDOKSSA-N 435.515 2.434 10 20 IECD CCCNC(=O)C1(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 754666337 NQULQFRFEIWMEX-UHFFFAOYSA-N 434.556 2.097 10 20 IECD O=C(N[C@H]1CCCC[C@@H]1O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 757904055 DCACXHHGCGFLNF-WMZOPIPTSA-N 435.458 2.135 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)(F)F)CC3)cc2F)C[C@@H](C)O1 760984509 PAMVBOWJPQIYQP-HUUCEWRRSA-N 447.473 2.445 10 20 IECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)NCc1cccc(Br)c1O 765729560 OPWSDRVSJHGTKD-UHFFFAOYSA-N 441.347 2.420 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H](O)[C@H](C)C3)c2C)c1 768765380 DLEBSRUSABCTGU-ZUOKHONESA-N 428.485 2.163 10 20 IECD 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O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc(Cl)nc1 1814324109 FZQWYPSREVWKEI-CYBMUJFWSA-N 443.851 2.279 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2cncn2c1 1819184308 TXAFPTHTTXZCKR-QGZVFWFLSA-N 447.455 2.483 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427107 PNWDJJNPQWSYJO-APWZRJJASA-N 441.532 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)cc1 725934601 FPFVELPZEJOBJK-UHFFFAOYSA-N 435.383 2.387 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(Cl)c(C(N)=O)c3)CC2)cc1 726725451 DTFIPEPDZSXWKQ-UHFFFAOYSA-N 430.892 2.171 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3csc(-c4nc[nH]n4)n3)cc2F)CC1 730286611 QXJBOYFRFSWHIJ-UHFFFAOYSA-N 429.525 2.068 10 20 IECD CCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCN(c2ccccc2)C1=O 731848463 SGFSBIRUTKOCBW-QHCPKHFHSA-N 436.556 2.471 10 20 IECD CN(C)CCN(CCN(C)C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903243 DNRWPSLCJQXWBW-QGZVFWFLSA-N 427.540 2.392 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 747251713 AQLPXQPBPKOUJU-HNNXBMFYSA-N 434.514 2.358 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)OCC(C)C)CC2)c1 749246624 TUQYKDYVHKFGFL-UHFFFAOYSA-N 433.549 2.337 10 20 IECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 750254553 YDAIAUGBAFQRPN-UHFFFAOYSA-N 438.528 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N4CCCC4=O)cc3)CC2)cc1F 754216082 SUEBWOVCQCDBQT-UHFFFAOYSA-N 440.475 2.248 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nc4sccc4c(=O)n3C)CC2)cc1 758196866 KWMBPJPKEVKURD-MRXNPFEDSA-N 446.598 2.279 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CC2)cc(OC)c1OC 759946775 VHSCBGPJYFFDMQ-UHFFFAOYSA-N 432.452 2.305 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](S(C)(=O)=O)C1 763910304 CXOAHQFDNJYNBM-HOCLYGCPSA-N 440.521 2.298 10 20 IECD Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 765170373 NTLSKBRFGMFXLK-QGZVFWFLSA-N 446.529 2.392 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC([C@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904704 GEPALKLRDJJNLH-CTNGQTDRSA-N 445.526 2.203 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1 771190185 IVWXGXUHKYMPSN-UHFFFAOYSA-N 436.516 2.014 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccnc1 774131867 YJCSSUCWJUFURJ-CQSZACIVSA-N 436.434 2.431 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 774862227 WWRJUYUJQAACBL-QFIPXVFZSA-N 442.535 2.040 10 20 IECD C[C@H](NC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccc(N(C)C)cc1 776268720 FQDHJJLMCQDACV-HNNXBMFYSA-N 433.530 2.070 10 20 IECD O=C(CS(=O)(=O)Cc1ccc(Br)cc1)OCC(=O)c1ccc(O)c(O)c1 782900059 VVQRJVAIOBYSIN-UHFFFAOYSA-N 443.271 2.201 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785297584 QFEDVUAJRUXLSE-CQSZACIVSA-N 449.529 2.326 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3CCN(CC(F)(F)F)CC3)cc2)CC1 786659748 NHWAHOCVQPHDNH-UHFFFAOYSA-N 426.483 2.246 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)cc2)CC1 786660113 WBKFRDBKHLFNCM-AKHDSKFASA-N 425.451 2.327 10 20 IECD C[C@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799734 PTJIYEIJDIZZPZ-KKSFZXQISA-N 426.492 2.283 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cnc[nH]4)CC3)cc2F)C[C@@H](C)O1 789817144 GBECYPMBDFGJFN-HZPDHXFCSA-N 443.523 2.185 10 20 IECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823742 FWHHYXWCYWTMMV-KFWWJZLASA-N 446.523 2.408 10 20 IECD C[C@H](c1cccs1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793731532 FLIPEBOYSFUYNZ-NVXWUHKLSA-N 428.558 2.286 10 20 IECD C[C@H]1CN(CCOC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCO1 800217111 KZRPOJMWSDXYPR-ZDUSSCGKSA-N 426.516 2.132 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1)c1ccc(N2CCOCC2)cc1 803310149 HIBCNNUHJWXURE-SFHVURJKSA-N 445.523 2.474 10 20 IECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC12CCCCC2 803689145 LMUNWAQMBWFLEO-UHFFFAOYSA-N 426.561 2.079 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)cc1F 804852498 AZYUEIXWICZATJ-SAHWJRBASA-N 435.540 2.473 10 20 IECD CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 805006724 COVIBLBEYGLLTJ-LEWJYISDSA-N 448.583 2.246 10 20 IECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)[C@H]1CN(Cc2ccccc2)CCO1 806282259 JGPLRDBMAQEMTO-FUHWJXTLSA-N 448.614 2.147 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1CCN(C(=O)c2cccnc2)CC1 919968557 FUAUBGQQOYGTMM-UHFFFAOYSA-N 436.556 2.459 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2)c1ccc(N2CCOCC2)cc1 920925064 HBVXJGGEYCWKAG-CQSZACIVSA-N 440.525 2.383 10 20 IECD CCOC(=O)c1ncc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 1118780501 XGTKVIQABZGDEJ-UHFFFAOYSA-N 432.546 2.271 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1[C@H]2SC=C[C@H]21 1796934718 HCVWMHROGRVWRZ-LYWMGSQXSA-N 436.537 2.293 10 20 IECD Cn1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c(C(F)F)n1 1810552271 UWXFYPLTOJTERI-UHFFFAOYSA-N 449.458 2.323 10 20 IECD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721523 MNAMZTXTBOJYJL-ZDUSSCGKSA-N 425.470 2.192 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1cc(O)nc(O)c1 1817848695 XXHYCMOXEPVVRD-XJKSGUPXSA-N 429.477 2.339 10 20 IECD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc(O)c(O)c3O)n[nH]2)COC1 1823477462 UFYIHBFLFDCVGS-VFADXPBXSA-N 442.472 2.269 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827429314 SPXBKEPUKNPSLK-LPHOPBHVSA-N 441.532 2.492 10 20 IECD COc1ncc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1C 1843441396 RIMSPMGSVYUZJC-UHFFFAOYSA-N 447.495 2.009 10 20 IECD CNC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 728681769 RGCFKLFFBBFBPN-UHFFFAOYSA-N 443.415 2.012 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)Cc3c[nH]c4ccccc34)cc2)C1 729598613 HNOKTFMISZWXTD-AZUAARDMSA-N 449.555 2.272 10 20 IECD NS(=O)(=O)c1ccc(F)c(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 734675827 KFWAOONYVBQDAC-MRXNPFEDSA-N 437.493 2.070 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1OC 739945453 PXZNJXFNZGWUQV-UHFFFAOYSA-N 434.514 2.391 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c1 743337551 WAVWJNNQHBGONP-AWEZNQCLSA-N 431.514 2.439 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1 743807144 AFRKTVWUQPSTJR-UHFFFAOYSA-N 430.324 2.395 10 20 IECD CN(C)c1ccc(CNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1F 746804117 UQBLTLUBWHKGIQ-PRUHCIRGSA-N 438.503 2.311 10 20 IECD COCCNC(=O)Cn1cc(NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1 747572378 SXFOIVKQNWXIPC-UHFFFAOYSA-N 428.537 2.300 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CC[C@](C)(O)C3)c2C)c1 748831991 CLYQJZINHLVMAS-QHCPKHFHSA-N 428.485 2.307 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 749914584 XTRSNWSEKCRDRN-UHFFFAOYSA-N 445.541 2.009 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 754050699 QRXMENCNWVDNDI-RTWAWAEBSA-N 448.608 2.119 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN(C)c2ccccc2S(C)(=O)=O)c1 754753347 BAPBVEJQPSLLMP-UHFFFAOYSA-N 432.542 2.467 10 20 IECD COc1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)ccc1S(=O)(=O)N(C)C 757913703 QNIPEOXRBQGCER-UHFFFAOYSA-N 448.545 2.104 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1nc2ccccn2n1 760032413 NXFLTDPAKIIVSR-UHFFFAOYSA-N 447.478 2.307 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccc([S@@](C)=O)cc3)CC2)cc(OC)c1OC 760129206 WTEWFTYFSQFBBD-WJOKGBTCSA-N 447.557 2.482 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2C1=O 765903215 HUSJUZNMTAHKON-UHFFFAOYSA-N 432.274 2.038 10 20 IECD CCC[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768521912 LQTCLNUWZULCMJ-HLFMIMNKSA-N 434.512 2.166 10 20 IECD Cc1nnc([C@H]2Cc3ccccc3CN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 769893878 AMCVUQQOEZIKAM-QGZVFWFLSA-N 428.470 2.395 10 20 IECD C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770065804 GXBKZBVRVZIDNN-STQMWFEESA-N 427.523 2.282 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC4(CCOCC4)C3)cc2F)C[C@H](C)O1 784598415 OCPMQPJNEVIXKC-OALUTQOASA-N 449.567 2.185 10 20 IECD COc1cc(N[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)cc(OC)c1 785433975 QUWUFQKOZVEHMG-SFHVURJKSA-N 440.544 2.489 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)c3ccc(S(C)(=O)=O)cc3)cc2)CC1 786259191 MHVYWAWGIKIBJY-KRWDZBQOSA-N 443.569 2.179 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)cc2)CC1 786656159 LBQUDAOFAQBHOD-UHFFFAOYSA-N 448.483 2.379 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@H](C)O1 787196954 ILNSWOMNMLNRFM-ROUUACIJSA-N 439.560 2.036 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CCN(CC2CC2)CC1 788486508 WKTXKGIRSWVFSZ-UHFFFAOYSA-N 438.366 2.494 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1(c2ccc(F)cc2)CC1 789759343 VJIWXQHCUMYWQR-UHFFFAOYSA-N 429.467 2.266 10 20 IECD CCO[C@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCC1 789800730 OAIBSSHXJWGZAF-OAQYLSRUSA-N 435.540 2.380 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Cl)c1 789800833 PYSWQPXXLONECJ-UHFFFAOYSA-N 449.910 2.299 10 20 IECD Cc1ccn(C[C@@](C)(O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(=O)c1 790626304 DCCQFJCJQFXTSS-JOCHJYFZSA-N 435.471 2.294 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(CCO)c3-c3ccccc3)cc2)C1 793133279 UKJLRTXULDXJQW-FQEVSTJZSA-N 447.539 2.174 10 20 IECD Cc1ccccc1[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793730681 CFOSYMFXVUTIFG-NHCUHLMSSA-N 448.567 2.329 10 20 IECD C[C@H]1CN(C(=O)C(C)(C)C)C[C@H](C)N1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795123165 PVJMDGBKXVVXAF-ROUUACIJSA-N 448.583 2.246 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2)CC1 797623824 ODRSJVRUPMTXCH-INIZCTEOSA-N 442.516 2.146 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C)(NC(=O)OC(C)(C)C)CC2)cc1F 803664265 ISXUQJPWCQOQRV-UHFFFAOYSA-N 436.528 2.414 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 810164095 ACIDPPPADVWPCK-UHFFFAOYSA-N 445.585 2.107 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1F 810413374 FTZPKTVDBGDRIB-UHFFFAOYSA-N 443.200 2.474 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cn(Cc2ccccc2)nn1 815647869 XINDTPONXQDVGF-UHFFFAOYSA-N 430.262 2.049 10 20 IECD COc1ccc(OCC[S@@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 912938867 SQAPCDCUSVFPMO-SSEXGKCCSA-N 432.542 2.180 10 20 IECD O=C(NC[C@@H]1CCCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 918372286 IXMCEWIHLOSAMF-ZDUSSCGKSA-N 435.458 2.258 10 20 IECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918439960 ZUIDBCTYVNECQT-UHFFFAOYSA-N 426.542 2.163 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C[C@H](C)O1 918443502 CNIQKZJALIQKIU-HOTGVXAUSA-N 425.485 2.239 10 20 IECD C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1 919789774 CFWBBKGGUMRWII-MRXNPFEDSA-N 432.546 2.073 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)CC2)cc1 1253443233 SKQKJNZQZNZUFT-UHFFFAOYSA-N 433.486 2.359 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(=O)(=O)Cc4ccccc4)CC3)cc2F)CC1 1324711404 AHNSFJXYEIHNMM-UHFFFAOYSA-N 446.592 2.225 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(Br)c2O)cc1 1343551868 GMFUQEBEEVJUSM-UHFFFAOYSA-N 443.319 2.148 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(Cl)c(F)c1 1790016816 FYKMRLGWQKULLA-JDFRZJQESA-N 449.866 2.192 10 20 IECD O=C(CCc1ccc2c(c1)OCO2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599276 JWIKBUVBIHYEOS-BJWYYQGGSA-N 439.468 2.106 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1798531676 CPXFRXGTKPECSV-NOFFMGQBSA-N 447.582 2.490 10 20 IECD COc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1798818532 GAKKZOHAGLSPCS-HBCWATKFSA-N 446.887 2.277 10 20 IECD CC(C)OCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805023347 KTHFUBIHALCHTF-FNORWQNLSA-N 432.517 2.473 10 20 IECD Cc1noc(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992231 WTQJVSKWLIZWBI-MGPUTAFESA-N 437.456 2.126 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993510 IZZDCFRVDYUWEA-AEIQOCSMSA-N 426.448 2.100 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ccon3)C2)CC1 1808729037 XFSDRUQBDLLDEZ-UHFFFAOYSA-N 435.484 2.312 10 20 IECD O=C(Cc1ccccc1O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1812701650 DHUSDENHUNWUGB-UZUQRXQVSA-N 448.479 2.156 10 20 IECD Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816720296 JGKDHWHDQGSXME-AWEZNQCLSA-N 439.497 2.121 10 20 IECD CCc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)co1 1817846391 VIEXSXDFDDEHQL-CQSZACIVSA-N 426.433 2.386 10 20 IECD Cn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823709106 ZBYBHFKDXURLOS-JTQLQIEISA-N 447.904 2.481 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1824843701 CHSDEZFDDIBWTL-GFCCVEGCSA-N 441.488 2.350 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)n(-c2ccccc2)n1 1843249988 YFTVFRBIIYUAKB-UHFFFAOYSA-N 433.468 2.118 10 20 IECD Cc1cc(C)n(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845502285 IUSDPPXOWIXOQF-UHFFFAOYSA-N 432.908 2.472 10 20 IECD O=C(c1ccc2c(c1)OCO2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037912 WYQUZJIJBLYDHQ-QPJJXVBHSA-N 438.436 2.063 10 20 IECD Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 508120165 OSEHVYBESOSBCT-MRXNPFEDSA-N 441.553 2.390 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc(C(=O)OC)cs3)cc2F)CC1 730269398 XGUWVIOTPPVNSS-UHFFFAOYSA-N 441.550 2.294 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 732923282 SOWYOIUZXCIWNF-UHFFFAOYSA-N 434.518 2.012 10 20 IECD Cc1cc(-c2csc(CS(C)(=O)=O)n2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739987685 VGDPKJNVBAAAKY-UHFFFAOYSA-N 425.557 2.410 10 20 IECD CN1CCCc2cc(CNC(=O)NCC[C@](O)(c3nccn3C)C(F)(F)F)ccc21 746724503 MESFUVPKYQSZBA-IBGZPJMESA-N 425.455 2.442 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cncc(Br)c1 751228294 OZSJWFOEGHFPDD-UHFFFAOYSA-N 444.326 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)CCOc3ccc(S(C)(=O)=O)cc3)CC2)cc1F 753745303 LRCQRYOVWFDOIG-UHFFFAOYSA-N 436.505 2.356 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C(=O)NC4CC4)cc3)CC2)cc1F 754212125 GHTOSDASTKCPFB-UHFFFAOYSA-N 440.475 2.014 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C 754641364 BIXGJLCYADXADR-HXUWFJFHSA-N 429.586 2.390 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3Cc4cccc(O)c4C3)CC2)cc(OC)c1OC 759486539 JRLCNABPPHDFNI-MRXNPFEDSA-N 427.501 2.417 10 20 IECD COCCN(CC(=O)Nc1cc(-n2nnnc2C)ccc1F)c1ccc(OC)c(OC)c1 760856771 IIOYMOLMCLCKFC-UHFFFAOYSA-N 444.467 2.219 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)nc2)c1C 762873829 ASWZQIITNWTINY-UHFFFAOYSA-N 427.482 2.485 10 20 IECD Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 766248456 JUMVXXAMXQGGKF-UHFFFAOYSA-N 430.436 2.442 10 20 IECD Cn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(-c2cccs2)n1 768336707 IQLFIJOCBRHHQU-UHFFFAOYSA-N 430.555 2.313 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)cc3F)cc2F)C[C@H](C)O1 769743244 VVQJCFOAKXVKPQ-STQMWFEESA-N 439.484 2.156 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C)nc5cc(C)nn45)n3)CC2)cc1 771065818 GXJXGZWCQICNBS-UHFFFAOYSA-N 447.499 2.296 10 20 IECD CC(C)N(CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 774792109 ZVEPTOALDHDENY-ROUUACIJSA-N 436.572 2.291 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CCN4C(C)=O)CC2)cc1 778220342 UWACDSORUQPFGE-KTKRTIGZSA-N 448.523 2.448 10 20 IECD CCN(C[C@@H](O)C(F)(F)F)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 779521436 ZNTIJMINYIFBBY-GOSISDBHSA-N 432.487 2.162 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)CC2)cc1 788823983 STVJHNFABSMEEJ-FQEVSTJZSA-N 444.576 2.190 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@@H]1SCCc2ccccc21 789802416 YIGBBIBTQJAKRA-NRFANRHFSA-N 443.544 2.425 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCCC1 790191934 XXQLOHAQSXFCEI-IAGOWNOFSA-N 438.519 2.221 10 20 IECD COc1ccc(Cn2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cn2)cc1 792971029 YXEYBROZJOQPMI-UHFFFAOYSA-N 449.511 2.032 10 20 IECD O=S(=O)(NCc1cccc(Br)c1O)c1ccc(Cl)c(-c2nn[nH]n2)c1 799818501 LPSYIAWRZVWNJU-UHFFFAOYSA-N 444.698 2.467 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2O[C@H](C)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 800302772 BMXVHBSHCRSHDJ-WVSMJXTDSA-N 434.514 2.281 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c(OC)c1 800599507 SJCPFBSUSAQPPJ-UHFFFAOYSA-N 445.491 2.367 10 20 IECD CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCC(CO)CC1 803448281 NMNPGGIFVFTPAX-UHFFFAOYSA-N 439.503 2.383 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(OCCCO)cc3)CC2)cc1 804757954 MIMFQIQHASLATB-VAWYXSNFSA-N 439.512 2.300 10 20 IECD Cc1cc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2)no1 805023708 KNGFVURZVSXAQB-UHFFFAOYSA-N 439.560 2.180 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 806856077 ATZKBSALFQGEAU-UHFFFAOYSA-N 438.528 2.465 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 807835164 VWILZMCLBRCLCN-INIZCTEOSA-N 443.500 2.497 10 20 IECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808856370 SRZQTGBQNYGMGZ-SFHVURJKSA-N 430.618 2.189 10 20 IECD O=C(Nc1cccc2c1COC2=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808939606 MQMCDABSCNGVBX-OAHLLOKOSA-N 443.887 2.435 10 20 IECD CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 814330725 MGLUFRISNQKTKS-GOSISDBHSA-N 439.578 2.087 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CCC(OC[C@H]4CCCO4)CC3)nc12 815344216 LBRZJBXJHUGXJH-BDVYOWHSSA-N 447.488 2.409 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2)C1 918117688 HPMJTRGZQMMDTQ-YADHBBJMSA-N 435.572 2.462 10 20 IECD CCc1nc2ccccc2n1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918336417 ZTEURFQORHJQTR-UHFFFAOYSA-N 426.542 2.150 10 20 IECD CC1(C)CC(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)C1 1784025066 HXFBNAPWOPVSMG-XMMPIXPASA-N 438.528 2.045 10 20 IECD CC(C)=CCCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509825 GOWUIVQZTDLGDW-ISGGHPHESA-N 430.501 2.393 10 20 IECD CCc1[nH]nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1F 1794853589 WLUPHKNWWBXNFJ-IRRWCRNKSA-N 444.463 2.193 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccsc1)C2)c1cc(O)c(O)c(Cl)c1 1799770749 CIUVPJLVYFBOBD-ZSBFGKGUSA-N 436.917 2.259 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)C1 1810551086 AUIJSJYAGHCJNJ-LJQANCHMSA-N 437.496 2.341 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C(O)O)n[nH]2)cc1 1814710945 UJPUSZYWHHFDCL-IBGZPJMESA-N 437.500 2.434 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nccn3c2)[nH]n1)c1cc(O)nc(O)c1 1817845319 JXAWJXDCRVXLPW-INIZCTEOSA-N 447.455 2.483 10 20 IECD O=C(CC1CC1)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834560598 CZPOXSRQBOYXBY-GQCTYLIASA-N 443.544 2.188 10 20 IECD CCc1ccnc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843442113 YXDPESNRTAXZIE-UHFFFAOYSA-N 431.496 2.254 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccc(C)c(O)c2O)cc1 110005023 VPLNSRVTUFHMNC-UHFFFAOYSA-N 436.486 2.232 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc([C@@H](C)OC)c3)CC2)cc1 727035431 QEMMCEKOGHMAFO-GOSISDBHSA-N 440.544 2.280 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2Br)cc1C(=O)O 728015214 MCBHEBKOGNWBMY-UHFFFAOYSA-N 449.304 2.320 10 20 IECD C[C@@H](OC(=O)C1(C(=O)NC2CC2)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729714331 HFZYDBPVBYFLNB-CYBMUJFWSA-N 446.459 2.391 10 20 IECD CC(C)N(CCCNC(=O)CN(Cc1ccccc1O)C1CCCC1)S(C)(=O)=O 732204632 POXGXWMENFNDIC-UHFFFAOYSA-N 425.595 2.313 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCN(C4CCCC4)CC3)CC2)cc1 738991648 RMYOPRYLHTUMEY-UHFFFAOYSA-N 429.609 2.477 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C3)nc12 740880062 SDIJOGJVEOXOKO-CZUORRHYSA-N 433.509 2.347 10 20 IECD COc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c(SC)cc1OC 741303861 ZIDOGNAIWSUIQJ-ZSOIEALJSA-N 448.613 2.176 10 20 IECD CCN(CC(=O)N[C@@H](C)C(=O)N1CCCCC1)Cc1cc(Br)ccc1O 743873645 PMJRMCDHJNTZBD-AWEZNQCLSA-N 426.355 2.494 10 20 IECD CCOC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 743888174 YXLUPNIDMGQMFP-UHFFFAOYSA-N 449.504 2.464 10 20 IECD CC(=O)c1cc(F)cc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1O 748051009 MQOOOLVCMRXEGF-UHFFFAOYSA-N 449.504 2.232 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](N(C)Cc4ccccc4)C3)CC2)cc1 754050240 IYBNASFUZDYPNY-JWQCQUIFSA-N 438.616 2.384 10 20 IECD CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 755329696 ZOIBKIFPGVWWTA-ACJLOTCBSA-N 449.485 2.334 10 20 IECD Cc1oc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1S(N)(=O)=O 755638007 JXAJNSYJVIBPDR-UHFFFAOYSA-N 447.435 2.021 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnn(CC(F)(F)F)c3)CC2)cc1 762442613 QBOSTLMOGMFHTA-UHFFFAOYSA-N 425.411 2.178 10 20 IECD CCc1nn(C)c(CC)c1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(OC)c1 766316764 ANNGHZGBEFILQJ-UHFFFAOYSA-N 430.552 2.116 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]4[C@@H](CCCN4C)C3)CC2)cc1 766845885 MHPVKAYGMSAVCP-NZQKXSOJSA-N 429.609 2.333 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H](O)C(F)(F)F)CC3)cc2)C1 766880060 IVJXNPAYUMHSMH-SJLPKXTDSA-N 442.482 2.233 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4nnc(C(C)(C)C)n4c3)nc12 769204770 JROMXVVEEMZUIZ-UHFFFAOYSA-N 438.444 2.309 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 773242702 AHQYCJWXSGEVCN-UHFFFAOYSA-N 433.455 2.498 10 20 IECD COc1ccccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 774725986 TZEQRMONHACCHG-IYBDPMFKSA-N 429.492 2.381 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccn(C(F)F)n1 775670382 XUMLAFFVVPEDMT-UHFFFAOYSA-N 431.422 2.464 10 20 IECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H](C)C1=O 778262620 LSLYPVMOORTINY-GBESFXJTSA-N 448.583 2.244 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2cccc(C(N)=O)n2)NC(=O)OC(C)(C)C)cc1 782003944 WTXNSIQBQWGONK-GOSISDBHSA-N 427.505 2.242 10 20 IECD CN(C)CCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 782360617 WZFWKXMKTWMDDE-UHFFFAOYSA-N 442.535 2.146 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc([C@@H](C)N2CCOCC2)c1 785295619 XMMXRZMUDZVVNK-JKSUJKDBSA-N 427.501 2.177 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3c(C)cccc3F)CC2)cc1 785529104 LLTFNKLJOSQSHA-UHFFFAOYSA-N 442.535 2.087 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)CC1 786262953 QZCVKTNCVRYIFG-UHFFFAOYSA-N 425.489 2.382 10 20 IECD COc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 787871184 HWLIYOGCDTWCSK-KRWDZBQOSA-N 443.519 2.425 10 20 IECD CC(C)[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734025 OWMHJAHISBQEGF-SESVDKBCSA-N 428.577 2.336 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 803132670 LOKQIUYFOGECHQ-QGZVFWFLSA-N 432.565 2.441 10 20 IECD C[C@H](NC(=O)C(=O)NCCN1c2ccccc2C[C@@H]1C)c1ccc(N2CCOCC2)cc1 803312281 WPYHXQBCVMQXRN-OALUTQOASA-N 436.556 2.268 10 20 IECD O=C(N[C@H]1CCN(CC(F)(F)F)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803388310 XJPOTXQCSNGTNR-HNNXBMFYSA-N 425.407 2.267 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 803450066 CIUABNUDLNGTSC-IPMKNSEASA-N 449.498 2.447 10 20 IECD C[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1=CCN(C)CC1 803451450 LETANNSHSNSBIQ-OAHLLOKOSA-N 436.503 2.140 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315950 WBGDSMSMVWDJLE-FQEVSTJZSA-N 425.529 2.154 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(CCOC(C)C)CC3)cc2)CC1 805025558 UXOXDVQQPDQWQM-UHFFFAOYSA-N 430.593 2.108 10 20 IECD CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 806277269 VZRHJFXUNABRMG-CQSZACIVSA-N 426.608 2.142 10 20 IECD CCNC(=O)COc1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807511746 UMOIRRVCTHXSPE-UHFFFAOYSA-N 440.283 2.469 10 20 IECD CCCc1nnc(SCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1N 813436141 RCBFVDVBBYDXFQ-UHFFFAOYSA-N 440.520 2.423 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCN(C(=O)c2cccnc2)CC1 919969086 FHIFMGHHXYXPBH-UHFFFAOYSA-N 440.519 2.350 10 20 IECD COC(=O)c1cc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)oc1C 1115856342 QSGLPUAEZXOJQG-UHFFFAOYSA-N 444.532 2.395 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1F)C2)c1cc(O)nc(O)c1 1777850667 CVEYEFSEUKETOD-VGOFRKELSA-N 429.448 2.073 10 20 IECD CCn1nc(C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782001398 JSSUPSJAKRVMBQ-OAQYLSRUSA-N 448.907 2.033 10 20 IECD COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C)c1 1796603232 FZKZAZNMPAXYSH-BJWYYQGGSA-N 439.468 2.153 10 20 IECD COc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(F)c1 1796604463 JLFAZNGYJGKWKC-CLLJXQQHSA-N 433.411 2.345 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnn2n1)c1cc(O)c(O)c(Cl)c1 1799106533 KYOSDMNGQYHNPP-BTTYYORXSA-N 441.875 2.360 10 20 IECD CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813698042 IBNOKKTYIDNQIA-UUHFFZMRSA-N 446.598 2.160 10 20 IECD CCc1noc(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1820649570 LSKVRLBPTBLFOV-LLVKDONJSA-N 443.485 2.348 10 20 IECD C[C@@H](CN)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826801731 FGSUJWNFRQFPGK-WHFNLZNOSA-N 431.533 2.031 10 20 IECD O=C1Cc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)c(O)c(Cl)c4)C3)ccc2N1 1845501396 KXQUQVOFMOKAFH-UHFFFAOYSA-N 441.871 2.377 10 20 IECD CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 18215223 QUEIVXZBBINDMA-UHFFFAOYSA-N 449.533 2.076 10 20 IECD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NCc2ccc(N(CC)CC)cc2)CC1 728948030 BJRFMQGHBUFHNF-UHFFFAOYSA-N 432.565 2.476 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H](c1ccccc1)N1CCC(O)CC1 729522955 AMVBBKYWCOVGRL-QHCPKHFHSA-N 427.520 2.477 10 20 IECD CC(=O)NC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCCC1 731255920 JTUUXEDSHLPUMQ-HOTGVXAUSA-N 449.523 2.048 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(OC(F)F)cc3)CC2)cc1 743432806 SNWUGLNKHAAALA-UHFFFAOYSA-N 448.470 2.174 10 20 IECD O=C(NCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccco1 748025530 ZRDZDDIKCRETJM-UHFFFAOYSA-N 435.483 2.007 10 20 IECD Cc1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1N1C(=O)CCC1=O 749731426 PBEUVKPIIUFINU-UHFFFAOYSA-N 432.527 2.342 10 20 IECD CN(Cc1ccccc1O)S(=O)(=O)c1cc2c(cc1Br)NC(=O)CO2 751239355 HJSLDZCTHFYXEY-UHFFFAOYSA-N 427.276 2.306 10 20 IECD COc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(Br)o3)CC2)cc1F 754028192 NZPNGBXUFGIGJL-UHFFFAOYSA-N 440.269 2.268 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n(Cc2ccccc2)n1 756766450 PTOMVXCPIWYRQC-UHFFFAOYSA-N 433.512 2.331 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 773763562 RVGIFSDTHWDYBU-QFBILLFUSA-N 432.542 2.387 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(=O)(=O)N(C)C)cn1C 778891870 INDYCOAHISXZJV-UHFFFAOYSA-N 444.351 2.406 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nccn1C 785643923 QQHGTMMHFKQFKR-OAQYLSRUSA-N 435.528 2.359 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](NC(N)=O)c3ccccc3C)cc2)CC1 786260533 YJEXLHIVZZKKRC-JOCHJYFZSA-N 437.544 2.079 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 788929865 LMGRMMNXVLEQHT-QGZVFWFLSA-N 430.549 2.371 10 20 IECD COc1cccc(CNS(=O)(=O)c2cc(Cl)cc(C(=O)N(C)C)c2OC)c1O 790215929 WXZOEHAODVCANX-UHFFFAOYSA-N 428.894 2.243 10 20 IECD CCOC(=O)[C@@H](CCOC)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 798774634 QPNLJEMMEAQJGZ-MRXNPFEDSA-N 440.408 2.068 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)cc1F 804851431 BXDCQDFGYFFDTK-NQIIRXRSSA-N 445.539 2.136 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCCN(c2ccccc2)C1=O 807290006 BCLPRBZVXVDLAK-QFIPXVFZSA-N 432.524 2.333 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(OC)c1 807385714 PSSXHFKVJPAXMB-UHFFFAOYSA-N 437.246 2.205 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 807769870 JIJYAHJJLOASHA-ZWQIFLOQSA-N 449.498 2.447 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H](C)C2CCN(C(=O)OC)CC2)cc1 807832789 BRYPWZFCOKHLNF-QGZVFWFLSA-N 432.565 2.474 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(NC(=O)c3cccnc3)c2)c1 919813741 KLBXABOYMJFYTL-UHFFFAOYSA-N 440.481 2.341 10 20 IECD CCCNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920924467 BWVOLCSUTBXFRO-KRWDZBQOSA-N 438.528 2.479 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccccc2C(=O)NCc2ccco2)C(=O)NC1=S 920977754 KLWQHJKKMGNQSH-LFIBNONCSA-N 426.498 2.405 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 1324158267 JQSXXOMKCDFEJV-QGZVFWFLSA-N 447.557 2.078 10 20 IECD CNC(=O)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1 1325005740 DZLCSGIAXOYHKZ-ZHACJKMWSA-N 436.512 2.207 10 20 IECD O=C(Cc1ccccc1O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1783241606 ZWLFFCARRCZKGW-QFIPXVFZSA-N 446.887 2.143 10 20 IECD CN(C)C(=O)C(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1787923132 QHEUSXNQZUONTF-UHFFFAOYSA-N 447.495 2.002 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246045 HKYXTBYFDQFUFD-FBBNDSKNSA-N 447.290 2.269 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1F 1792422196 DSIOBPSCJFXLID-ITJFMEAMSA-N 445.422 2.442 10 20 IECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c(O)n1 1796933064 NNQUOHNIPWZHPW-VBUUOAMHSA-N 447.495 2.140 10 20 IECD COC(=O)CCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809098538 OVASTURJWKFGDU-GQCTYLIASA-N 446.500 2.001 10 20 IECD CN1CC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)C1 1823003581 NUCSIXNONJEFDP-HNNXBMFYSA-N 433.896 2.342 10 20 IECD CC(C)(C)C(=O)NCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 25980281 ITNJDMVZBFDWFV-UHFFFAOYSA-N 436.464 2.496 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCNC(=O)c3cccs3)CC2)cc1 28064812 RKPMVWIIUSWNAG-UHFFFAOYSA-N 430.574 2.205 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCc1nnc2n1CCCC2 302963991 QSGVIDCFLVRRJX-UHFFFAOYSA-N 438.454 2.469 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1 729063359 JKSOJZLGGCGFSP-AWEZNQCLSA-N 441.484 2.461 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H]1CN2CCC[C@H]2CO1 729497336 SEDJJCUYZKFKOH-ROUUACIJSA-N 442.482 2.204 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c1 734073765 BXTFSDYZPIQYCW-UHFFFAOYSA-N 431.342 2.330 10 20 IECD CN(CCCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 737037653 QISPXYHJTKMAEF-GOSISDBHSA-N 447.580 2.445 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1 737165898 CRVIGNYHKLWMAK-UHFFFAOYSA-N 430.262 2.049 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)c1 739085414 IXRUBOZRXGCBAY-IYBDPMFKSA-N 427.501 2.265 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(C(=O)NCC(C)C)CC3)CC2)cc1 742948029 LIUPSZLYBBYJMV-UHFFFAOYSA-N 445.608 2.011 10 20 IECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cn1 743047074 WPQOZQQKIMSHSP-UHFFFAOYSA-N 437.459 2.197 10 20 IECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C[C@@H](C)O 748374099 HQJSGGWYYBOMFK-QWHCGFSZSA-N 437.474 2.238 10 20 IECD CC(=O)N1CCN(C(=O)[C@@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C(C)C)CC1 751930223 GVTMJZPHPXHELJ-FQEVSTJZSA-N 444.557 2.188 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccnn1Cc1ccccc1 756764236 GIQFYUQFUQCQAJ-UHFFFAOYSA-N 437.475 2.162 10 20 IECD CCS(=O)(=O)c1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759219535 CFLFGEBHJKBFKF-UHFFFAOYSA-N 448.541 2.468 10 20 IECD COc1ccc(N2CCN(C(=O)CN3c4cc(Cl)ccc4CS3(=O)=O)CC2)cc1 765543872 WTWWMRYPIDWCEQ-UHFFFAOYSA-N 435.933 2.347 10 20 IECD CCc1nn(C)c(CC)c1S(=O)(=O)Nc1nc(-c2cccc(-n3cnnn3)c2)cs1 766743346 KOJFGLQAYQEVHX-UHFFFAOYSA-N 444.546 2.445 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1OC 766923440 JOHUQNZWCSZXRU-UHFFFAOYSA-N 425.438 2.262 10 20 IECD CC(C)C[C@@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771051023 ROUPMZQHNHDEJG-OAHLLOKOSA-N 437.474 2.238 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(Br)cn1 772940313 VZAWGMXLDCLSMF-UHFFFAOYSA-N 433.306 2.278 10 20 IECD CS(=O)(=O)Nc1ccc(OCCNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 773589464 RYMZYDNYMJQGLN-UHFFFAOYSA-N 430.530 2.313 10 20 IECD C[C@H](NCC(=O)N1CCC(C(=O)N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 775256932 AOTMXCUDUILYIJ-IBGZPJMESA-N 428.577 2.035 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nc4ccccc4o3)CC2)cc1 778295634 VEHLPHCXKVXTEZ-KHPPLWFESA-N 434.496 2.400 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)[C@H](O)c2nc3ccccc3[nH]2)cc1 779620456 SXNVRJRNLSBXBB-NYVOZVTQSA-N 438.528 2.231 10 20 IECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCCCC2)cc1 780735344 NEIHDHYEVGCRKJ-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN3C(=O)N(CC(C)C)C[C@@H]3C2)c1 782883466 JZTPNOUZIQLXSR-QFIPXVFZSA-N 444.576 2.005 10 20 IECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764430 HBIMTLFMESPWEK-AWEZNQCLSA-N 441.866 2.227 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CN(Cc2ccccc2)CCO1 785423811 HIXUNXAMGLKMOW-DHIUTWEWSA-N 438.572 2.165 10 20 IECD O=C(NCc1cnn(-c2ccccc2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785973263 WVZDEZFFELOWFZ-NRFANRHFSA-N 434.496 2.402 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(CN4CCN(C)CC4)c3)cc2)CC1 787322331 PBKHBAAMBBCYLR-UHFFFAOYSA-N 449.599 2.033 10 20 IECD C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788324653 XNTCNCKILIGZDL-SIKLNZKXSA-N 436.556 2.091 10 20 IECD Cc1nc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)sc1C 788910438 KTOJHXLUBOHZNV-UHFFFAOYSA-N 427.574 2.325 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](c4ccccc4)S3(=O)=O)CC2)cc1 793856967 OBFMFYCECJAFHN-NRFANRHFSA-N 429.542 2.121 10 20 IECD Cc1ccc(CN(CCO)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 803301122 ZEWHRANMHLRQPX-IBGZPJMESA-N 425.529 2.030 10 20 IECD COc1ccc(F)cc1CN1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807678332 WIZVWFROIVTJFG-KRWDZBQOSA-N 442.535 2.422 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 812493854 YBQCQKHIYHSZRC-GJZGRUSLSA-N 428.526 2.202 10 20 IECD C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)S1(=O)=O 813085534 FZYQMANYBLBVNS-RBSFLKMASA-N 431.505 2.474 10 20 IECD O=C(C=c1sc(=Cc2ccc(N3CCOCC3)cc2)c(=O)n1Cc1ccccc1)C1CC1 914581771 JMQCTRQHKMQFLF-UHFFFAOYSA-N 446.572 2.383 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 915779230 ZFZRTQJQIIOTRE-UHFFFAOYSA-N 434.496 2.191 10 20 IECD CNC(=O)CN1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 919656633 CJVZUHYXVVYGRX-UHFFFAOYSA-N 427.549 2.268 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 920253992 DLKAAVYZZBIPBU-JPFBCYGGSA-N 448.567 2.415 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1 920255701 UJTKVBUAKNFHEP-QXMHVHEDSA-N 436.512 2.241 10 20 IECD C[C@H](NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920865806 NHNGTLWQHPYBLC-INIZCTEOSA-N 429.542 2.455 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1CNc2ccccc2O1)c1cc(O)nc(O)c1 1798367933 MDCCGQFINBEYIY-YVSFHVDLSA-N 438.484 2.008 10 20 IECD Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1805509824 OUKXNPSTRPVPKO-KKSFZXQISA-N 433.468 2.225 10 20 IECD Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1813508286 DTCUDJBGPSGWCJ-OPAMFIHVSA-N 436.468 2.352 10 20 IECD CC[C@H](NC)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708526 FFQQNTQUKHYTLA-JQWIXIFHSA-N 438.937 2.432 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)c2cnc[nH]2)CC1 1825890312 XGGHAOMIYNNVFN-SUQGKYDKSA-N 440.500 2.473 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2cccc(O)c2)C1 1846464013 GYOXMKFGWGINJL-UHFFFAOYSA-N 446.507 2.321 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(N4CCN(C)CC4)nc3)CC2)cc1 110464054 SNUQWGJCJJOQKO-UHFFFAOYSA-N 438.576 2.310 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O 726288104 ATTRHPCIDZGCNT-UHFFFAOYSA-N 438.406 2.240 10 20 IECD CN(CCc1ccccn1)C(=O)CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 727608211 NTAJGSVHOXUJPR-FQEVSTJZSA-N 426.517 2.179 10 20 IECD CCS(=O)(=O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 727718883 SPCKTQVDKRPUJK-QBFSEMIESA-N 432.614 2.280 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCOc3cccc(C(N)=O)c3)cc2F)CC1 751378047 CGVLVJZHXXZXPC-UHFFFAOYSA-N 428.508 2.152 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1 751404592 HXRLFGUKLJSZJG-GOSISDBHSA-N 435.521 2.361 10 20 IECD COC(=O)c1coc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 754002992 VBSKUYCGTMWNEF-STQMWFEESA-N 426.466 2.297 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1nnc2n1CCC2 754665957 DYDIZBCGEQTTAC-AWEZNQCLSA-N 429.480 2.459 10 20 IECD C[C@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1cc(Br)ccc1O 756527199 XCXWPMOGABWOJM-AWEZNQCLSA-N 434.338 2.334 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC[C@]2(CCOC2)C1 756925046 AMXMEDBGIPZLGJ-QHCPKHFHSA-N 440.523 2.264 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)cc(OC)c1OC 759101853 KPCQYHBGFZXZKF-UHFFFAOYSA-N 432.502 2.100 10 20 IECD COc1cc(N2CCN([C@@H](C)C(=O)NC(=O)NC3CCCCC3)CC2)cc(OC)c1OC 759887180 UPEVRNMSOSHWMF-INIZCTEOSA-N 448.564 2.381 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCc4nc(C)ncc4C3)CC2)cc(OC)c1OC 760096066 LOPYRQDUSPWSDW-QGZVFWFLSA-N 441.532 2.200 10 20 IECD COCCOC(=O)C1=S=c2nc(/C(Cl)=C\c3cccc4nccn34)nc(O)c2=C1C 769606944 GGSLMKSBBATOEI-JLHYYAGUSA-N 444.900 2.097 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@@H](C)CN1C 770165821 STEQFDKUGGEWTN-KBPBESRZSA-N 448.501 2.266 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4c(C)nn(C)c4C)n3)CC2)cc1 771058887 WNDLJDBIZOJSTI-UHFFFAOYSA-N 438.532 2.105 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)cc2F)C[C@@H](C)O1 775178772 CYROVAANSQPUQY-BZPMIXESSA-N 432.323 2.366 10 20 IECD CCCN(C)C[C@H]1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295645 RTGYRLKPPVLNHU-SQUSKLHYSA-N 428.577 2.090 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc([C@@H](C)N2CCOCC2)c1 785295618 XMMXRZMUDZVVNK-HZPDHXFCSA-N 427.501 2.177 10 20 IECD Cc1ccc(OCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1 785499112 XLRISYDPPZRLBE-UHFFFAOYSA-N 443.519 2.215 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCc4occc43)CC2)cc(OC)c1OC 788614764 WNHQTBNPLVGXAR-QGZVFWFLSA-N 443.500 2.148 10 20 IECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823745 FWHHYXWCYWTMMV-SOUVJXGZSA-N 446.523 2.408 10 20 IECD CN(C)C[C@@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793728383 YHKATTCEUKDUOG-FGZHOGPDSA-N 439.556 2.189 10 20 IECD CN(CCCN1CCCC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450327 VVGBRESJZHEJMD-UHFFFAOYSA-N 438.519 2.317 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)ccc21 803686240 DOJLHDZUMXIASA-JOCHJYFZSA-N 448.567 2.035 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1csc(N(C)C)n1 806664326 MXSYMPPNQQXRLN-UHFFFAOYSA-N 441.351 2.342 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1C 807513447 NYWITKIKTPOVHX-UHFFFAOYSA-N 446.312 2.218 10 20 IECD COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 808030164 WYIKIJCAXLICSD-FUHWJXTLSA-N 430.549 2.227 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)cc2)CC1 808338345 HMCFBPXPHIWFEN-GOTSBHOMSA-N 442.604 2.033 10 20 IECD C[C@H](c1ccc(F)cc1)N1CC[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 815197866 SNNBEZKUZKIDDE-KZULUSFZSA-N 436.461 2.422 10 20 IECD COc1cnc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc1 815524943 MYDLGTSESNEBCE-LBPRGKRZSA-N 431.404 2.445 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(CO)CC1 1794114907 YVJLUSUUFDTNGG-DSHMIGQCSA-N 444.528 2.254 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935519 QHPVHGDMILNUMX-UUXHPUJUSA-N 448.527 2.184 10 20 IECD COC1(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1807998813 ONZASRGJYBSZNK-IERDGZPVSA-N 440.500 2.167 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)on1 1825019781 QMULCWIXBLLFSO-SFHVURJKSA-N 428.489 2.265 10 20 IECD C[C@H](Cn1ccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428775 IPNBJYRAIFMECC-APWZRJJASA-N 441.532 2.259 10 20 IECD CC[C@@H](NC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877533 PWHILTYBDHFJPS-HLKZIGTNSA-N 445.560 2.434 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CC=CCC3)CC2)CC1 1836677914 JNLQMRIQCZNKJW-MRXNPFEDSA-N 429.517 2.461 10 20 IECD O=C(CSc1ccncc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441229 RZNIOLGEVDNQEG-UHFFFAOYSA-N 449.536 2.170 10 20 IECD C[C@@H](Cc1ccncc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442150 ASNLPFWUZLSIBD-SFHVURJKSA-N 445.523 2.257 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc3occc3c2)C1 1843768738 KECULBAXSLFLTN-UHFFFAOYSA-N 429.523 2.110 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846640344 WYXOWKORHGOYQL-KRWDZBQOSA-N 434.496 2.455 10 20 IECD CC(C)(C)OC(=O)NCCCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847961369 GUDROGIICNGGKF-HOTGVXAUSA-N 448.520 2.003 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccc(C)c(O)c2O)c1 110000713 WYSAXHJIRXAECV-UHFFFAOYSA-N 436.486 2.232 10 20 IECD C[C@@H](CCN(C)C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237457 MLCYUWRSEYKPBG-KRWDZBQOSA-N 429.544 2.082 10 20 IECD COc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)c1 729598168 YISQDUXXLFFPFJ-UHFFFAOYSA-N 443.523 2.222 10 20 IECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1C(=O)NCc1ccc2c(c1)CCCN2C 731543649 OKKSQGPYRVECJS-QFIPXVFZSA-N 432.528 2.408 10 20 IECD COc1ccc(N2CCC(NC(=O)N(C)[C@@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 732889512 VEHIUQYFFUYIIR-QGZVFWFLSA-N 428.455 2.469 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 734405759 JPBWLRNQFHZKEN-UHFFFAOYSA-N 437.587 2.002 10 20 IECD O=C(NC[C@@H]1CCC[C@@H](O)C1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748320964 QHOYYRYUDPNHTJ-CZUORRHYSA-N 449.485 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 750507076 AZCOJHVOAMIVIL-UHFFFAOYSA-N 447.532 2.144 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c([N+](=O)[O-])c1 751227093 DFCJVVNPHBKQOU-UHFFFAOYSA-N 439.465 2.182 10 20 IECD COc1ccc(N2CCN(C(=O)CSCc3cc(=O)n4ccsc4n3)CC2)cc1F 753742589 RSIFNFLLMDQMSX-UHFFFAOYSA-N 448.545 2.486 10 20 IECD COc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccc(OC)c(F)c4)CC3)C2=O)c(OC)c1 753978956 ZDJUOROGEQCSDS-LJQANCHMSA-N 443.475 2.306 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](CC(N)=O)C3CCCCC3)cc2F)C[C@@H](C)O1 754504573 ISVICTAGGIQUAL-LZJOCLMNSA-N 448.583 2.469 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccn(Cc4ccccn4)n3)CC2)cc1 759024777 CSEJCONKXKZTOG-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)NC(=O)Nc1ccc2c(c1)OCCO2 759597460 SFGFQDWPIGOTAJ-AUXFESMGSA-N 428.397 2.162 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)CC2)cc1 765111451 HQEMMZPTEOQEOU-UHFFFAOYSA-N 441.553 2.478 10 20 IECD C[C@@H](NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)c(F)c1 765519410 WLMJWDFFSJUPIO-LJQANCHMSA-N 441.551 2.447 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](CC(=O)OC(C)C)C3)CC2)cc1 766914597 DHTBJZSVLJUOQT-IFMALSPDSA-N 433.593 2.232 10 20 IECD COc1ccc(CCC(=O)N2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc1 768443250 BZWLDRZDOPADNT-JOCHJYFZSA-N 426.513 2.494 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)ccc3OC)cc2F)CC1 768951466 XFRLFWIUFKSDSG-UHFFFAOYSA-N 432.471 2.370 10 20 IECD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770575538 GJMJTTPZASUVKP-XJKSGUPXSA-N 433.521 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(-n5cccn5)nc4)n3)CC2)cc1 771082165 JSNRQTDCXCMRMD-UHFFFAOYSA-N 445.483 2.217 10 20 IECD Cc1cc(C)n(CCCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 774804692 BRQGSJCBWQCHLI-ROUUACIJSA-N 445.539 2.075 10 20 IECD COC(=O)c1ccc2c(c1)CN(C(=O)/C=C/C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2 778265289 JWJJLBBTNMXTIW-MDZDMXLPSA-N 449.507 2.229 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 778288465 DOAZKMHTLAFOMJ-DRUFCSCSSA-N 437.540 2.310 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(F)c(F)c(C(=O)O)c3)c2)CC1 780408228 CYSOAIYXFITVDW-UHFFFAOYSA-N 439.440 2.132 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 784030510 QTRJOKLYWNTGFZ-UHFFFAOYSA-N 449.504 2.349 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H](CN1CCOCC1)c1ccccc1 785561407 QXCCEUAKDWORBS-HSZRJFAPSA-N 436.556 2.093 10 20 IECD CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCCCSc2nccs2)CC1 788422613 MYWFVQSXFPIHMU-UHFFFAOYSA-N 428.580 2.257 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)c(C)o1 788928572 ALFDBMPKNLAFRX-UHFFFAOYSA-N 438.528 2.097 10 20 IECD CC(C)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819066 LDPAFJJRLYUAHB-SCTDSRPQSA-N 435.540 2.329 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CC2)cc1 792966308 YFFSJOVFGZDKCR-UHFFFAOYSA-N 434.496 2.225 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCCC34CCOCC4)CC2)cc1 800607807 ZIKHIMMOVDDHMA-SHBDEGQCSA-N 427.545 2.366 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1 802609974 OHGZOGCYKTUNMW-UHFFFAOYSA-N 433.530 2.209 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 803298629 VUPFLZSRAVHXBP-OXQOHEQNSA-N 429.517 2.360 10 20 IECD CC(C)Oc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccn1 803299418 LBRNDGOKSXZSIL-QGZVFWFLSA-N 426.517 2.199 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCCNC(=O)C3CCC3)cc2)CC1 805024320 RPSIBZGACYLOHU-UHFFFAOYSA-N 428.577 2.304 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccc(N(C)C)cc1 806985660 CTGCMVNNBIWRHY-ZDUSSCGKSA-N 426.448 2.361 10 20 IECD O=C(NCc1ccc(OC(F)F)cn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807528051 AKNAVDPQZKKMOD-QGZVFWFLSA-N 435.427 2.213 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN3CCSCC3)cc2Cl)C1 807954975 JFIAQXRMTSFUIZ-MRXNPFEDSA-N 439.025 2.358 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809443884 KVNDQDZVMYHDPJ-QGZVFWFLSA-N 428.533 2.075 10 20 IECD COc1ccc([C@@H](O)C2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 812637649 GZHRBVHCBRKOSE-HXUWFJFHSA-N 434.514 2.358 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(F)(F)[C@@H](CO)C1 812643035 JONKQMLAGUGVJU-LLVKDONJSA-N 432.470 2.344 10 20 IECD C[C@@H](OC(=O)CN1CCCCC1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 915455251 MWHLIPVVPHUXIU-CQSZACIVSA-N 434.448 2.345 10 20 IECD COCCc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 917930216 NAPXOMFQOXIRPQ-LJQANCHMSA-N 431.558 2.056 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1COc2ccccc2O1 919698193 WBFYUMFZLVSOEH-JOCHJYFZSA-N 449.486 2.399 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)ccc1F 1777852890 YZSPMLPCEROVGZ-WZONZLPQSA-N 443.475 2.382 10 20 IECD CC1=CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1778748183 MEJJIGOAWZFXFE-PRCFCKQXSA-N 429.517 2.367 10 20 IECD Cc1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1797231778 KIVUNGLLRBDMOM-ACHSLPGTSA-N 437.525 2.496 10 20 IECD O=C(CCc1cnccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719333 IOMMNCHCXSDSND-MUJYYYPQSA-N 430.892 2.426 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993922 RBRBPZUISBETES-OPAMFIHVSA-N 436.468 2.433 10 20 IECD CN1CC(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1811809157 HJFOMZBXPCDOTF-LIRRHRJNSA-N 444.919 2.027 10 20 IECD O=C(Cc1ccccc1O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1812701649 DHUSDENHUNWUGB-SBUREZEXSA-N 448.479 2.156 10 20 IECD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)ccn1 1817846227 LIGXJZADQSTOTM-OAHLLOKOSA-N 438.444 2.239 10 20 IECD Cc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1837360103 GCBUGAIOVWMKJK-UHFFFAOYSA-N 446.529 2.184 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(O)cc2F)C1 1845363989 WGSKMVXZWUNIFK-XVNBXDOJSA-N 428.416 2.179 10 20 IECD O=C(/C=C/c1cccc(O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039506 XDKLUIYBWUFILF-FWMCCXIMSA-N 436.464 2.439 10 20 IECD Cc1cccnc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1848158745 JMGLCHAIBBQFQU-VXKWHMMOSA-N 445.523 2.317 10 20 IECD O=C(Nc1ccc(C(=O)Nc2cc(-c3cccnc3)nn2CCO)cc1)C1=S=CC=C1 446923193 RYTLPRKXCLJCAD-UHFFFAOYSA-N 433.493 2.406 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 727355454 MZUSPUWHNMXYDV-UHFFFAOYSA-N 436.870 2.438 10 20 IECD COc1cccc(NC(=O)CSc2ccccc2C(=O)N2CCS(=O)(=O)CC2)c1 729368756 LJENFDAPCUSOKH-UHFFFAOYSA-N 434.539 2.297 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[S@@](=O)Cc3ccccc3)cc2)C1 735108499 UXRDSKXSMBCIQO-PKHCJMHPSA-N 442.585 2.136 10 20 IECD COC(=O)c1ccc(C)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740609411 JSUHBPGIQHLSKG-UHFFFAOYSA-N 431.514 2.284 10 20 IECD COCCOC[C@H]1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 744374524 WFHBLQCHLZYYCF-AWEZNQCLSA-N 438.436 2.495 10 20 IECD CN(C)C(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903273 FJSMZEUVVNVTND-OAHLLOKOSA-N 425.480 2.266 10 20 IECD COc1ccc(-c2nnc(SCC(=O)N(C)Cc3ccc(N(C)C)cc3)n2N)cc1 748575473 GRYXMPRUQNYLKP-UHFFFAOYSA-N 426.546 2.484 10 20 IECD Cc1cc(F)cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1[N+](=O)[O-] 752557097 KVXPYHAUELNNIZ-UHFFFAOYSA-N 449.410 2.491 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 755301994 MPIJBSKESHXSNJ-SNVBAGLBSA-N 425.429 2.075 10 20 IECD O=C(COC(=O)c1cccc(O)c1O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 758563315 VPCJUBDMPBEJCP-UHFFFAOYSA-N 434.470 2.068 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)CC2)cc(OC)c1OC 759224906 JDJGUAVMBONVKZ-UHFFFAOYSA-N 427.457 2.006 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(C(C)C)on3)CC2)cc(OC)c1OC 759408546 DCMIJLBWCFXXLT-UHFFFAOYSA-N 432.477 2.111 10 20 IECD Cc1nc(C(=O)NCc2cccc(Br)c2O)nn1-c1n[nH]c(C(F)(F)F)n1 765735041 CSSQXLRXUHRNCG-UHFFFAOYSA-N 446.187 2.111 10 20 IECD CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cn1 766365742 OPISITBZKGMGPH-UHFFFAOYSA-N 441.532 2.377 10 20 IECD Cc1cc(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c(C)n1-c1ccc(Cl)cc1 768731108 UIWBCAHLIAPNMM-UHFFFAOYSA-N 448.936 2.012 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 773741637 UYJNDQJQFNZIMD-LLVKDONJSA-N 448.419 2.022 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773859038 USHKFQKSWVGEMG-OAHLLOKOSA-N 432.546 2.257 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773992647 DMZIDTMJWRGSCO-OAHLLOKOSA-N 432.546 2.257 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)c1 781387235 DGZVUOPGPXMRDM-UHFFFAOYSA-N 430.461 2.287 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CN(C)C(=O)c4ccccc43)CC2)cc1 782053869 YTMQUZAZXAIDDO-QHCPKHFHSA-N 436.556 2.193 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(F)(F)F)n3)cc2)C1 786291252 YMBNLOIMQKDPOP-CQSZACIVSA-N 449.433 2.057 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CSCN3C(=O)OC(C)(C)C)cc2)CC1 787319597 MSQJTBGWXMMLFO-LJQANCHMSA-N 448.589 2.281 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCCN3CCC(C)CC3)CC2)cc1 787896642 XMXDLCYEBZVFJR-UHFFFAOYSA-N 430.593 2.362 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(CC(F)(F)C(F)F)CC2)cc1 788975847 RUUQNCYPDPNRFA-UHFFFAOYSA-N 432.462 2.194 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 789844370 FZKPSUURPNLNAM-SIKLNZKXSA-N 442.629 2.331 10 20 IECD Cc1cccc(=O)n1C[C@](C)(O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 792198011 IQSWNQDOHRXXPW-ZHRRBRCNSA-N 435.471 2.294 10 20 IECD CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 793628416 CPRVAQUICQKILK-IBGZPJMESA-N 428.533 2.099 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H]1CCc2ccccc21 793733713 NWKLWFSMVMTMQB-DENIHFKCSA-N 434.540 2.150 10 20 IECD COCCN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 793818915 YKLMHATTZVXCSP-UHFFFAOYSA-N 442.560 2.101 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1 795155903 KLFLJAWNGCPAJP-UHFFFAOYSA-N 430.574 2.201 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 801548745 OMVVYIIMABCQID-UHFFFAOYSA-N 435.546 2.194 10 20 IECD CCC[C@@]1(C2CC2)NC(=O)N(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 802737814 HDJKQLGHXAONMT-QHCPKHFHSA-N 446.548 2.293 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803296746 GUFBJRDAPZNFRB-HXUWFJFHSA-N 442.604 2.425 10 20 IECD COC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccco1 803449318 VTJJGFKNSPHSAT-KRWDZBQOSA-N 437.443 2.470 10 20 IECD CCN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1)CC(F)(F)F 803664525 NCWLEQYAKVXDCK-HNNXBMFYSA-N 432.462 2.241 10 20 IECD COCCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 804901052 PAAASWOMODVXKS-WMZOPIPTSA-N 436.984 2.029 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCC(=O)OC(C)(C)C 804904934 VOFFVBKTUIQHFY-UHFFFAOYSA-N 429.311 2.351 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCO[C@H](CC(C)C)C3)cc2F)CC1 805006812 GYUHGOBXOYIYHK-VQTJNVASSA-N 448.583 2.294 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 805734669 VWMVJVGJUJOJFT-KRWDZBQOSA-N 448.564 2.011 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O 807135096 KHSTWHJSONNSIX-FQEVSTJZSA-N 439.512 2.057 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCCC4)cn3)cc2)C1 917391176 OILADPVXXZRRQW-GOSISDBHSA-N 443.573 2.180 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cccc1[N+](=O)[O-] 918437847 BZCJIVLMAFYMJX-UHFFFAOYSA-N 430.436 2.258 10 20 IECD Cn1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C(F)(F)F)c1 1337751806 IESVHRVNGAMBPL-UHFFFAOYSA-N 443.397 2.493 10 20 IECD O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2O)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998909 PLSKCDTUYHZFMN-UZUQRXQVSA-N 448.479 2.156 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)ccn1 1810787819 QMZABOBODNIXGF-LAUBAEHRSA-N 433.468 2.225 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc([N+](=O)[O-])o1 1814308903 RROBJXUFHUWKBW-LBPRGKRZSA-N 442.388 2.337 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c(O)n1 1817847582 MOZYJHGXCGGPIW-OAHLLOKOSA-N 438.444 2.245 10 20 IECD CC(C)n1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1843442334 BAHCNEKGWFVKRJ-UHFFFAOYSA-N 434.500 2.074 10 20 IECD C[C@@H]1CCc2c(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)n[nH]c21 1843730555 WKOFWIDNIYVVSS-OQHXTRMZSA-N 438.484 2.107 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)CC2)cc1 726716362 ISGGARWABRCOQO-UHFFFAOYSA-N 443.592 2.004 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)c3ccc(F)cc3)CC2)cc1 734938855 NTMFCXMFCVRWBD-JOCHJYFZSA-N 430.524 2.379 10 20 IECD Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 737131103 MKWPLNOLMGQPPP-UHFFFAOYSA-N 441.576 2.472 10 20 IECD O=C(Nc1ccn(CCN2CCOCC2)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 743168791 MAXBFURYJOUYCR-LJQANCHMSA-N 429.521 2.134 10 20 IECD Nc1c(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ncnc1-n1cccn1 747814930 JRLVLJNVOXBZOE-UHFFFAOYSA-N 446.494 2.112 10 20 IECD CC[C@@H](C)NC(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748035910 OOTMZCNVJQSDDN-GFCCVEGCSA-N 425.532 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(N4CCCC4=O)c3)CC2)cc1 749984702 CKEKROZGUGEVRG-UHFFFAOYSA-N 437.496 2.328 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)CCC4)cc2)C1 750253290 LVPWODNWWGXHLT-GOSISDBHSA-N 448.523 2.162 10 20 IECD Cc1ccccc1[C@@H](CN1CCOCC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753666355 XESHKOZVHKKCTK-XMMPIXPASA-N 443.613 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(F)cc3CS(C)(=O)=O)CC2)cc1 759786813 KKHHROXVQXFFJP-UHFFFAOYSA-N 435.521 2.140 10 20 IECD COc1cc(N2CCN(CCN3C(=O)c4ccccc4C3=O)CC2)cc(OC)c1OC 759879440 VQISUGOZUMDXJN-UHFFFAOYSA-N 425.485 2.131 10 20 IECD Cc1cc(C(=O)CN2CCOCC3(CCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759915286 NODLCOFZGQSKAI-UHFFFAOYSA-N 431.558 2.427 10 20 IECD O=C(CCc1nc(C2CCCC2)no1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 761992618 NQZQDUFNSJYKHK-UHFFFAOYSA-N 432.546 2.211 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766983954 VFQGOHGGIGXTCP-XMSQKQJNSA-N 444.601 2.340 10 20 IECD O=C(CN1CCN(c2ccccn2)CC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771053160 MDJMVOCMJGZQBC-FQEVSTJZSA-N 443.979 2.343 10 20 IECD CCN1CCC(n2nccc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)CC1 775153073 MYYPJDFTCAJKPD-UHFFFAOYSA-N 425.533 2.379 10 20 IECD Cc1ncc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c(C)n1 777197190 IBLAVIKSRJRKPN-UHFFFAOYSA-N 442.497 2.188 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1c(C)nc2ncnn2c1C 777827969 FVXZUHZIMWXOTR-UHFFFAOYSA-N 431.880 2.235 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@@H](c4ccco4)C3)CC2)cc1 778319414 WTMMMXCMAUAMNH-MHNQQFQPSA-N 425.485 2.093 10 20 IECD CN(CCCC(=O)OCC(=O)c1ccc(O)c(O)c1)S(=O)(=O)c1ccc(F)cc1 782079895 DTHDDGIGYPOAGA-UHFFFAOYSA-N 425.434 2.064 10 20 IECD O=C(NCCc1cccc(F)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 785539844 MAILNKHJBODGOU-UHFFFAOYSA-N 438.547 2.333 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(Cn2cccn2)cc1)c1ccc(N2CCOCC2)cc1 788458931 HQIGRVKBEGNMEC-LJQANCHMSA-N 447.539 2.262 10 20 IECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 789798097 BIKFWQRAEAVYJG-LJQANCHMSA-N 449.910 2.436 10 20 IECD Cc1ccn(C[C@@](C)(O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(=O)c1 790896381 FXHLCELLOLOBAK-XMSQKQJNSA-N 433.936 2.048 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccccc3)cc2)C1 793718917 KQMZFQHGQKKHBL-IRLDBZIGSA-N 434.540 2.368 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](O)c1cccc(C(F)(F)F)c1 795366296 IWAYBPKQPAJZSX-SFHVURJKSA-N 442.459 2.290 10 20 IECD Cn1cc(C(=O)CCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 796158145 OOZPCVQRZRNUHQ-UHFFFAOYSA-N 445.431 2.340 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C 797611044 JQNVPNPTVIPPDI-CYBMUJFWSA-N 436.534 2.167 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4nccs4)CC3)cc2)C1 798383027 HBZHTBKXHBIBQG-KRWDZBQOSA-N 442.589 2.313 10 20 IECD O=C(NCc1ccc(OCC2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803567738 LEDLRMXVDVMONW-HXUWFJFHSA-N 439.512 2.400 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1c(C)noc1C 805007358 JFIJHUNAFUAYBR-LJQANCHMSA-N 445.539 2.456 10 20 IECD C[C@@H]1CCSCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854386 WRJKHAMQJSZMFR-GOSISDBHSA-N 430.618 2.189 10 20 IECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(OC)c(OC)c3)cs2)cn1C 914789633 OHAVBKRLUOFLFH-UHFFFAOYSA-N 436.515 2.326 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1C 917758398 VELHVLCELDJPFY-UHFFFAOYSA-N 446.572 2.269 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 918141063 RWCJQHSKRVWYEP-GASCZTMLSA-N 444.463 2.394 10 20 IECD CN1CCN([C@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2)c2cccs2)CC1 919790151 MYZGEJACMQOYOD-OAQYLSRUSA-N 443.617 2.373 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC1(c2ccc(NC(=O)Cn3cncn3)cc2)CCC1 1788259665 MNHJFXFWUFPALG-YCRREMRBSA-N 449.467 2.242 10 20 IECD C[C@@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427090 NYAZBYRVMVRZGT-AWEZNQCLSA-N 436.472 2.168 10 20 IECD Cc1[nH]nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1F 1817843799 AQDZADLFHLIBBI-GFCCVEGCSA-N 429.412 2.006 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c(C)n1-c1cccc(Cl)c1 108935217 WWGDAUCZWOUXTE-UHFFFAOYSA-N 444.963 2.364 10 20 IECD CCCS(=O)(=O)N1CCC(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 726612901 HVNMYMDVUJASIW-UHFFFAOYSA-N 438.594 2.167 10 20 IECD CC(C)CN1C(=O)/C(=C\Nc2ccccc2C(=O)NCC(F)(F)F)C(=O)NC1=S 730998910 OIXKLHNUBDKDQQ-GHXNOFRVSA-N 428.436 2.174 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H](c1ccccc1F)N1CCOCC1 742556841 LNDMCSAOPYOWSJ-QFIPXVFZSA-N 431.483 2.491 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742805119 GSJPYKIWPFDWGX-AWEZNQCLSA-N 438.475 2.484 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 743809484 UINDRUSGLCALPJ-YDOWWZDFSA-N 433.302 2.310 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc21 749731612 WNGFIFZNLNQSRK-UHFFFAOYSA-N 431.543 2.081 10 20 IECD COCCCOc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 749915106 AFVUKVWEMMCCKK-UHFFFAOYSA-N 432.542 2.267 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(F)c1 751237147 OHJUOHPLFGPKAP-UHFFFAOYSA-N 435.521 2.471 10 20 IECD C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 752633584 ZXHVMJKWCBBODG-OLZOCXBDSA-N 427.523 2.139 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1 760918060 JTBOUSQBWMZSAR-PBHICJAKSA-N 435.521 2.484 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NC3(C(N)=O)CN(C(=O)OC(C)(C)C)C3)c2C)cc1 763822746 LKESSBQASRPKJR-UHFFFAOYSA-N 442.516 2.307 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 769160477 INPDUPOJFSEQHX-DHIUTWEWSA-N 448.583 2.354 10 20 IECD C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 772055311 DHRGJVHXTPIKII-NSHDSACASA-N 448.391 2.288 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@]4(CCS(=O)(=O)C4)C3)cc2)CC1 776041071 JCRONBHWQJNYKA-UGKGYDQZSA-N 435.590 2.458 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3cc(OC)ccc3O)CC2)cc1 778389282 GALDYQVFFTWTSI-SXSDINLZSA-N 439.512 2.492 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1csc2ccccc12 779159413 JHFGPBLIMBRKQK-UHFFFAOYSA-N 443.550 2.391 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1 782042158 NCEBQRONPWPMGV-ZDUSSCGKSA-N 437.474 2.070 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1 784559175 QMKOOTCBGKXVGZ-UHFFFAOYSA-N 442.440 2.310 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 786733529 AFBAHAYVURJYBP-QGZVFWFLSA-N 449.577 2.346 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)c(Cl)c3)cc2)C1 786972060 KSLPEKNJNABYBF-MRXNPFEDSA-N 446.910 2.113 10 20 IECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccnn1C 788112911 YARORSIOONLULY-ICSRJNTNSA-N 426.565 2.361 10 20 IECD COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 788498799 OTVHTLRIDPEAGS-CTNGQTDRSA-N 444.553 2.359 10 20 IECD CC[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799056 MNFDRWMYPVYDTP-HXUWFJFHSA-N 443.519 2.078 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCC[C@H]3O)cc2F)C[C@@H](C)O1 789823008 CCVBKHYROYUHSV-KALAIVBUSA-N 435.540 2.065 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCN(C4CCCC4)CC3)cc2F)C[C@@H](C)O1 789823402 DNKUZLBCLWROHO-QZTJIDSGSA-N 446.567 2.142 10 20 IECD CN(CCCCCO)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 790142541 UGVSSVTXZWYDGG-UHFFFAOYSA-N 437.474 2.336 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@@]4(CCO[C@@H]4C)C3)CC2)cc1 790643033 LKDFNDFRMDRBGZ-ROKPMTFOSA-N 446.592 2.185 10 20 IECD CNC(=O)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 796588501 VOONKLJWSNAQGS-NSHGMRRFSA-N 448.583 2.436 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(F)c(N4CCOC4=O)c3)ccc21 796769386 RSBWCHULUQLDKP-UHFFFAOYSA-N 426.448 2.420 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(C)c3)cc2)CC1 797504604 DAMBBXKNGUDWLI-UHFFFAOYSA-N 426.473 2.267 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803298626 VUPFLZSRAVHXBP-JXFKEZNVSA-N 429.517 2.360 10 20 IECD Cc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nc2ccccc12 804288219 XLOBYQNTQIWOBA-SFHVURJKSA-N 434.496 2.468 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1F 804852896 PWNSYDRERXETDS-SFHVURJKSA-N 432.540 2.195 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1F 814268037 PEEDIDACMWKKCP-UHFFFAOYSA-N 433.505 2.388 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](CSC)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 872160624 IYXFVMINQFNNAT-UFYCRDLUSA-N 445.585 2.251 10 20 IECD CCn1c(=O)c2ccccc2n(CC(=O)NCc2ccc(N3CCSCC3)cc2)c1=O 917386118 QAQKUZWLIWCUCJ-UHFFFAOYSA-N 438.553 2.053 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(F)cc2nc(S)[nH]c12 919750093 NUZXALQYVBQAKN-UHFFFAOYSA-N 434.518 2.156 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 920015151 PTARWPDCSOGRDL-UHFFFAOYSA-N 442.946 2.231 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)c2cnc(N3CCCCC3)s2)c1 920635559 HYKKTVFPGNHETQ-UHFFFAOYSA-N 439.515 2.250 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccc(Cl)cc2)n1 1320519131 BIVPUIFPQCYYBH-HNNXBMFYSA-N 430.848 2.236 10 20 IECD O=C(CCc1ccccn1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005218 ZSSAZDCNSZCEOV-QFIPXVFZSA-N 445.903 2.223 10 20 IECD CC(C)(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)s1 1796674052 UPXRUFPGNHVDGK-HBCWATKFSA-N 445.541 2.369 10 20 IECD Cc1ncc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)s1 1804291499 KCQMMSRLOSTRNT-NCSLWMNCSA-N 443.525 2.462 10 20 IECD Cc1nc(F)ccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816726340 SZVQNJZZVCVCSX-LLVKDONJSA-N 443.460 2.331 10 20 IECD CCOC(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)OCC 1822561876 ZKORESYREVRXHT-OAHLLOKOSA-N 447.492 2.311 10 20 IECD CC(C)(C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839431743 KOAJPMQWQKJLRP-NRFANRHFSA-N 440.924 2.257 10 20 IECD O=C(c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433944 YVAQZXLZYQICAE-JOCHJYFZSA-N 446.887 2.135 10 20 IECD CC(C)(C)n1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1 1844805178 JMQKHZLKPPJBQR-UHFFFAOYSA-N 433.896 2.229 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3csc(N4CCCC4=O)n3)cc2F)CC1 303291140 KYYHYBBMHXAZAX-UHFFFAOYSA-N 445.564 2.410 10 20 IECD CCOc1ccc(S(=O)(=O)NCCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437020089 CLTKAWRTAZVWNP-UHFFFAOYSA-N 433.530 2.245 10 20 IECD Cc1occc1C(=O)NC1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 554643790 HSHPGTZSGWDORE-UHFFFAOYSA-N 436.512 2.425 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(OCC(F)(F)F)cc2)SC1=S 727176081 GFHVXOQNWFUEFH-XYOKQWHBSA-N 440.490 2.378 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 728208612 OXUHRFOVSNOBCN-LJQANCHMSA-N 445.589 2.344 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl 737133675 CKLHUEDOLHLXJH-UHFFFAOYSA-N 437.905 2.183 10 20 IECD CC(C)[C@H](CCO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738845 YXPHPQSOTKRLIK-IBGZPJMESA-N 430.528 2.149 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 748298197 SBSVBWKJXXJKRD-HXOBKFHXSA-N 448.539 2.354 10 20 IECD COc1ccc(N2CCN(c3nnc([C@H]4CCOC4)n3C[C@@H]3CCOC3)CC2)cc1F 752835652 DCATXVCRXUWFQN-IRXDYDNUSA-N 431.512 2.293 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3cccc(NC(C)=O)c3)CC2)cc1 754123746 MWXCESJRQILMKS-WZONZLPQSA-N 426.561 2.487 10 20 IECD C[C@@H]1C[C@@H](NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c2c(O)ccc(F)c21 756442447 QCIZWXCEHKYVSI-NVXWUHKLSA-N 434.537 2.216 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1C(N)=O 768012457 MFOKRSBATJMFQF-UHFFFAOYSA-N 444.557 2.127 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c2ccccc12 774364365 XLLJTWZKZWIXGN-UHFFFAOYSA-N 438.436 2.100 10 20 IECD CCCN(C)C[C@@H]1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778295649 RTGYRLKPPVLNHU-XTXLJPNXSA-N 428.577 2.090 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)[C@@H](C)O)cc1 779498067 HOOGWKDAHPEPPG-VGOFRKELSA-N 445.585 2.280 10 20 IECD C[C@H]1CN(c2ccccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C[C@H](C)O1 785294869 OVRQRUFIXJXPLK-PMPSAXMXSA-N 427.501 2.397 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@H](CC(C)C)C3)CC2)cc1 785529243 WCMBTHUXIIQXTB-HXUWFJFHSA-N 430.593 2.218 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN(C)Cc3ccccc3)CC2)cc1 785529782 YCCJBVLFEDAKON-UHFFFAOYSA-N 438.572 2.372 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785601449 MKXBFZADUYVERJ-UHFFFAOYSA-N 434.422 2.089 10 20 IECD CCc1c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cnn1-c1ccccn1 787325925 SFJNNVSUSGHUKF-UHFFFAOYSA-N 432.528 2.428 10 20 IECD COc1c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc(Cl)cc1C(N)=O 792994907 VWVLZKKQLAGNTC-UHFFFAOYSA-N 428.876 2.079 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(C(N)=O)cc3F)C3CC3)nc12 794769175 BQYWEEGYHVWYHF-UHFFFAOYSA-N 427.436 2.014 10 20 IECD CN(C)c1ccc([C@H](CNS(=O)(=O)C[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795250268 ZLIGJYIBWWYCMX-YJBOKZPZSA-N 427.567 2.274 10 20 IECD COc1ccc(CNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)c(O)c1 798493390 QNAUQOQSPLYMMM-UHFFFAOYSA-N 427.910 2.222 10 20 IECD O=C(NCC1(OCCO)CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 800710826 XQPANKMQLQYNOE-MRXNPFEDSA-N 443.491 2.114 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 803451797 WKBZHQNPCUCNMR-APWZRJJASA-N 437.487 2.447 10 20 IECD C[C@H](OC(=O)c1ccoc1CC(N)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803938398 OYESOEAOHVRJJN-LBPRGKRZSA-N 446.415 2.267 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@]4(CCc5ccccc54)C3)CC2)cc1 804317565 HTCFAOQHLAFVDV-AREMUKBSSA-N 449.551 2.481 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@@H]3COC(=O)NC)cc2F)CC1 806750214 NGVDHAAODPPRSO-GOSISDBHSA-N 435.544 2.388 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289149 KLXARIBPXZRCRR-YLJYHZDGSA-N 442.560 2.441 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 810208394 VBEAJMLMAYFUMJ-LAUBAEHRSA-N 427.549 2.197 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)cc1 917371680 REAPEKNVRURSHA-UHFFFAOYSA-N 446.525 2.060 10 20 IECD NC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCSCC3)cc2)=NN1c1ccc(F)cc1 917386652 RGNAQDFUWCIGDM-FQEVSTJZSA-N 441.532 2.115 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295291 CPJZQCSUCHGKQV-KRWDZBQOSA-N 446.525 2.250 10 20 IECD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970671 SFQBYIHAKBYFQP-UHFFFAOYSA-N 444.463 2.131 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@@H]1F)C2)c1cc(O)c(O)c(Cl)c1 1781122932 DCVYUSVCOFNNGT-SUDRFXRBSA-N 426.872 2.237 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1F 1798993686 MQXKVSCQHKXENZ-RRJKNOHSSA-N 427.432 2.303 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1CCSCC1 1802170344 NZFIWDOAVLLPGH-XOIINTDNSA-N 440.949 2.098 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccn(C(F)F)n1 1804285725 IYIIIYPTDLNHML-LJWNITHASA-N 448.426 2.360 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C(F)(F)F)CCC1)C2 1804332171 PEHIYWNIAGFGBC-ZSBIGDGJSA-N 449.520 2.218 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ccccc23)[nH]n1)c1cc(O)nc(O)c1 1817845130 ASZHLBPPKHGNJW-KRWDZBQOSA-N 447.455 2.483 10 20 IECD COC(OC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291606 WEVYWFUXJMXYOX-ZDUSSCGKSA-N 438.868 2.399 10 20 IECD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1827425137 XYTZRDFMHNHGOZ-YJBOKZPZSA-N 431.533 2.277 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829073671 PPHLPKOEFJWJCD-QAPCUYQASA-N 446.548 2.031 10 20 IECD O=C([C@@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832883151 YRFYQGRFQGSKCE-BJAZZSIWSA-N 444.528 2.473 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCN2CCCC2)CC1 1832965842 JNJAGGMEEJDBBH-LJQANCHMSA-N 430.549 2.212 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)no1 1847038938 GDEINMTYSKYWER-FNORWQNLSA-N 427.457 2.445 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)CC2)cc1 20615011 OXCNHSCXAOIHHD-UHFFFAOYSA-N 427.526 2.041 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c(OC)c1 561594914 CUURXZUKNXJEPZ-UHFFFAOYSA-N 439.512 2.488 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)n(C)c2ccccc12 570669847 PLTUHFGBDKJGJE-OAQYLSRUSA-N 448.567 2.163 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1S(N)(=O)=O 730843055 WVHUPWNSJUZFMA-GASCZTMLSA-N 435.521 2.325 10 20 IECD O=C(O)[C@H]1CC=CC[C@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 743246274 DQPOSFOTNLZWLF-MSOLQXFVSA-N 439.491 2.226 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NCc3c(O)ccc4c3CCCC4)cn2)C[C@@H](C)O1 747573413 XVNXCGOMTZJIOE-HZPDHXFCSA-N 441.532 2.425 10 20 IECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 751317960 JBZHCZGCIIBZEM-AWEZNQCLSA-N 443.543 2.254 10 20 IECD CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751945030 KDAVHXZBNJWTPR-AWEZNQCLSA-N 446.529 2.162 10 20 IECD CN(CC(=O)N(CCC(N)=O)c1ccc(F)cc1)Cc1ccc(N2CCOCC2)cc1 764860679 IHIXXYNZRNOWTJ-UHFFFAOYSA-N 428.508 2.003 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCOC2(CCC2)C1 766252626 ILOMIAULGMVZFQ-UHFFFAOYSA-N 447.469 2.496 10 20 IECD O=C(NCCc1ccon1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770103142 UCYPGHKPQUZJKK-UHFFFAOYSA-N 432.414 2.062 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc4c(c3)CCN4C(=O)CNC(C)=O)c2)CC1 770151660 ASOIWINJHWMCOQ-UHFFFAOYSA-N 449.555 2.106 10 20 IECD C[C@H](NC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 773262521 ANFODSKQNOGHJF-INIZCTEOSA-N 433.553 2.192 10 20 IECD CCc1nc(N)nc(SCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 776292649 SAJKFOLQLXJKJD-CHWSQXEVSA-N 434.541 2.177 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](Cn3ccnc3)C(C)(C)C)CC2)cc1 778244339 CQJQDXVHWYWHEH-GLCJEOIMSA-N 439.560 2.328 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C12CCC2 778290568 XIMPUCVIFMWQNK-XNZYIBKVSA-N 427.545 2.364 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3CCN(C4CCCC4)CC3)CC2)cc1 778305141 LWHFVQKLCJXZIM-KHPPLWFESA-N 440.588 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3c(F)cccc3F)CC2)cc1 778346026 HXNFKVHEVYLRIY-XTXLJPNXSA-N 445.466 2.028 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)c3c(C)noc3C)CC2)cc1 778393108 AHXZUBLSWBZORD-YDZSZYSISA-N 426.517 2.425 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(CCc4ccccc4)CC3)CC2)cc1 779215135 HAHAKYFPMIQOLT-VWLOTQADSA-N 438.616 2.038 10 20 IECD Cc1ccc(C(=O)NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)s1 785424180 FUPHQUWDOMAVNY-UHFFFAOYSA-N 428.558 2.160 10 20 IECD O=C(NCCc1ccc(F)cc1F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844124 PVCGVMMFJKXVGU-UHFFFAOYSA-N 435.446 2.040 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)ccc1O 790405748 LXMQDIHZCDAHQI-UHFFFAOYSA-N 441.531 2.086 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](CS(C)(=O)=O)C1 795085466 JIXYBZOXTGUMFU-LSDHHAIUSA-N 440.521 2.156 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 799254681 CSPLTGSDERSFEY-QFIPXVFZSA-N 448.523 2.236 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](C)N(C)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 803304955 GFUXJTOTIINDSO-PMACEKPBSA-N 438.572 2.337 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1F 804851981 VUFIHOGEBMVZLQ-FGZHOGPDSA-N 448.583 2.172 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(-n2cncn2)c(F)c1 807387691 RQQZLIMIHCLMGR-UHFFFAOYSA-N 434.225 2.129 10 20 IECD COc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCCC3)cc2)cc1OC 810246076 MHTQKZBTCXHEGX-UHFFFAOYSA-N 447.557 2.289 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1 918437627 KXTVHYSGFXYJOE-UHFFFAOYSA-N 440.569 2.331 10 20 IECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OC 918442908 WQVYGJPZWAZGKK-UHFFFAOYSA-N 441.528 2.476 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1C 918461620 IQUTYLQBCOKJII-UHFFFAOYSA-N 425.485 2.468 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccsc4)n3)cc2F)C[C@H](C)O1 918632647 AJEQLSBCMFQXMZ-KBPBESRZSA-N 430.509 2.471 10 20 IECD Cc1oc(CO)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918924825 BMRQSHWTAXRGGZ-OKILXGFUSA-N 434.464 2.306 10 20 IECD Cc1ncnc(O)c1CCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1317811463 PTSOIXIXZJZIGG-UHFFFAOYSA-N 445.431 2.381 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccc1F)C2)c1cc(O)nc(O)c1 1777847417 ADYIWDZJIFQNMO-WZONZLPQSA-N 443.475 2.002 10 20 IECD CC[C@H](NC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795726574 XSSLJSWXYLEULN-MQFRRQCYSA-N 438.572 2.295 10 20 IECD COCCn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1797058386 VNVRNVWBXNQFJC-QDMKHBRRSA-N 448.907 2.160 10 20 IECD CCCNC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712607 NJQQZSPYGXPTRB-QDMKHBRRSA-N 437.924 2.309 10 20 IECD O=C(CC1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817163833 AXVMSJBTSVOUSD-MRXNPFEDSA-N 429.477 2.339 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncc(Cl)cn2)[nH]n1)c1cc(O)nc(O)c1 1817843825 CGYOGWTUEGAFQZ-CYBMUJFWSA-N 443.851 2.279 10 20 IECD Cc1nccn1CCCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037042 KWSMSCMJXSSEDU-SOFGYWHQSA-N 440.500 2.005 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)cc1 617040927 DFYRWCZXRZALFO-UHFFFAOYSA-N 433.511 2.405 10 20 IECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 726244239 BRDDMYFXPXLPLP-NLWGTHIKSA-N 432.565 2.157 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)c1 729067683 XAZXMRMLQOQRQJ-CYBMUJFWSA-N 425.441 2.260 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2F)CC1 730194582 MDXCRKLWDKXIPH-KDURUIRLSA-N 444.551 2.149 10 20 IECD Cc1cc(=O)oc2cc(OCCOC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc12 740957587 BUMYCJLPNJXVMM-UHFFFAOYSA-N 433.438 2.414 10 20 IECD COc1ccccc1-c1noc([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 743798375 HYRPHKQIVJOWGV-LLVKDONJSA-N 432.458 2.313 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](c4nc(C)no4)C3)CC2)cc1 746517496 UBOPHZGEBVAWGQ-GOSISDBHSA-N 428.537 2.098 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](c4nc(C)no4)C3)CC2)cc1 747299376 KIBXHUHMYPLJHN-LJQANCHMSA-N 442.564 2.488 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3c(F)cccc3-n3cccn3)CC2)cc1F 754210992 CNTZITDOEDYBPV-UHFFFAOYSA-N 441.438 2.446 10 20 IECD C[C@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 756593378 YRDMPJPLRUARES-HNNXBMFYSA-N 434.518 2.087 10 20 IECD COC[C@](C)(NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)OC 757012877 RXLZIEUGNUXQTB-GFBZKKKVSA-N 442.584 2.424 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(CNC(C)=O)cc3)CC2)cc(OC)c1OC 759222363 KVWYLMMLCUFLKS-UHFFFAOYSA-N 427.501 2.311 10 20 IECD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NCc1cccc(Br)c1O 765751689 JGAISJFDAZQFLJ-UHFFFAOYSA-N 449.273 2.418 10 20 IECD CCCc1ccc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc1 768442976 UULASFMZTNDJJJ-OAQYLSRUSA-N 432.542 2.277 10 20 IECD C[C@H](NC(=O)N(C)[C@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 771768571 KZNJRRDFIXSCPE-CVDCTZTESA-N 429.609 2.394 10 20 IECD Nn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1ccccc1 772881552 CVIDCKSTKVJQKW-UHFFFAOYSA-N 442.520 2.043 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(C(C)(C)O)cc3)CC2)cc1 775216758 FNVPMACMSRHQQH-OUKQBFOZSA-N 437.540 2.444 10 20 IECD Cc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C(=O)N1CCCC1 785305316 XAIBKLSZIKOXEG-HNNXBMFYSA-N 425.485 2.328 10 20 IECD COc1ccc(CN2CCC(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785439158 MEJYVSACQJDJJA-UHFFFAOYSA-N 438.572 2.406 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccnc3-c3cnn(C)c3)CC2)cc1 786315048 UMKKTPKDTLUJCM-UHFFFAOYSA-N 434.500 2.214 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccccc1CN1CCCC1=O 787430982 IHFAAEBBWLNCNN-UHFFFAOYSA-N 434.540 2.342 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)c1 787614433 VADUNLZWMLMMTD-AUSIDOKSSA-N 438.572 2.428 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 789843382 JZMTWTMXUQFFGL-UHFFFAOYSA-N 443.519 2.379 10 20 IECD C[C@@H](CN1CCOCC1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 790134897 GCSCQCIGDLHIPZ-AWEZNQCLSA-N 439.559 2.047 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1F 792219797 KYOZPGQSTNRIIP-UHFFFAOYSA-N 436.491 2.275 10 20 IECD CN(C)S(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 793104121 DSIPZTKJNRIXGI-UHFFFAOYSA-N 433.599 2.349 10 20 IECD CCCn1c(CCC(=O)NCc2ccc(OC)cc2O)nc2cc(S(N)(=O)=O)ccc21 794377860 LRKDGIJYINYKBN-UHFFFAOYSA-N 446.529 2.057 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCC2(N(C)C)Cc3ccccc3C2)C2CC2)cc1 807298115 UTZMMSGSYNBXPO-UHFFFAOYSA-N 434.584 2.459 10 20 IECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768929 BWNZMLKHOKGULA-FRQCXROJSA-N 439.503 2.383 10 20 IECD CC(C)OCc1cc(NS(=O)(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1O 811705823 SJDCSGLQYLSUMW-UHFFFAOYSA-N 428.532 2.368 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 917710462 JFTTWUDRMIYLHH-HZPDHXFCSA-N 446.523 2.310 10 20 IECD Cc1cccc(C)c1NC(=O)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117923 SREIEWPZZODQPZ-IBGZPJMESA-N 437.544 2.443 10 20 IECD O=C(COC(=O)c1ccc2c(c1)CCC(=O)N2)NCc1ccc(N2CCOCC2)c(F)c1 919022530 SEQYTUJHMLGGPS-UHFFFAOYSA-N 441.459 2.020 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1C(=O)COc2ccc(Cl)cc21 928983479 VHIFOUFMLQHTIA-UHFFFAOYSA-N 445.903 2.333 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccc2[nH]1 1798202102 YTWMGOIUKOOEAT-ZSBIGDGJSA-N 448.595 2.342 10 20 IECD CC[C@H](NC)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807348095 DOWZXUILQGVBJN-FNHZYXHNSA-N 446.935 2.464 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ncc[nH]3)C2)CC1 1807822977 PZMVEDQYWQHIKX-UHFFFAOYSA-N 434.500 2.047 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(F)nc1 1810692063 BOAXKRLMPROLMU-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2scnc2C(F)(F)F)C1 1842567756 PEYIJQGRLGFNAN-UHFFFAOYSA-N 428.392 2.099 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)n(C)c2ccccc12 576811465 GHRRXLATBSJMTA-ZIFCJYIRSA-N 426.561 2.203 10 20 IECD Cc1nc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)cn1C 727113219 PZEBMPHMOCKOBD-ZDUSSCGKSA-N 438.575 2.378 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Br)cn3)CC2)cc1 727552597 YLLJSJHOKAWEFS-UHFFFAOYSA-N 434.290 2.358 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC2)cc1 730067513 QJZMEWUAZMLMLT-UHFFFAOYSA-N 447.557 2.446 10 20 IECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 731283577 DBYVKXPTKSCDIC-IEBWSBKVSA-N 433.572 2.414 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c1O 750816843 AFKPAWSJWLQWFP-UHFFFAOYSA-N 427.542 2.361 10 20 IECD C[C@H]1OCC[C@]1(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 753054261 ZZUIQBOWYKBZCM-BLVKFPJESA-N 435.458 2.399 10 20 IECD O=C1N[C@@H](c2cccnc2)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 761126272 YDAPSBSNSYDDOF-FQEVSTJZSA-N 447.474 2.130 10 20 IECD COc1ccc(-c2noc(CN3CCN(Cc4cc5c(cc4O)OC[C@H]5O)CC3)n2)cc1 768441879 PTUDYLNQUWCXKI-HXUWFJFHSA-N 438.484 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3CCN4C(C)=O)CC2)cc1 769631081 SAIWGARMUKUFRR-ZHACJKMWSA-N 448.523 2.448 10 20 IECD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773747673 DCOUMXQVUXNZDE-AAEUAGOBSA-N 437.474 2.198 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([C@H](C)N2CCOCC2)cc1 785304828 RRSINAZWWCOBNQ-HOTGVXAUSA-N 427.501 2.177 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2cncn2)cc1 785398756 ONKWZNGIONSWFT-DYESRHJHSA-N 449.511 2.358 10 20 IECD Cc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 789818400 JTEWCBAEMZHVBN-IRXDYDNUSA-N 428.508 2.118 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@H]3CCO[C@H](C)C3)cc2F)C[C@@H](C)O1 789819086 LIDMEJOURNUIQD-BDXSIMOUSA-N 435.540 2.377 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@H](N(C)C)C3)cc2F)C[C@@H](C)O1 789823705 FDYBNLHZGKLTIV-RWQQGDIJSA-N 434.556 2.045 10 20 IECD CCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843640 NAOJVNKEWUNGNL-UHFFFAOYSA-N 443.519 2.427 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856983 ZWMUKICQQBOJLP-QGZVFWFLSA-N 443.569 2.448 10 20 IECD CC(C)c1nn(C)cc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 796972095 NIDDBMXWMNXCAH-UHFFFAOYSA-N 438.576 2.330 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(N2CCOCC2)cc1 803299131 ZIQCYAKDPYUERK-NOXFTYBFSA-N 440.588 2.176 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CSCCN1Cc1ccccc1 807100401 MGCXOMAJSOBDHJ-QFIPXVFZSA-N 440.613 2.411 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCOCC2)c1 807385918 UQUPVZCYQXFDPK-UHFFFAOYSA-N 434.290 2.246 10 20 IECD C[C@@H]1C[C@@H](N(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCN1C 807770743 NVOHZBNPIWRWDG-NUJGCVRESA-N 438.519 2.314 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cn2n1 810369335 RATKSRZIZUSSGT-CQSZACIVSA-N 444.442 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3cc(C)ccc3OC)CC2)cc1 912934034 CPULHYLILLGCNL-UHFFFAOYSA-N 432.542 2.276 10 20 IECD O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918297784 SECFWJPUOZTYJQ-HXUWFJFHSA-N 437.496 2.431 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@H]1CCOC1)C1=NN(c2ccccc2)C(=O)C1 1803346342 KAOQIZNGSBQZQT-XEYPJELSSA-N 438.528 2.234 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ccno1 1816440899 YWXBPSDNDKHEFK-QGZVFWFLSA-N 447.455 2.497 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cn[nH]c3cn2)[nH]n1)c1cc(O)nc(O)c1 1817846341 SLWSJESBOSAWCA-MRXNPFEDSA-N 448.443 2.107 10 20 IECD O=C(c1cccc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426711 BBIOFXVEQIFMMU-KRWDZBQOSA-N 426.473 2.141 10 20 IECD O=C(c1ccc(O)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427871 KEGLAZVPCIBXLQ-KRWDZBQOSA-N 426.473 2.141 10 20 IECD Cc1cc2cc(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)ccc2[nH]1 1845716480 ASTFYHQFRUZDSI-UHFFFAOYSA-N 442.566 2.154 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@H](c2cccs2)N2CCOCC2)n(C)c2ccccc12 572020637 XIRLMXMWEMLUOW-HXUWFJFHSA-N 440.569 2.354 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(I)cc2)c1 734072544 GEKYICPLNGHORU-UHFFFAOYSA-N 426.210 2.260 10 20 IECD COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 735039751 DWGSLKZZJOMBTM-KRWDZBQOSA-N 432.542 2.258 10 20 IECD CCc1nc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1-c1ccccc1 735431241 DMZORDPIOQTBGI-SFHVURJKSA-N 432.528 2.461 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 735518383 JHCRQABNCHVARH-MRXNPFEDSA-N 438.571 2.367 10 20 IECD CCN(CC)c1ccc(CN(C)CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 741677498 BDRFODXRUKCJRZ-UHFFFAOYSA-N 429.565 2.497 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1 747475996 GUMPDRNQDAYAHS-UHFFFAOYSA-N 431.558 2.375 10 20 IECD CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751241210 XURKTYYRVJKYPS-UHFFFAOYSA-N 431.558 2.010 10 20 IECD COC(=O)CCC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 753351513 XDQSEYBXQVWFOK-IBGZPJMESA-N 430.549 2.263 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2 763282545 YOWQBSVPUCOFAR-HNNXBMFYSA-N 432.542 2.392 10 20 IECD COc1ccc2ccc(O)c(CN3CCN(S(=O)(=O)c4cn(C)c(C)n4)CC3)c2c1 765447072 UPPMVNGJZLBODT-UHFFFAOYSA-N 430.530 2.102 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCN(CC(F)F)CC3)cc2F)CC1 766793578 RUBQABZHTOHPLL-UHFFFAOYSA-N 427.515 2.450 10 20 IECD CCCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769021341 GXLPWOGUVMCRRX-UHFFFAOYSA-N 438.576 2.470 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 769160479 INPDUPOJFSEQHX-GOTSBHOMSA-N 448.583 2.354 10 20 IECD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)c1cnn(C)c1 769907290 JNYPHCBMBMQKMK-UHFFFAOYSA-N 431.430 2.111 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCCc4nc(O)ccc43)CC2)cc1 778224149 RJJQIEQCESJXOB-VIOKTNGOSA-N 436.512 2.194 10 20 IECD CC[C@H]1CCCCN1CCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778276411 QXJLQCBEYNBWMF-DUQGCJEPSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3(c4ccc5c(c4)OCO5)CC3)CC2)cc1 778392025 ZTQAJXYUMZBMGB-HJWRWDBZSA-N 449.507 2.434 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cccc(N4CCCC4=O)c3)nc12 785212756 BONKUZPWTBCYQA-UHFFFAOYSA-N 438.440 2.024 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CC34CCOCC4)cc2F)C[C@@H](C)O1 786456407 IJGJCCQHQJFNCA-JFIYKMOQSA-N 434.508 2.415 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 789827125 RKFNWJMMFUJASY-IYBDPMFKSA-N 431.512 2.149 10 20 IECD CS(=O)(=O)[C@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 800456973 FLJWDPUSMUAKCX-HNNXBMFYSA-N 440.521 2.300 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc4c(s3)CSCC4)CC2)cc1F 806934209 CTXBKRUFOQGCQO-UHFFFAOYSA-N 436.534 2.367 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 807290838 AYPQRWONBOPFNG-JOCHJYFZSA-N 446.551 2.029 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCN(c4ccccc4F)C3)nc12 811378881 VRUCRFQORPUFOR-CYBMUJFWSA-N 428.420 2.320 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 915311936 SPKGJJQFKCKEJH-UHFFFAOYSA-N 448.545 2.104 10 20 IECD C[C@H](Sc1nncn1C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456541 IECALPOGJYIPSD-LBPRGKRZSA-N 429.468 2.468 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2OC)cc1C 917758376 TVZWLXAOICQJBV-UHFFFAOYSA-N 428.488 2.264 10 20 IECD COCCOc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 918035673 YZIDQGVEPZJXQI-QGZVFWFLSA-N 427.505 2.130 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(F)c(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 918632676 BEFRJXPJKBLMGT-BETUJISGSA-N 439.484 2.156 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2)c1ccc(N2CCOCC2)cc1 920927654 ZWYTVQRKKLTGEL-LSDHHAIUSA-N 438.484 2.059 10 20 IECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc2F)CC1 1335107600 QZNINIOFMFLBEF-UHFFFAOYSA-N 448.564 2.211 10 20 IECD COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1C 1803485721 FEAAKUILUFMVHQ-QDMKHBRRSA-N 447.582 2.116 10 20 IECD O=C1CC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)CC3)C1 1828068614 UMBGYQSIMTVGFM-SNVBAGLBSA-N 435.889 2.413 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ncc[nH]2)CC1 1832071243 HTZMBTSNIILQBX-QGZVFWFLSA-N 427.505 2.082 10 20 IECD O=C(c1cc2ncsc2[nH]1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441552 FYKDEYVWORTVMW-UHFFFAOYSA-N 448.508 2.234 10 20 IECD O=C(Cc1cccnc1Cl)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033745 BDRWONUJLNYOCA-FNORWQNLSA-N 443.887 2.311 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)ccc21 522690981 FHTJCSSOLSMTLI-UHFFFAOYSA-N 439.516 2.212 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)C1 730175712 UJCVQTYNVQOGCU-ROUUACIJSA-N 438.503 2.197 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 741214537 XGLVFJKHATZIFF-OAQYLSRUSA-N 437.540 2.457 10 20 IECD CCc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c2)o1 743896728 IWIXYETVJFIIIM-UHFFFAOYSA-N 435.484 2.391 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 746676888 LLEGGRMVRPYSET-GOSISDBHSA-N 444.557 2.255 10 20 IECD Cc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 751213546 XKVNRDXBWUAXLK-UHFFFAOYSA-N 443.478 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1F 753742265 QOZJGIXENBKDIL-CQSZACIVSA-N 425.464 2.178 10 20 IECD CC[C@H](C)c1nc([C@@H](C)NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)n[nH]1 754709530 KTJYDCZSEJSRKG-JGUBBDCWSA-N 440.548 2.409 10 20 IECD NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)cc12 760890147 WKGAGIBOIXQMKB-UHFFFAOYSA-N 433.424 2.128 10 20 IECD COC(=O)[C@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767879708 BGBNRRFNIYNHAN-NFBKMPQASA-N 445.535 2.130 10 20 IECD O=C(Nc1cccnc1-n1cncn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769726446 GTUNAYRTBOZEQI-UHFFFAOYSA-N 442.482 2.483 10 20 IECD CN1CCN(c2ccc(CNCC3CCN(S(=O)(=O)C(F)(F)F)CC3)cc2)CC1 771832515 GQNZFFSGYJPTLU-UHFFFAOYSA-N 434.528 2.090 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 773744417 RHRFVBCHLVTWSL-JBEBIEQOSA-N 435.480 2.287 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3[nH]2)cc1 779620455 SXNVRJRNLSBXBB-BWAGFHJFSA-N 438.528 2.231 10 20 IECD CCCNC(=O)[C@H]1CN(C(=O)C(=O)N(CCC)Cc2ccccc2O)c2ccccc2O1 784023327 BFLSPLQKVCBMJT-OAQYLSRUSA-N 439.512 2.451 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(C)cc1C 788326486 GJFRQBYYANQHRD-UHFFFAOYSA-N 425.485 2.182 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 788330112 ABOQKPJIWBTZFI-RNHFSVANSA-N 441.572 2.336 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)cc1 788976998 GIXRGDCHQWSAHZ-NHCUHLMSSA-N 443.636 2.166 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CCC(NC(=O)C(C)(C)C)CC3)nc12 789201827 DHGVPHFPHONSCN-UHFFFAOYSA-N 446.504 2.376 10 20 IECD C[C@H]1CN(CCN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)O1 789329186 LZNXZMYWLSXWHK-CALCHBBNSA-N 435.524 2.442 10 20 IECD CC(C)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819068 LDPAFJJRLYUAHB-ZHALLVOQSA-N 435.540 2.329 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]1c1ccccn1 789842201 BHWAQWIUKORICF-NRFANRHFSA-N 426.492 2.162 10 20 IECD COc1ccc(CNC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(O)c1 792803977 JYVOXKDSOHKVDA-UHFFFAOYSA-N 433.530 2.362 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)N3CCC[C@H](C)C3)CC2)cc1 793909183 LTMIPGHIZSRRQB-SFHVURJKSA-N 430.593 2.407 10 20 IECD CN(C)C(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 799774311 UDFLNYRHSWEZHA-UHFFFAOYSA-N 431.558 2.076 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2cccs2)CC1)c1ccc(N2CCOCC2)cc1 803298120 PFKJIANDMKKTCF-QGZVFWFLSA-N 428.558 2.111 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 806846015 ZLMLPRCJYKDSCG-HXUWFJFHSA-N 438.576 2.154 10 20 IECD O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCC(CO)CC2)cc1 918214335 FQFKEFBGUVSBJM-UHFFFAOYSA-N 445.585 2.310 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)s1 919767801 ZECSDLWNAIDYDG-IBGZPJMESA-N 449.598 2.363 10 20 IECD CN(Cc1nnc2n1CCC2)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1323298526 YOKKTFIHZAKZHV-UHFFFAOYSA-N 438.454 2.421 10 20 IECD C[C@H](NC(=O)c1n[nH]cc1I)c1ccc(N2CCOCC2)cc1 1324037490 IJGIDTQKGSHXQO-NSHDSACASA-N 426.258 2.342 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2 1782004974 RNUKKMYZPQJMCE-SFHVURJKSA-N 442.255 2.150 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CC(C)(C)O)C3)cc1 1799620023 JAVLSHJOAKFPKZ-JHDGKUDLSA-N 439.556 2.458 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801296424 LZHLFMSHJGDWIW-HZVDOMFNSA-N 448.472 2.016 10 20 IECD COc1cc(F)ccc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1804510448 HYKNARUSAKZKFX-BJWYYQGGSA-N 429.448 2.135 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)C(F)F 1806430579 BIZIEJNNIAGRGQ-BEFAXECRSA-N 441.438 2.145 10 20 IECD COC1(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CCC1 1816728122 JUPCDZJFLNWWCA-LBPRGKRZSA-N 432.502 2.134 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)nn2)[nH]n1)c1cc(O)nc(O)c1 1817846268 OEWKVJDZHLHBQA-CYBMUJFWSA-N 443.851 2.279 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnn3c2CCC3)CC1 1830902683 WVNVQHMWCZEANP-GOSISDBHSA-N 439.516 2.183 10 20 IECD COc1cnc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(F)c1 1842273102 ZAWVGNPODVBWIM-UHFFFAOYSA-N 435.839 2.425 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C(=O)OC)[C@H]3C(=O)OC)ccc21 511318236 CVJIMAYNHQNXDD-XLIONFOSSA-N 430.501 2.471 10 20 IECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N(C)C1CC1 727860612 OBPAGFFJNACGKA-CYBMUJFWSA-N 448.501 2.314 10 20 IECD CN1CCC[C@H](CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 731058415 XURSGMHZFJKSGK-CQSZACIVSA-N 448.501 2.173 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1 734703956 TUPFNIYJLWZCJM-UHFFFAOYSA-N 446.573 2.345 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 735195919 SPRUOPHBYREGTF-WJOKGBTCSA-N 443.569 2.219 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCNS(=O)(=O)c1cnn(C)c1 742449487 JXDDJYLIUVXWCU-UHFFFAOYSA-N 449.558 2.145 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C[C@@H](NC(N)=O)c3cccc(C)c3)CC2)cc1 742920712 MUQNXZXNEBQHJR-JOCHJYFZSA-N 439.560 2.042 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1 747571343 NNYLPYZCNQKWSK-IRXDYDNUSA-N 428.537 2.215 10 20 IECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 753076650 IERHGMPQXIZRLR-PRAQEBQASA-N 447.630 2.471 10 20 IECD COc1cc(N2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759220041 BOZQDALAZZEDOM-UHFFFAOYSA-N 431.445 2.348 10 20 IECD CC1(C)C(=O)Nc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 760537756 RSOHGHYFUVLCBJ-UHFFFAOYSA-N 433.505 2.371 10 20 IECD CCOC(=O)c1cnn2c(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccnc12 763928657 VJCOHFMEBIBRCW-UHFFFAOYSA-N 437.500 2.045 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1NC(=O)CCN(C)C 767970066 WSCWZCOTXOCLQO-UHFFFAOYSA-N 425.533 2.206 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)O1 774776908 USLONBLPPGVTPC-WBAXXEDZSA-N 440.491 2.192 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(Br)c(C(=O)O)c1 775286915 PRTUSEWFGSVVDP-UHFFFAOYSA-N 430.232 2.440 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(CNC(C)=O)cc3)CC2)cc1 778275065 HHBZMTTYEDCAGL-QXMHVHEDSA-N 436.512 2.175 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc4c(cc3F)NC(=O)CC4)c2)CC1 780408776 MVPPEEHYQICTRT-UHFFFAOYSA-N 446.504 2.180 10 20 IECD CCC[C@]1(C)C(=O)NCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 782661102 HVRUSVBMIAQRDP-SEPYTNNBSA-N 434.556 2.046 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc(OC)cc3)cc2F)CC1 786760736 ODVQIBSOTFMOTB-QGZVFWFLSA-N 442.535 2.470 10 20 IECD Cc1ccccc1C1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789802328 XBBMJBXUGMOSAO-UHFFFAOYSA-N 425.504 2.435 10 20 IECD Cn1cc([C@H]2CSCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 790237022 IXFKHSDOUAMPNP-YLJYHZDGSA-N 442.589 2.122 10 20 IECD C[C@H](OC(=O)[C@@H]1CCCN(C(N)=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792273178 QBUUXPSQDKETPW-UONOGXRCSA-N 449.463 2.123 10 20 IECD CCCn1ccnc1CCCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803300987 XFMGNSADTHEKOS-IBGZPJMESA-N 441.576 2.398 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288932 DGXMDYIBNGMNBF-UHFFFAOYSA-N 437.496 2.083 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C(N)=O)nc3)cc2Cl)C1 807954422 RIXWJYKHIOQJHS-AWEZNQCLSA-N 443.935 2.003 10 20 IECD Cc1cc(N2CCC[C@@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)C2)n(C)n1 809872098 SHDORDNCAOIFFS-HXUWFJFHSA-N 440.592 2.317 10 20 IECD CC(C)N(C)C[C@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 811866349 KKKRSZNYHGNBJR-SFHVURJKSA-N 443.571 2.470 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3cc(OC)cc(OC)c3)CC2)cc1 918369853 UDBCFKSPXWIGHF-UHFFFAOYSA-N 427.501 2.181 10 20 IECD CC1=CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1778110341 QUCKOKXYDSWVGG-QEAUFWJJSA-N 442.512 2.393 10 20 IECD CC(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792219088 ZBNHZIXHXRWSRY-SNYJDTOOSA-N 432.517 2.233 10 20 IECD Cc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1798910532 LPUDYURNCXGORG-SQKXBHHXSA-N 438.480 2.028 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994396 WCDHDUKQBLEPSI-NHYWBVRUSA-N 442.369 2.108 10 20 IECD CC(C)(F)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898642 UETUPTBIBHBQOV-CQSZACIVSA-N 429.583 2.215 10 20 IECD O=C(c1ccc(N2CCCC2)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250328 LDZHSJZVPDIHIT-UHFFFAOYSA-N 440.475 2.363 10 20 IECD C[C@@H](Nc1ccccc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441767 OZRLFXXMZRXYBO-GOSISDBHSA-N 445.523 2.483 10 20 IECD O=C(COc1ccccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441945 JYKAADOAAREEEV-UHFFFAOYSA-N 432.480 2.062 10 20 IECD CC(C)(C)c1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)[nH]n1 1844475908 JJDYGCBTMJIECI-UHFFFAOYSA-N 448.527 2.317 10 20 IECD CCOc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035584 YSOUSAJCNQMINN-VQHVLOKHSA-N 439.468 2.128 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3ccc(-c4ncon4)cc3)C=C2)CC1 518016806 SFKGAFPLUINHPG-UHFFFAOYSA-N 432.527 2.342 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N3CCC4(CC3)OCCO4)ccc21 728639211 OBIKQJHKSQWAPV-UHFFFAOYSA-N 430.501 2.427 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCCc4ccccc43)cc2)C1 731403166 DYXFTVAIAVMGTN-NLFFAJNJSA-N 436.556 2.412 10 20 IECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 735836987 OLSSUJNGBMTALK-SFHVURJKSA-N 430.509 2.322 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccccc3SCCO)CC2)cc1 735940048 AKXCZFFHBMDSFL-UHFFFAOYSA-N 430.526 2.285 10 20 IECD Cc1ccnc2nc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)nn12 742752325 FZHQLHMARFLLQZ-QGZVFWFLSA-N 439.520 2.495 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(N2CCNC2=O)CC1 745905940 SUQYAVVWVFLQJD-HNNXBMFYSA-N 437.491 2.456 10 20 IECD CN(C)c1ccc(CN(CN2C(=O)C[C@@H](Cc3cnn(C)c3)C2=O)CC(F)(F)F)cc1 746377707 OMUQQSYIJRKJMN-QGZVFWFLSA-N 437.466 2.426 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 746784209 UXLMQLSPKZXYGE-UHFFFAOYSA-N 425.485 2.215 10 20 IECD CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749406259 NNXGFJBOWMHOTM-UHFFFAOYSA-N 429.496 2.491 10 20 IECD CN(C[C@@H]1CCOC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749566796 ZGVXYTJXNRPDHA-SFHVURJKSA-N 428.512 2.120 10 20 IECD CC[C@@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC1 753010251 SIPZOCJWKSIRQL-MAUKXSAKSA-N 440.491 2.193 10 20 IECD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NCCCSc2nccs2)CC1 759601551 NMTGZIOLJHIPRK-MRXNPFEDSA-N 425.624 2.354 10 20 IECD COc1cccc(CNC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759879422 VKYQEBGXRDVLKM-UHFFFAOYSA-N 429.517 2.159 10 20 IECD Cc1nn(C)c(=O)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 765107068 LFACDBAKGYBDIT-GOSISDBHSA-N 443.548 2.459 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1nccn2c(Br)cnc12 769710601 CIWSSRBBRUNMBU-UHFFFAOYSA-N 434.269 2.398 10 20 IECD CC[C@H]1Oc2cc([C@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2NC1=O 769932477 UPKSUOOQTDTCRP-APPDUMDISA-N 433.486 2.364 10 20 IECD C[C@@H]1COCCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770067950 CITNLADMOCSMJK-CYBMUJFWSA-N 435.458 2.352 10 20 IECD CCOC(=O)c1cnc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 775050585 ARGOJYAMKPVPBA-UHFFFAOYSA-N 441.484 2.081 10 20 IECD O=C(NCCCCCCO)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775727580 HQBKVUBNPGNGLN-UHFFFAOYSA-N 430.528 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 778391196 KHHKJRVDQPUXKX-VWDGOUSSSA-N 437.540 2.008 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c1 780794328 KLGNWJGZIPUDFN-UHFFFAOYSA-N 425.406 2.173 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784767741 RLZIDFIKEBRMDR-KRWDZBQOSA-N 444.919 2.172 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 785295070 QNDDHOLPEOQKRI-BRWVUGGUSA-N 441.528 2.393 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nccn1C 785648232 YTFUBNKJNMDSFA-JOCHJYFZSA-N 447.539 2.333 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4nc(C)cc4C)nc3)cc2)CC1 786260459 XGLIGMRJMFUWDI-UHFFFAOYSA-N 432.528 2.483 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCCCCC1 786630393 WZWSWOSRSIZTJC-QHCPKHFHSA-N 444.620 2.498 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(-c4cc(C)cc(F)c4)nn3)cc2)CC1 788774243 IPEZGTYKWJZIMY-UHFFFAOYSA-N 436.491 2.313 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)o1 789828136 WPNDVNKTCCRORZ-FCEWJHQRSA-N 447.507 2.461 10 20 IECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 789838689 GHKPNQPWVUDIHB-ZDUSSCGKSA-N 437.518 2.500 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C)c(Br)c2)ccc1O 790406831 IBTOMELPTXOIAB-UHFFFAOYSA-N 435.321 2.172 10 20 IECD COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 791535448 XVBIPXPMJYRYDA-AVRDEDQJSA-N 436.512 2.206 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(Br)n1 792955520 ICOOYFHECJXAFL-UHFFFAOYSA-N 433.306 2.278 10 20 IECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 795073230 KJDBAXNNUSTJFA-UHFFFAOYSA-N 437.635 2.093 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c(O)c1 797390484 HEKRMCOFURUUQJ-HZPDHXFCSA-N 427.501 2.265 10 20 IECD Cc1ccc([C@@H]2COCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 803302852 CUNRYRSHRNIFBR-XLIONFOSSA-N 427.501 2.202 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OC)c1 805153743 SABFZERLONNJRD-HNNXBMFYSA-N 429.517 2.315 10 20 IECD CN(C)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc2ccccc12 810172382 HBHRBAVEPRVRIS-UHFFFAOYSA-N 438.553 2.466 10 20 IECD Cc1cc(CCNS(=O)(=O)c2cccc(S(N)(=O)=O)c2)c(C)n1-c1ccccc1 818020725 IHMRZXBPTYROHI-UHFFFAOYSA-N 433.555 2.263 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1 916687756 GTPOATGHHNTSCG-UHFFFAOYSA-N 437.500 2.239 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(NC(C)=O)c2)cc1 917754080 SFYIKUSZLMWIAJ-UHFFFAOYSA-N 427.504 2.216 10 20 IECD Cc1ccc(CN2C[C@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2=O)cc1 917832269 RAEKBKIHFPIWEX-FCHUYYIVSA-N 448.567 2.362 10 20 IECD CC(C)n1ncc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc21 918284676 NLPVHKTYPASDQV-UHFFFAOYSA-N 440.479 2.243 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918293962 AEKCGPIFKPBBSP-SFHVURJKSA-N 446.525 2.332 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 919970125 PPSJDKPYQZHYCL-OAQYLSRUSA-N 428.577 2.439 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC(=O)N3CCCc4ccccc43)cc2)C1 920045590 PPOLVMWOKRHINC-HXUWFJFHSA-N 449.555 2.167 10 20 IECD CCOc1ccc(N2CCN([C@H](C)C(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 1116418224 SYBNFBQTDGTSSY-LJQANCHMSA-N 440.544 2.173 10 20 IECD COCCNC(=O)CN1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)CC1 1318615035 CKRRVDYNSXXVBN-UHFFFAOYSA-N 432.952 2.268 10 20 IECD Cc1nnc(O)c2c(NC(=O)CN(C)Cc3ccc(N4CCOCC4)cc3)oc(C)c12 1319496733 NUUSMJZSVXBWAR-UHFFFAOYSA-N 425.489 2.452 10 20 IECD Cc1cc(-c2nnc(N3CCN(C(=O)N4CCOCC4)CC3)n2C)c(C)n1-c1ccccc1 1327092168 LXXBRBSQBVZIBY-UHFFFAOYSA-N 449.559 2.464 10 20 IECD C[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC=CCC1 1784760963 WQCKQHQLABQWRC-SGRYIFHISA-N 442.512 2.393 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H]3CCOC3)cc2)CCC1 1791977642 JCBVLPRZJFKDLS-ZDUSSCGKSA-N 433.555 2.017 10 20 IECD CCc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)co1 1798912997 ASRGCSHYKSJCHR-RRJKNOHSSA-N 427.457 2.319 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccnc(F)c1 1803840099 KPXITWOBBZWHEF-QRWLVFNGSA-N 437.431 2.055 10 20 IECD CCc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807990894 KNOUEISBWUMPSD-XOBRGWDASA-N 437.456 2.072 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)F)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146724 ZCODDIUVOTVRSH-OAHLLOKOSA-N 430.415 2.460 10 20 IECD CO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822448010 CUOQUSMSKZOTNF-KSSFIOAISA-N 438.488 2.230 10 20 IECD Cc1cnn([C@H](C)C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1822744558 PIYSZRDTLDOTMP-CZUORRHYSA-N 439.476 2.288 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCOc2ccccc2)C1 1842642594 SSWQRFDYUBAKNV-CSKARUKUSA-N 438.480 2.489 10 20 IECD C[C@@H](Cc1ccncc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1845765889 GIGYAWQJXPGCBI-NBUZRDOWSA-N 437.496 2.294 10 20 IECD COc1cc(Cl)ccc1CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845890523 AKPPFBLXSFBJGM-UHFFFAOYSA-N 431.876 2.215 10 20 IECD O=C(CCCc1ccncc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033761 BVWYXNAMUGKFFB-SOFGYWHQSA-N 437.496 2.438 10 20 IECD CN(C)c1ccc(CNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)cc1 15134365 UMRZUMKUARCVKF-UHFFFAOYSA-N 437.949 2.357 10 20 IECD CCN(C(=O)[C@H](C)OC(=O)c1sc2nc(C)cc(C)c2c1N)[C@H]1CCS(=O)(=O)C1 29033591 FJLJFQAHFXQDBQ-STQMWFEESA-N 439.559 2.076 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)nc3)cc2F)CC1 730235664 LCOMQXVKVZTRFU-UHFFFAOYSA-N 427.524 2.129 10 20 IECD Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)COC(=O)c2cc(O)cs2)CC1 732354938 XIXYNEQDBWXIAI-UHFFFAOYSA-N 431.514 2.010 10 20 IECD Cc1ccccc1-c1csc(NS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)n1 743248876 SMVUVBFKOPCMIU-UHFFFAOYSA-N 429.483 2.267 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1CCS(=O)(=O)CC1 746589444 REFVESVTOJIFMK-KAMYIIQDSA-N 444.625 2.423 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CCCC4)cc3)cn2)C[C@@H](C)O1 747570214 HQQUOKDDCRMOTN-HDICACEKSA-N 440.548 2.441 10 20 IECD COc1cc(N2CCN(Cc3c(O)nnn3-c3ccccc3)CC2)cc(OC)c1OC 758956269 WQLSQSHLILIHLM-UHFFFAOYSA-N 425.489 2.321 10 20 IECD CCOC(=O)c1c(NS(=O)(=O)c2cccc3nonc23)cc(OC)c(OC)c1OC 765094338 DXNBNSUHIGFOHH-UHFFFAOYSA-N 437.430 2.226 10 20 IECD O=C1COc2cc(NS(=O)(=O)c3cccc4nonc34)c(Br)cc2N1 765095866 RCVYTMFCHNDRNG-UHFFFAOYSA-N 425.220 2.117 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765926326 LMOZQZNOCISDPZ-UHFFFAOYSA-N 438.253 2.251 10 20 IECD O=C(COC(=O)C[C@H]1CSCCS1)NCc1ccc(N2CCOCC2)c(F)c1 767701199 RDPRQAOUJRWNNX-HNNXBMFYSA-N 428.551 2.060 10 20 IECD CCC[C@]1(C(=O)OCC)CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 769999763 GWZAFSWWZOSUOR-HSZRJFAPSA-N 435.540 2.476 10 20 IECD COC(=O)N1CC(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 771755589 JYGDCEIYTDSVDJ-MDWZMJQESA-N 425.557 2.296 10 20 IECD COc1ccc(N2CCN(CCCN[C@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 774375380 DYVBSUJNTGDIMT-GOSISDBHSA-N 432.590 2.206 10 20 IECD COCCN1C(=O)c2ccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2S1(=O)=O 775402003 ANYJODOAVUKEJW-AWEZNQCLSA-N 431.514 2.035 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnc(O)c([N+](=O)[O-])c1 776335217 HKIPFYFPJNVSFT-UHFFFAOYSA-N 426.351 2.481 10 20 IECD Cc1cc(NS(=O)(=O)c2cc3c(cc2Br)n(C)c(=O)n3C)ccc1O 776748564 PMWJYAXOCJWZIY-UHFFFAOYSA-N 426.292 2.454 10 20 IECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@@H](O)C(F)(F)F 778202062 DAHGYLUQWYZNBL-GOSISDBHSA-N 447.479 2.169 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1 778217496 HFKPEARJKWGMQT-YAOQVBECSA-N 436.556 2.319 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(OCCN(C)C)c3)cc2F)CC1 781424650 CIUSLGFNRRYWJA-UHFFFAOYSA-N 429.540 2.233 10 20 IECD CN(C)CCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 782219346 NUGHTVKMUMMEMG-UHFFFAOYSA-N 428.508 2.021 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCCCC3)cc2F)C[C@@H](C)O1 787752494 VFXVPTKCADLHQO-KURKYZTESA-N 434.556 2.046 10 20 IECD COc1ccc(C[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789799746 LBOZPROLQJMBDA-KRWDZBQOSA-N 443.519 2.282 10 20 IECD CCOc1nc(C)ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 791655016 PTSHEKKQTZEMQJ-UHFFFAOYSA-N 431.464 2.238 10 20 IECD O=S1(=O)CCN(c2ccc(CNCc3ccc(Cl)cc3-n3cncn3)cc2)CC1 792976713 GJTWENQMIUVDQR-UHFFFAOYSA-N 431.949 2.445 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)COCc1ccccc1 793952982 CVRUMAGZODDDQC-FQEVSTJZSA-N 439.556 2.451 10 20 IECD COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c(O)c1 794387914 OONWBZNCSDOVDT-GASCZTMLSA-N 434.514 2.129 10 20 IECD CC(=O)N1CCN(Cc2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)CC1 799184973 SVTVPDMTMVTJKD-UHFFFAOYSA-N 431.543 2.156 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 803400569 GNLZQBCCLVTBRW-QFIPXVFZSA-N 442.535 2.006 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNc3cc(S(=O)(=O)N4CCCC4)ccn3)cc2)C1 804366742 WOKBTEDTNQSASC-SFHVURJKSA-N 443.573 2.180 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1C[C@H](C)S(=O)(=O)[C@H](C)C1 810112553 XZUZGNXWNZRXDH-ZNMIVQPWSA-N 440.521 2.296 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(N4CCNC4=O)cc3)CC2)cc1 812598485 FJCHPYJMCAJAPI-UHFFFAOYSA-N 437.544 2.167 10 20 IECD O=S1(=O)CC[C@H](NS(=O)(=O)c2ccc(NCc3c(O)cccc3Cl)cc2)C1 863992784 IITGZWXINGIZHP-ZDUSSCGKSA-N 430.935 2.123 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1C 917758228 MCRRPIDDOIRBIV-UHFFFAOYSA-N 439.559 2.236 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)cc2)C1 917833026 KNRJZJZUWAYUQI-SFTDATJTSA-N 434.540 2.053 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccco4)CC3)cc2)C1 918118948 WQXSOTBPJDXGNE-IBGZPJMESA-N 425.533 2.009 10 20 IECD CC(C)N(CCCNC(=O)CN1CCCc2cc(OC(F)F)ccc21)S(C)(=O)=O 919802975 NJMXNEWPZQQGTB-UHFFFAOYSA-N 433.521 2.217 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920924503 CREZIJYXTPRUFO-KRWDZBQOSA-N 438.528 2.349 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2 1782004847 OSBPOPBVFGKKPI-FQEVSTJZSA-N 435.839 2.043 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)no1 1796934848 VBZNVYJNFAJHEL-ACHSLPGTSA-N 435.484 2.282 10 20 IECD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cnc1C 1799767512 VDBWOEPLGFUZKA-HGKCTWBKSA-N 445.903 2.280 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1802923620 BTHOVOZFJKXHPD-XEYPJELSSA-N 448.527 2.184 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C(F)(F)Cl)[C@H]1c1cccnc1 1813211275 HMXSCGHVIAXTOU-IAQYHMDHSA-N 426.807 2.039 10 20 IECD O=C(CC1CCC1)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823433775 OYDVPJRGJZSLKT-AWEZNQCLSA-N 435.575 2.452 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1 1832096845 BJHXSNIZZYGBIW-SHCNBLLESA-N 425.489 2.163 10 20 IECD COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 726290579 UBHHUFMFNONVSY-UHFFFAOYSA-N 446.403 2.291 10 20 IECD O=C(NCCCSc1nccs1)C1CCN(S(=O)(=O)c2cccnc2)CC1 733972862 AOKLFTLLSBINEK-UHFFFAOYSA-N 426.589 2.237 10 20 IECD Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 743836109 JRCZKQRQTDZFIN-UHFFFAOYSA-N 434.879 2.225 10 20 IECD COc1ccc(N2CCN(C(=O)CONC(=N)Cc3ccc(OC)c(OC)c3)CC2)cc1 744185209 QNNXPYDMNSIZEA-UHFFFAOYSA-N 442.516 2.102 10 20 IECD O=C(Nc1cnn(CCN2CCOCC2)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 747561137 FZEHQQBVECPIAW-HXUWFJFHSA-N 429.521 2.134 10 20 IECD O=C(Cn1c(-c2cccnc2)noc1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 749358035 NVFMOUDXXRWICQ-UHFFFAOYSA-N 426.388 2.312 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc2c(c1)C(=O)CCC2 750254782 ZZRXWIPCJPJNDS-UHFFFAOYSA-N 425.460 2.436 10 20 IECD COC(=O)C[C@H]1CN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CCO1 751969508 SCOFDJBTHALYBB-QMMMGPOBSA-N 434.199 2.042 10 20 IECD CS(=O)(=O)NCc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)o1 753600861 JODQZEPDXNVLNV-UHFFFAOYSA-N 443.472 2.329 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 754155284 VPVSCBMNNGRYAN-UHFFFAOYSA-N 442.601 2.147 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@@H]2c2ccccc2C)c1 758994709 WOOXZZLTDUKPEL-QHCPKHFHSA-N 437.540 2.409 10 20 IECD CNS(=O)(=O)c1cccc([C@@H](C)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761230736 WPYVVRIKPCFNON-GFCCVEGCSA-N 437.905 2.479 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCS(=O)(=O)C[C@@H](C)C2)c([N+](=O)[O-])c1Br 763054033 NPMBCFCCQIOEIX-QMMMGPOBSA-N 438.256 2.145 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765903327 JCZKZVCUHSYBAN-UHFFFAOYSA-N 439.262 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nccn3-c3ccccc3)CC2)cc1 766036183 YYQABSWCSHFOSH-HKBQPEDESA-N 438.553 2.478 10 20 IECD Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NCc1ccccc1O 768284232 BMLPNHLVPBQOAF-UHFFFAOYSA-N 428.514 2.091 10 20 IECD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770575537 GJMJTTPZASUVKP-CZUORRHYSA-N 433.521 2.337 10 20 IECD COc1ccc(C(=O)N(C)C)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772904106 MJMWVYSCKAULQQ-UHFFFAOYSA-N 444.507 2.101 10 20 IECD O=C(NC[C@H]1COC2(CCOCC2)O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776944679 DPUYMQOLFXGOPI-QAPCUYQASA-N 441.475 2.478 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 777829404 WHAIJHUIHBKJDU-UHFFFAOYSA-N 440.905 2.125 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3nc4ccccc4[nH]3)CC2)cc1 778224726 DEJPWWPLSSJQAJ-VAWYXSNFSA-N 433.512 2.435 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCCN1CCN(C)CC1 778952370 BBJHGGBBGSKJTF-SFHVURJKSA-N 448.567 2.358 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](O)[C@H](O)c1nc2ccccc2s1 779489531 RTBLXCMNIWAKPU-UXHICEINSA-N 445.516 2.107 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 781520164 AYAOXLSSWISFLX-UHFFFAOYSA-N 439.468 2.122 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Nc1cccn(CCS(C)(=O)=O)c1=O 782794151 GXXZFSBZFOPQMF-UHFFFAOYSA-N 434.562 2.401 10 20 IECD CNC(=O)[C@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c2ccccc2O1 783317313 PISBELYKJIWRSV-OAQYLSRUSA-N 438.528 2.030 10 20 IECD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785298033 UJRFAMFXMQAZIG-CQSZACIVSA-N 441.484 2.028 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(-n2cncn2)cc1 785397173 LAQQIVXSKLKGQK-MSOLQXFVSA-N 448.527 2.159 10 20 IECD O=C(NCCc1c(F)cccc1F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787918065 UDUXGVJFTJSOEY-UHFFFAOYSA-N 435.446 2.040 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3nc4c(s3)CCC4)cc2F)CC1 789471592 HEKFUXGUNQMPPC-UHFFFAOYSA-N 431.537 2.168 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 789801378 SLXDHVXCNFCLGV-GOSISDBHSA-N 433.524 2.277 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843418 KXCIQDSDVRQUTP-UHFFFAOYSA-N 442.535 2.128 10 20 IECD C[C@H]1CSCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950802 QPZOGZPGKXQLKD-ZDUSSCGKSA-N 431.480 2.122 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)COc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 793780662 AFVUWCURFCTWMO-SJORKVTESA-N 429.492 2.423 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(CNC(=O)OC(C)(C)C)CC3)ccc21 803685967 QYCSXYYSUOLXQS-UHFFFAOYSA-N 444.576 2.449 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1)c1ccc(N(C)C)cc1 804521036 LDLGPNGOBNCFKK-SFHVURJKSA-N 438.572 2.203 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1F 804852959 JKYNSQYCBLSUOT-WBVHZDCISA-N 436.528 2.271 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C2CC2)cc1 808346363 SHBGNUYYGGKSFO-DHIUTWEWSA-N 442.604 2.128 10 20 IECD CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)OCC(=O)C(C)=O 808484726 GNQDSURSZVZHPL-LBPRGKRZSA-N 442.342 2.095 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 915778810 PZYMTDGCXNLALF-UHFFFAOYSA-N 442.541 2.082 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@H](C)O1 918306241 XIVMXRCTEUULJP-IRXDYDNUSA-N 425.533 2.358 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccccc1-n1cccn1 918442256 CSJJFODBNCDGFV-UHFFFAOYSA-N 433.512 2.336 10 20 IECD CSC[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 919767341 XIMUULQUECIGSF-HSALFYBXSA-N 445.585 2.046 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1 920252006 WVRSTYGFPIOBPZ-QXMHVHEDSA-N 448.567 2.244 10 20 IECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCCc1c[nH]c2ccccc12 920638076 RKFQQRMGOQJODW-CYBMUJFWSA-N 445.497 2.149 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccccc2Cl)nn1 1321366461 LYCOMRMMODGVNU-AWEZNQCLSA-N 430.848 2.236 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CN)[C@H]3C2)cc1 1786785295 RDUBLBGZRQZXEY-AAEGSUEWSA-N 438.572 2.282 10 20 IECD Cc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1805241918 QHZIBHGMJDMGBE-RDTXWAMCSA-N 439.497 2.286 10 20 IECD COC1(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1813672416 BNMNXFNGSWQFFW-HRAATJIYSA-N 440.500 2.167 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@@H]1CCOC1 1822957582 PADWBCQFGDKIJU-WQELODFKSA-N 442.472 2.269 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)CC1 1826647670 AYCMDYQBAUTDCJ-UGKGYDQZSA-N 439.512 2.460 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@@H]2C[C@H]2C1 1827428171 KMGWOTGRHXQVHQ-TTYHFUOFSA-N 442.560 2.066 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429060 ODPDQSKCWZNXLT-KXBFYZLASA-N 441.532 2.492 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c(O)n1 1829734575 CPWPXCLYWOHVAO-SFHVURJKSA-N 440.500 2.449 10 20 IECD O=C(c1n[nH]c2ccccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037857 VQSIOKXPOUIRCB-VQHVLOKHSA-N 434.452 2.210 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)n(C)c2ccccc12 472765590 DGIPALCPUINCBF-UHFFFAOYSA-N 447.539 2.129 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(CC(F)(F)C(F)F)CC2)n(C)c2ccccc12 673314438 MSSGHFCPNQLYNM-UHFFFAOYSA-N 428.430 2.148 10 20 IECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1 726562703 ONMMEEXHCAHXQB-UHFFFAOYSA-N 443.978 2.474 10 20 IECD CC(=O)c1ccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 727979601 QYAYTXWUCFLQCE-UHFFFAOYSA-N 447.586 2.139 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 728889113 PFTJSPDIGYPMQB-FQEVSTJZSA-N 426.561 2.393 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CCCS(=O)(=O)C1 733959267 UUGNIVPWWKDVHI-LQELWAHVSA-N 444.625 2.423 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3nc4ccccc4oc3=O)CC2)cc1 742926873 DCVQBJGMNXYXIU-UHFFFAOYSA-N 436.512 2.068 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC(=O)Nc3c(C)cccc3C)CC2)cc1 742948173 NJGJHSXXDCUAKA-UHFFFAOYSA-N 439.560 2.372 10 20 IECD CN1CCCc2cc(CNC(=O)[C@@H]3CCCN3C(=O)/C=C\c3ccc(C(N)=O)cc3)ccc21 746814608 UHIMRRZGEKYTAA-MSABZPHASA-N 446.551 2.489 10 20 IECD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)CC2 750249998 GOGPQRFKAKRZPS-GJZGRUSLSA-N 439.534 2.378 10 20 IECD CC(C)[C@@H](NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nc(-c2nc[nH]n2)no1 752659231 GFIXMRIRUJYMEY-WMLDXEAASA-N 440.508 2.449 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 754421759 IMGKIVYMAWCTER-JOCHJYFZSA-N 448.523 2.437 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(c4ncccc4F)C3)cc2)C1 755309182 UDXMGXAOABAACZ-QZTJIDSGSA-N 440.523 2.001 10 20 IECD CNC(=O)c1ccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759216263 NJYKSOUAKCCKAQ-UHFFFAOYSA-N 442.516 2.104 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](CCO)C1 765222363 OAYTWKPBAKXWCK-CQSZACIVSA-N 449.485 2.336 10 20 IECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NCc1cccc(Br)c1O 765754188 SDASJPLPTSOMMN-FQEVSTJZSA-N 444.285 2.164 10 20 IECD O=C(NCCS(=O)(=O)CC1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765969903 XYGLONAAKGMLBS-OAHLLOKOSA-N 431.505 2.381 10 20 IECD C[C@H](CC(=O)Nc1cccnc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980411 ZQNCDQYUWGKMED-OAHLLOKOSA-N 436.965 2.477 10 20 IECD Cn1c(=O)nc(O)c2c(C(=O)NCc3ccccc3O)cc(-c3ccc4c(c3)OCO4)nc21 769361896 CIWFYVKSJJTVPW-UHFFFAOYSA-N 446.419 2.065 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@H]3c3ncon3)CC2)cc1 778287352 ODXMOFVYEXHSBU-VJIACCKLSA-N 425.489 2.037 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)c2)CC1 781046578 GQHAIVWASXVBHH-UHFFFAOYSA-N 426.429 2.287 10 20 IECD C[C@@H](c1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1)N1CCOCC1 785295616 XMMXRZMUDZVVNK-CVEARBPZSA-N 427.501 2.177 10 20 IECD COc1ccc(OC)c([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 785499443 LVQQGEUXXWWGBW-OAHLLOKOSA-N 445.491 2.173 10 20 IECD CCC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786121582 HWVUFVXGQMPULK-UHFFFAOYSA-N 429.542 2.426 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788724196 JRNJDHVRQFTVCY-VQIMIIECSA-N 426.521 2.295 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCCN3C3CC3)cc2F)C[C@@H](C)O1 789822995 CCENJSKUSOQQCY-FUHIMQAGSA-N 446.567 2.189 10 20 IECD CC(C)(C)[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789843435 LFSHMHCFJXQTLX-JXFKEZNVSA-N 435.540 2.113 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cccc(Cn2cccn2)c1 789848117 ZRULLNRQXIQWSB-UHFFFAOYSA-N 449.580 2.417 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 793940326 ZPEHOVASBYLTSW-SJORKVTESA-N 433.549 2.304 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(OC)cc3O)c(C)c2)CC1 797389513 LNMNMEBBIFLOTL-UHFFFAOYSA-N 426.517 2.106 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cccc(O)c3)CC2)cc1F 804852291 GEHOCXDBVWLIGG-UHFFFAOYSA-N 428.508 2.343 10 20 IECD COCc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 804919083 ZWCLMAJCWSPFRZ-UHFFFAOYSA-N 429.492 2.084 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 806281135 OJSJVIHBSGIBIV-UHFFFAOYSA-N 446.598 2.410 10 20 IECD CC1(C)C[C@@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806806466 NGVPFHZIBWVQPK-GJZGRUSLSA-N 425.476 2.447 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(O[C@@H]2CCOC2)c1 807291168 UGSVDXSHBMLADA-JOCHJYFZSA-N 435.524 2.472 10 20 IECD C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770367 LCTLFNCSEZYDAC-MDZRGWNJSA-N 438.519 2.172 10 20 IECD COCC(=O)NC1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 917120067 UEBGUTONGJGHMD-OAHLLOKOSA-N 449.507 2.016 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(OCC(=O)NC)c(OC)c3)CC2)cc1 1116419902 UIEVLNALGDZVBT-UHFFFAOYSA-N 427.501 2.181 10 20 IECD Cc1cccc(N2N=C(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CCC2=O)c1 1317924923 AURWFNBCAILQAC-LJQANCHMSA-N 447.539 2.496 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cnccc1F 1787195312 BTGAEZJTGDFJTI-MIUNTBIASA-N 449.866 2.192 10 20 IECD Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1Cl 1787294280 IPFYUIUPKDEUGR-JQFCIGGWSA-N 445.903 2.362 10 20 IECD CCn1nc(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1796597483 GJTMLTYJELWHJO-FJXIAYRNSA-N 440.500 2.293 10 20 IECD Cc1cc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)no1 1798514759 YBEKRIQIWNDAMH-IXYPHHJPSA-N 447.495 2.427 10 20 IECD Cc1onc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1C 1816720409 QSSBVHPZUWLQPW-NSHDSACASA-N 429.458 2.094 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843466 PJGIYEQVFLBBSQ-OAHLLOKOSA-N 439.476 2.186 10 20 IECD CCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1827140319 FBYDLPJOLJCXBT-GBVBUYCNSA-N 447.513 2.312 10 20 IECD COc1ccc(CC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843441690 AHWPAHNOEXHLQO-UHFFFAOYSA-N 446.507 2.234 10 20 IECD Cc1c(F)ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1N 1843441951 KEZRIVXELMZSCU-UHFFFAOYSA-N 449.486 2.326 10 20 IECD COc1cccc2c1OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 728396755 YESKKMFXVLPLEN-OALUTQOASA-N 438.528 2.200 10 20 IECD O=C(CN(C1CC1)[C@@H]1CCS(=O)(=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 731843343 ACAPVBZJVITAQM-OAHLLOKOSA-N 438.505 2.052 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc([S@](C)=O)c3)cc2F)C[C@@H](C)O1 737107624 NJNIQNQJSHGXLF-LBLJIAFJSA-N 447.532 2.432 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cs1 740919376 PPUZZEQPVCSHAB-UHFFFAOYSA-N 447.586 2.044 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccccc3NC(C)=O)CC2)cc1 743568709 YNSWCQLKYIDSAK-UHFFFAOYSA-N 425.533 2.275 10 20 IECD CCC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 747458218 LLFRDVLDFKIPQK-QGZVFWFLSA-N 444.557 2.215 10 20 IECD COCCOCC(=O)NC1CCC(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 748723349 BQEKWEXKUWYCFA-PELRDEGISA-N 447.576 2.038 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@H]4CCOC4)CC3)cc2)C1 753121458 NOOWLFMDHTVEAP-VQTJNVASSA-N 444.576 2.115 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4ccccc4)C[C@H]3C)CC2)cc1 754043545 QFVRAAOENGKTDN-RDGATRHJSA-N 438.616 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3CC(=O)c3ccccc3)CC2)cc1 757640451 VVHHZVOSCJVRBW-QFIPXVFZSA-N 437.540 2.318 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)N[C@@](C)(CCC=C(C)C)C3=O)CC2)cc1 758224479 VBDSHSAYSYBUOR-RDPSFJRHSA-N 444.576 2.235 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnn3[C@@H](C)C3CC3)cc2F)CC1 760224171 VYKNYYLKPVHLKF-INIZCTEOSA-N 442.539 2.390 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O 767338410 OHFASDNELPHFAI-DYESRHJHSA-N 433.574 2.137 10 20 IECD CC(C)[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768516500 DTCOHJKPNBLJOX-PXAQALGRSA-N 433.524 2.477 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CS(=O)(=O)c1cccc(Br)c1 773750144 UQSOEHPITQGCDG-NSHDSACASA-N 428.304 2.381 10 20 IECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775675920 FVELZFHEWWMLOU-JTHBVZDNSA-N 427.637 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C)CC34CCCCC4)CC2)cc1 778294061 IVWRVPQRPGZKGX-ZHACJKMWSA-N 440.588 2.377 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)Cc2ccc(O)cc2)cc1 781083870 GYBXLSDMOUGTTK-JOCHJYFZSA-N 425.529 2.325 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 784765904 CNCQQGHQVHERIZ-INIZCTEOSA-N 432.908 2.477 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc1 785527340 KACXBRXYJAURJN-XUVXKRRUSA-N 430.593 2.264 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)c3ccccc3)cc2F)C[C@@H](C)O1 785621690 GNXOXFZVECPLKO-QZTJIDSGSA-N 442.535 2.308 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCNC(=O)NC3CCCCC3)cc2)CC1 786258235 ARVYQXBSSRWJDF-UHFFFAOYSA-N 443.592 2.383 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@@H]3c3cc(OC)ccc3OC)nc12 788197928 VPDQLKUMUMKKJN-GDBMZVCRSA-N 441.440 2.476 10 20 IECD CC(C)NC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789825476 MCAYCQBKUAIOBN-IRXDYDNUSA-N 434.556 2.045 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC[C@H]3c3ccco3)cc2F)C[C@@H](C)O1 789828704 YEEWETBRVFOZKB-QINHECLXSA-N 445.491 2.249 10 20 IECD O=C(CCNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1cccnc1 790125551 XRINSNXVNWOALO-UHFFFAOYSA-N 435.507 2.456 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C2(S(C)(=O)=O)CCC2)NC(=O)OC(C)(C)C)cc1 793576327 ZVXWQACHUVJKOX-QGZVFWFLSA-N 439.578 2.402 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 803448322 OGLSWXMXQDUGNU-QRVBRYPASA-N 437.487 2.447 10 20 IECD C[C@@H](CN1CCOCC1)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677090 FRIHQJOMNXOMDB-IBGZPJMESA-N 430.593 2.251 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N(C)C3CCN(C(=O)c4ccccc4)CC3)ccc21 803687438 MOEROVNRLIDPFH-UHFFFAOYSA-N 448.567 2.448 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)Cc3ccc(C)s3)CC2)cc1 803747602 RPVFKZGQRVYBIW-QGZVFWFLSA-N 444.601 2.051 10 20 IECD CC[C@H](C)[C@H](C)N(C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CC1 803750374 LWLPIXGBSJMGGR-OALUTQOASA-N 430.593 2.359 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCc2ccnc(O)c2C1 807769798 VYNMBKDWVKWJAH-OAHLLOKOSA-N 446.454 2.059 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1cccc(N(C)C)n1 808403689 QDYYCMGOXQKULE-UHFFFAOYSA-N 435.322 2.281 10 20 IECD CCOCc1nc([C@@H](C)NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)no1 812565870 UCDFWTRZSWOYEE-CQSZACIVSA-N 449.508 2.225 10 20 IECD C[C@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)S1(=O)=O 813085536 FZYQMANYBLBVNS-ZNMIVQPWSA-N 431.505 2.474 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)cc1[N+](=O)[O-] 815009526 KFJVYSSELLGZFC-UHFFFAOYSA-N 448.545 2.484 10 20 IECD Cc1c(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cccc1-n1cnnn1 916670631 ZIQIXLDFXRCQTD-UHFFFAOYSA-N 425.468 2.393 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)CC1 917020537 RMZUOARKEJZWPQ-UHFFFAOYSA-N 430.593 2.060 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)CC2)cc1 917823781 LLOJRSQNERECLL-UHFFFAOYSA-N 435.521 2.437 10 20 IECD O=C(Cc1cc2ccccc2nc1O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338109 SRKMMNGJSXYCPZ-UHFFFAOYSA-N 425.510 2.034 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(O)nc(S)nc4c3)cc2)C1 918370886 CRELSRMBXKYGRY-HNNXBMFYSA-N 437.525 2.256 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 1321049824 BSXBTCOTHOQXCJ-UHFFFAOYSA-N 444.557 2.047 10 20 IECD CN1CCN(Cc2cccc(CNC(=O)NCc3ccc(N4CCOCC4)cc3)c2)CC1 1326130526 RFQRQHBCBDFOQQ-UHFFFAOYSA-N 437.588 2.270 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)C1CCCCC1 1786338261 VRCSDCZKBYNEAU-RLTIEFLZSA-N 444.528 2.377 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H]2CCCO2)C3)cc1 1799622572 SLVZHPTVFPNHBI-MQFRRQCYSA-N 437.540 2.476 10 20 IECD CN(C)c1c(F)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1F 1800807288 VTBGDCMYCKVMBB-QDMKHBRRSA-N 446.454 2.403 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465170 RAQKHBKXNJLOGK-YNFBMLRVSA-N 449.486 2.238 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H]2CCNC(=O)C2)C3)cc1 1845399425 XUUCDLDUQZHTMQ-FQEVSTJZSA-N 434.540 2.437 10 20 IECD COc1cc(OC)c(OC)cc1CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387167 VJBCMTNDRDKHQL-UHFFFAOYSA-N 443.544 2.297 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 543916795 IAKTVRBTENTPAR-UHFFFAOYSA-N 446.529 2.204 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](N(C)C(=O)OC(C)(C)C)C3)nc12 725812012 JAJTYYDFQPNIHX-OAHLLOKOSA-N 433.509 2.443 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1F 731409487 TYUDJJMXONRLBU-UHFFFAOYSA-N 435.521 2.471 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn4nccc4c3=O)c2C)c1 732864102 IIGHKPYGXDKEGJ-UHFFFAOYSA-N 433.468 2.341 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(CC(F)(F)C(F)F)CC2)c1 738234750 STWWAFRPTDZOAY-UHFFFAOYSA-N 447.473 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)CC2)cc1 741803924 KEEORWDTDAQGTF-SFHVURJKSA-N 432.565 2.285 10 20 IECD Cc1noc(-c2ccccc2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 742051355 SOACAQDWFLKDIV-UHFFFAOYSA-N 426.498 2.210 10 20 IECD CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742567237 WDMRJEWQHGJNAM-MRXNPFEDSA-N 438.532 2.093 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2C=CS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742750400 MXTRIWUKCTWDDJ-MAUKXSAKSA-N 437.562 2.383 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCNc3ccccc3[N+](=O)[O-])CC2)cc1 742921231 RMRMWFRIQPHBTC-UHFFFAOYSA-N 427.505 2.344 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 742952266 JFHLOHCHFHVTCI-QFIPXVFZSA-N 426.448 2.084 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1 743889706 SWMUCHSIKGYEDG-UHFFFAOYSA-N 435.528 2.441 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 751306270 QMKUXZFJCNIELT-UHFFFAOYSA-N 447.532 2.375 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-c4n[nH]c(C)n4)cc3)CC2)cc1F 754211628 IWCOLRLPFQVKFW-UHFFFAOYSA-N 438.463 2.215 10 20 IECD COc1cc(N2CCN(CC(=O)NCCc3ccc(F)cc3)CC2)cc(OC)c1OC 759879447 VTNWHPWAMASRFR-UHFFFAOYSA-N 431.508 2.332 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](NC(=O)NC2CC2)C1 760897236 OSHAETLRCRESNP-YOEHRIQHSA-N 446.507 2.325 10 20 IECD C[C@@]1(O)CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 767154571 GQBYMSFHELJWPX-LJQANCHMSA-N 435.458 2.088 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cnc2ccc(Br)cc2c1=O 773751245 OBEXSUMGGQKJEV-NSHDSACASA-N 432.274 2.318 10 20 IECD COc1ccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N(C)C)cc1OC 774857464 FOYWVFCSQWPHOF-JXFKEZNVSA-N 442.560 2.366 10 20 IECD C[C@@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCSCC1 774991894 NLMHBWCGTUQVLH-AWEZNQCLSA-N 438.505 2.381 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@](O)(c4ccc(F)cc4)C3)CC2)cc1 776899782 KLMGNQMYKVCLKW-XMMPIXPASA-N 442.535 2.259 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)cc1F 777919286 HKTTWRFBGDZOGO-UHFFFAOYSA-N 438.437 2.235 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 778391268 VEJACWWUYNFDAX-LJBSYDGDSA-N 445.585 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3([C@@H](C)CCO)CCC3)CC2)cc1 778419539 LTFYCDZIUJOQPJ-QWUACUGRSA-N 429.561 2.205 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779221550 JTWSGPOEUWEKFG-QZNHQXDQSA-N 446.636 2.195 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 782467260 LMIWOCJQIAIZQL-UHFFFAOYSA-N 426.441 2.271 10 20 IECD O=C(NCCN1CCCOCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 782927193 BDRQAYQHUJSQNW-UHFFFAOYSA-N 430.471 2.064 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1F 784768408 XIPYMMKDPVXWDS-OAHLLOKOSA-N 448.882 2.003 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(OC)c(OC)c1OC 787298886 OKVYCVCGIYHINR-UHFFFAOYSA-N 429.517 2.443 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](c2ccsc2)O1 789813318 SXIPRUYFHCZKIN-QRWLVFNGSA-N 447.532 2.329 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOCC4(CCCC4)C3)cc2F)C[C@@H](C)O1 789827455 SULSSCVUMRFWKQ-QZTJIDSGSA-N 447.551 2.475 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@H]1CCc2ccccc2C1 789841465 YWGZEVCAAQBHEV-KRWDZBQOSA-N 439.531 2.324 10 20 IECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 789971189 VIAYAQSIIOANSC-AEFFLSMTSA-N 433.549 2.446 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCCC1 790191935 XXQLOHAQSXFCEI-IRXDYDNUSA-N 438.519 2.221 10 20 IECD O=C(c1cccc(O)c1O)N1CCN(S(=O)(=O)c2cccc(Br)c2)CC1 790472722 PWAUYHZLRINSNB-UHFFFAOYSA-N 441.303 2.007 10 20 IECD CCS(=O)(=O)c1ccc([C@@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 792948915 MUYRMHRWUWPDNF-GOSISDBHSA-N 445.585 2.488 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)Cc3ccsc3)cc2F)CC1 793793366 UCAMTISZZWCGGM-INIZCTEOSA-N 432.565 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]3C)CC2)cc1 795126057 YHMUFCBPVBQCED-OALUTQOASA-N 430.593 2.311 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)c(O)c1 797388800 AECDBDAEFJQNIV-UHFFFAOYSA-N 432.498 2.372 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)c(O)c1 797389123 QFQSHAXBIYPROS-UHFFFAOYSA-N 449.529 2.041 10 20 IECD CS(=O)(=O)N1CCN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1 798208597 RLVDDAGHIAXYDU-LJQANCHMSA-N 441.513 2.311 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)cc1F 803663674 WPAOTNAFAMDHKN-UHFFFAOYSA-N 436.528 2.460 10 20 IECD CC[C@@H](NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 803747375 PKDUYQBTONMXBV-JOCHJYFZSA-N 430.593 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@@H]3C[C@@H](C)O)CC2)cc1 804449357 YYRVCTVVWJPPOB-FIUOBNDQSA-N 429.561 2.442 10 20 IECD COc1ccc(CN2CC[C@H](NCc3ccc(N4CCN(C)CC4)cc3)C2=O)c(OC)c1 808423485 DCDFFSHLUOCKQA-QHCPKHFHSA-N 438.572 2.346 10 20 IECD CCn1c(O)nc2cc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2c1=O 919969985 MYCSFMBMZYHWCK-UHFFFAOYSA-N 436.512 2.261 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921025223 IZOOHFZQTQBVTO-UHFFFAOYSA-N 434.587 2.282 10 20 IECD CCOc1ccc(N2CCN(C(=O)Cc3c(C)nc(-c4ncccn4)nc3O)CC2)cc1 1319546079 XOTDUMVPCSYFBF-UHFFFAOYSA-N 434.500 2.238 10 20 IECD CC(C)NC(=O)c1cnn2c1C[C@@H](CNCc1ccc(N3CCN(C)CC3)c(F)c1)CC2 1320604241 XDWSBFDAIKOJMF-IBGZPJMESA-N 442.583 2.264 10 20 IECD Cc1cc(C(=O)CN2CC[C@](CO)(C(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1323917087 MUDMGCWNKFAROW-QFIPXVFZSA-N 433.574 2.265 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCCC(=O)OC(C)(C)C)CC2)cc1 1339093028 OPLZLOSBNLXHBD-SEYXRHQNSA-N 445.560 2.480 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@H]1C[C@H]1C1CC1 1783946172 YFXHLQKXLULPAC-RWBKLUSOSA-N 434.920 2.391 10 20 IECD O=C(CC(F)(F)F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786691141 MVXDCRROCOMOIY-CHIMOYNISA-N 436.814 2.297 10 20 IECD Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)n1 1790242180 SADBRPNKWXPIIY-RFUYNDQBSA-N 445.903 2.362 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2)CC1 1826701570 ANUDMGMAYGSKDY-IBGZPJMESA-N 430.549 2.212 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc3cccnc3[nH]2)C1 1844085085 YQJZPSZRJRVRHT-UHFFFAOYSA-N 442.479 2.173 10 20 IECD O=C(c1nc(O)n2c1CCCC2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501613 HVYVPMFLOAABTH-UHFFFAOYSA-N 446.891 2.120 10 20 IECD CC(C)c1nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)co1 1847033870 MLGFMOJCERCFHV-FNORWQNLSA-N 427.457 2.445 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(-n2cncn2)nc1 195683266 XZEATHGNEVMGMK-UHFFFAOYSA-N 432.406 2.448 10 20 IECD O=C(NCCCSc1nccs1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 733971947 GXOBYXWCUIRITO-UHFFFAOYSA-N 427.573 2.076 10 20 IECD CN(C)S(=O)(=O)c1ccsc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736196038 LUAPLCHZOIWTIB-UHFFFAOYSA-N 437.587 2.137 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@@H]4CCCO4)CC3)cc2)C1 751783875 XJATVPHBPIZQRZ-UGKGYDQZSA-N 444.576 2.258 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc(OC)c1OC 759281661 HXVREMFKYBOABN-CQSZACIVSA-N 446.470 2.181 10 20 IECD CN(C)CCNC(=O)c1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761184801 VLUPKGSVEDZEDW-UHFFFAOYSA-N 444.919 2.301 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 765102057 YZKFEKFDSWPBRB-VXGBXAGGSA-N 443.522 2.161 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1CC(=O)O 774602690 BLHBNXUEAQUHBU-UHFFFAOYSA-N 448.906 2.148 10 20 IECD C[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(N2CCOCC2)cc1 775255012 MUSCLYPUKDJVMU-MRXNPFEDSA-N 428.558 2.390 10 20 IECD CN(C)c1nccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 775727215 MQCYASGMQRUCLP-UHFFFAOYSA-N 438.454 2.397 10 20 IECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1F 776044186 ZPMPJSRSOWNESA-OXQOHEQNSA-N 427.542 2.207 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cc(F)cc4c3OCOC4)cc2)CC1 786258705 GKWMTLHDKZROBG-UHFFFAOYSA-N 427.476 2.220 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(OCC(F)(F)F)nc1 787277318 DBKMWECYNVGALB-UHFFFAOYSA-N 434.418 2.332 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 787705012 IPGANHSQYHTDHA-HSALFYBXSA-N 430.593 2.185 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(N3CCN(C(C)C)CC3)CC2)cc1 788953285 AJBJUXOGTHLMBK-UHFFFAOYSA-N 443.636 2.166 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H](c2ccsc2)O1 789813317 SXIPRUYFHCZKIN-MGPUTAFESA-N 447.532 2.329 10 20 IECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccco1 789824827 KBXYJOJMEWMNOR-DAYGRLMNSA-N 433.480 2.152 10 20 IECD Cc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 793717351 FTUFBJLEFJLTGL-DOTOQJQBSA-N 428.558 2.252 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)n3cccn3)c2)c(O)c1 797390831 VDLKCOZSDIJICF-CQSZACIVSA-N 437.456 2.052 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3cc4c(cc3[N+](=O)[O-])n(C)c(=O)n4C)cc2)CC1 804644312 HGROQDLMDHISSO-UHFFFAOYSA-N 438.488 2.066 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccncc1 805740619 XXAANGYJNFHZJC-HSZRJFAPSA-N 435.572 2.497 10 20 IECD O=C(CN1CCC[C@H](c2nc(O)n[nH]2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808777192 GGBLJJJUICHTDY-ZDUSSCGKSA-N 431.452 2.104 10 20 IECD COCCOCc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 812478133 DLVIXJWFONKHMS-OAQYLSRUSA-N 425.529 2.481 10 20 IECD COc1ccc(NC(=O)N(C)Cc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 916668716 IUMAOAUGHMFYOX-UHFFFAOYSA-N 435.502 2.086 10 20 IECD CC(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917708020 DUECOLKNFXMAQE-UHFFFAOYSA-N 435.521 2.279 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 918284305 ADCWTLKFGRAYOW-UHFFFAOYSA-N 436.827 2.479 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CNC(=O)O2)C3)cc1 1800511702 DTNGKAMNKXBWLY-NRDMVMEKSA-N 436.512 2.454 10 20 IECD Cc1cnn([C@@H](C)C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1822744560 PIYSZRDTLDOTMP-XJKSGUPXSA-N 439.476 2.288 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)C2CC(O)C2)CC1 1824117973 WIGYFDVFNPNOGJ-KUTQSGRNSA-N 444.528 2.207 10 20 IECD CCOc1cnc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1842201487 XDCCNFMJBKBPOJ-UHFFFAOYSA-N 432.864 2.071 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)Cn2ccncc2=O)C3)cc1 1845399301 MNVVSVLJCSXJIW-UHFFFAOYSA-N 445.523 2.168 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 10619776 VWHIVSNTPMAMFM-MRXNPFEDSA-N 433.482 2.041 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc1 726616485 MWCNWSLRLYIYLN-VQTJNVASSA-N 445.608 2.296 10 20 IECD CC1CCC(NS(=O)(=O)CC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 726871327 MLJKZOTZPFNLKU-UHFFFAOYSA-N 425.620 2.354 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1OC 731855898 FRRUSTHULGOYMR-QGZVFWFLSA-N 434.514 2.130 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)C(C)(C)C)cc2F)C[C@H](C)O1 733342302 JAYULIVCXVZSBP-GJZGRUSLSA-N 429.558 2.452 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3n[nH]cc3Br)cc2F)CC1 738478070 VXJMTTTTYUINJK-UHFFFAOYSA-N 439.333 2.453 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O 743893479 WWYQVNBDRLPQKD-UHFFFAOYSA-N 440.905 2.066 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN(C(=O)c4ccncc4)C3)CC2)cc1F 753737181 BOSGQUVFVXXFDA-GOSISDBHSA-N 426.492 2.430 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4cc(C)c([N+](=O)[O-])cc43)CC2)cc1 754109837 OYQLIUFCLYXAMB-HXUWFJFHSA-N 426.517 2.457 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](C)N3CCc4ccccc4C3)CC2)cc1 758209131 IAVXXPSPMXEEBA-PXDATVDWSA-N 438.616 2.215 10 20 IECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)c1 760804145 BZDCGCLBIVSXOK-UHFFFAOYSA-N 439.495 2.017 10 20 IECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1F 761116320 AAIBFPSOHLOLOU-UZLBHIALSA-N 440.475 2.329 10 20 IECD COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)n[nH]2)cc1 764940736 UUKKZLYIDUHCOE-UHFFFAOYSA-N 440.525 2.250 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(F)c1 765932108 VCTLMZQRRNJRFW-UHFFFAOYSA-N 425.210 2.335 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1C 766318532 JUYIWQREXFLWQB-UHFFFAOYSA-N 429.476 2.480 10 20 IECD CCn1cc([C@@H](O)CN(Cc2ccccc2)C(=O)C(=O)NCc2ccc(N(C)C)cc2)cn1 785432329 ANYBJPIDXSSEAI-QHCPKHFHSA-N 449.555 2.348 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCC[C@@H]3O)cc2F)C[C@@H](C)O1 789823013 CCVBKHYROYUHSV-RDBAUFEQSA-N 435.540 2.065 10 20 IECD CCc1cnc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 789832570 ATVFKBBLSSDPPG-UHFFFAOYSA-N 434.537 2.081 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCCO1 789832689 CGXMFCMPEQNUHH-HXUWFJFHSA-N 435.540 2.115 10 20 IECD Cc1cc(F)ccc1CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793715816 AXZYQJVLANTEFP-LJQANCHMSA-N 440.519 2.111 10 20 IECD CC(C)[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793829989 PJEVESWFIQKGDN-QGZVFWFLSA-N 442.539 2.061 10 20 IECD COc1ccc(CNC(=O)CCCn2cnc3cc(OC)c(OC)cc3c2=O)c(O)c1 794377507 JJICQRZHSDDHSD-UHFFFAOYSA-N 427.457 2.225 10 20 IECD C[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)NCCF 800183752 HPYUEDVUQQBJQQ-KBICQTFXSA-N 429.564 2.320 10 20 IECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)O2 803301890 BJTTWMBDAIGRNL-CGLLJXKSSA-N 445.560 2.138 10 20 IECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803685761 KBSFFYXQSUPFHC-LJQANCHMSA-N 436.556 2.337 10 20 IECD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@H]1CCCOC1 804286910 PXKVFHIMHUTBOW-HNNXBMFYSA-N 435.458 2.352 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 805734670 VWMVJVGJUJOJFT-QGZVFWFLSA-N 448.564 2.011 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 807195572 HTIJDJLBJLDDRY-BMFZPTHFSA-N 425.323 2.433 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)sc1C(C)=O 815471020 SHEGHHISRLRTNI-SECBINFHSA-N 435.458 2.053 10 20 IECD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 815715637 OJSBCMJSOCIDOE-OLMNPRSZSA-N 433.455 2.324 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 920252023 FRPPMIJVUSXWOO-LEQVUBRHSA-N 448.567 2.291 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21 921304809 XDWCFMHBRKIGMA-SVFBPWRDSA-N 432.590 2.207 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)C3CC4(CCC4)C3)C2)C1 1784847801 XHTGOCYNDXEZKC-JURIHQFCSA-N 442.512 2.227 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1804212168 DNNOQBTTWJMAKZ-JYYAWHABSA-N 437.924 2.308 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccc2ccnn12 1804289388 GIVBBFQPRBHPRU-ZBTRPWJCSA-N 448.479 2.416 10 20 IECD Cc1ccoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818174316 JQQMYMCMXDSTJJ-CYBMUJFWSA-N 447.542 2.477 10 20 IECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827426818 ILHPUWSPUCHRLC-SFHVURJKSA-N 427.505 2.082 10 20 IECD O=C(CC(F)(F)F)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837788080 AMHUZFHJYCDZAI-UHFFFAOYSA-N 431.411 2.057 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)C3CCCC3)C2)C1 1839431783 MVLGRLBZNIAPJO-NRFANRHFSA-N 438.908 2.011 10 20 IECD Cc1cnc2c(C(=O)N3CC4(CCCN4C(=O)c4cc(O)c(O)c(Cl)c4)C3)cnn2c1 1845501381 JNABCEALBXXVSB-UHFFFAOYSA-N 441.875 2.233 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H]3CCNC(=O)C3)C2)cc1 1846424075 NXOYFJPBLJVEOF-FQEVSTJZSA-N 434.540 2.437 10 20 IECD CS(=O)(=O)c1nc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccccn12 731858348 KNQGZDMTVNSLRN-INIZCTEOSA-N 429.498 2.265 10 20 IECD Cc1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737246073 SIMZWHHHLONKLF-UHFFFAOYSA-N 435.933 2.138 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCN3C(=O)CCc4ccccc43)nc12 738871525 SGIDNQBORNSPFM-UHFFFAOYSA-N 438.440 2.024 10 20 IECD CC(=O)N1CCc2cc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc21 738887746 KQBOAVZRIJNZLA-UHFFFAOYSA-N 442.541 2.152 10 20 IECD COc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1NC(C)=O 738900201 SDLYEIFLLGCZRV-UHFFFAOYSA-N 446.529 2.210 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 741097755 XWAOPJAIYMKDHO-UHFFFAOYSA-N 429.484 2.306 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCn1ccc([N+](=O)[O-])n1)c2[N+](=O)[O-] 748103106 OILUYMRFXHGEEX-UHFFFAOYSA-N 436.336 2.332 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)N3CCN(c4ccccc4O)CC3)CC2)cc1F 753856680 JBRHEZFVYLKJHR-GOSISDBHSA-N 442.535 2.399 10 20 IECD O=S(=O)(Nc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccc2nonc12 753923446 JAJILAKGZVOXMI-UHFFFAOYSA-N 427.486 2.311 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCN(c2ncccc2F)C1 755306456 CVCAHPPSFNOFSQ-INIZCTEOSA-N 431.487 2.399 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cccc4c3OCO4)CC2)cc(OC)c1OC 759217138 WVJIJNVJKMXOPK-UHFFFAOYSA-N 429.473 2.473 10 20 IECD CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc21 760145585 MQIHXJUOJUUXSL-RUZDIDTESA-N 437.540 2.215 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 760537005 LNJLLHYMWOVBQH-UHFFFAOYSA-N 444.575 2.261 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]3C)nc12 772328925 YYODKKFMKDCSGC-KBPBESRZSA-N 433.509 2.441 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1nc2ccccc2s1 774981988 PMNJVIZOUBBQAS-UHFFFAOYSA-N 428.489 2.205 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 775075724 QJHAEUKGQGXVRK-QHCPKHFHSA-N 430.508 2.440 10 20 IECD CCn1cc(-c2nn(C)cc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 778936295 DEAZJNIGEDFGKX-UHFFFAOYSA-N 426.496 2.334 10 20 IECD COc1ccccc1[C@H](CO)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 782064304 RTXIVICGYPTDPX-FIKGOQFSSA-N 445.535 2.387 10 20 IECD Cc1nc(Cn2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn2)no1 783854267 YCIBIBYTXSELBK-ZDUSSCGKSA-N 433.419 2.018 10 20 IECD NC(=O)c1ccc(F)c(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784765205 NXVWQEMVAAXDHW-HNNXBMFYSA-N 448.882 2.003 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc1 785527338 KACXBRXYJAURJN-SLFFLAALSA-N 430.593 2.264 10 20 IECD CC(C)NC(=O)c1cnn2c1C[C@@H](CNCc1ccc(N3CCOCC3)c(F)c1)CC2 785562627 HPRIWCQBLFIBRQ-SFHVURJKSA-N 429.540 2.349 10 20 IECD CN(CCOc1cccc(Cl)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797663 CHXVZNVXMVDIAC-UHFFFAOYSA-N 449.910 2.469 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccccc1-n1ccnc1 789843570 ABXIOXJPVNFONR-UHFFFAOYSA-N 435.553 2.358 10 20 IECD Cn1ncnc1-c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 790517246 GEYJFJYQEHDSGM-UHFFFAOYSA-N 425.464 2.153 10 20 IECD Cc1ccccc1[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793730694 CFOSYMFXVUTIFG-SFTDATJTSA-N 448.567 2.329 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C(F)F)cc3)cc2)C1 793733610 NAGUTCQSGMDBJB-GOSISDBHSA-N 444.482 2.259 10 20 IECD O=C(COC(=O)c1ccnn1-c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 795761650 NMPXFGOCEREUQU-UHFFFAOYSA-N 438.459 2.321 10 20 IECD CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n1 803688377 YDYDJORUHAAGOT-INIZCTEOSA-N 443.548 2.460 10 20 IECD COCCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 806626609 BGNDDBVPQLDWQS-UHFFFAOYSA-N 444.507 2.485 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O 808199433 VNBXUFGEHLZOOR-JOCHJYFZSA-N 449.555 2.342 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3ccc(C)c(C(N)=O)c3)n2)o1 914791929 XLQQDZDXVPHXDW-UHFFFAOYSA-N 434.499 2.247 10 20 IECD COc1cc(OC)cc(C(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)c1 917385608 DVFCWJDOXDXVLK-UHFFFAOYSA-N 429.542 2.303 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918297919 UYFYSIIDWAMWED-OAQYLSRUSA-N 441.528 2.479 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cc(S(N)(=O)=O)cn3C)c2C)c1 918918867 ONTHHLCANOSWJL-UHFFFAOYSA-N 429.498 2.428 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1C(=O)c1ccccc1 1338289402 WWMYABYTDMGTSN-RBUKOAKNSA-N 440.496 2.383 10 20 IECD CCOC(=O)C1=C(C)C(C(=O)Nc2ccccc2)=S=C1NC(=O)c1ccnc2ccnn12 1350869619 GITOHEXDSZBNNP-UHFFFAOYSA-N 449.492 2.027 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1778341610 ZZCPZEUEVJJYMD-YIGJPRQDSA-N 438.528 2.045 10 20 IECD CC(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n[nH]1 1782007098 JJXDBZZQKWWTTG-OAQYLSRUSA-N 448.907 2.355 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cccc(F)c1Cl 1790091122 FCUJRXGSKNHYIY-PJODQICGSA-N 449.866 2.192 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc[nH]n2)C3)cc1 1799620060 MZULOBUJOPFTJE-HATOLVCRSA-N 433.512 2.334 10 20 IECD Cc1nccn1[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822879132 DQVGOOLYNKJNNM-BLLLJJGKSA-N 439.476 2.288 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1828767154 IOTAFTYUZWMGKE-WIYYLYMNSA-N 447.532 2.314 10 20 IECD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1841345393 FHHDZTFCPLNTDW-OLZOCXBDSA-N 436.892 2.158 10 20 IECD O=C(c1cc(Br)cs1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249982 XUOLIZHXGPMNHS-UHFFFAOYSA-N 438.303 2.448 10 20 IECD COc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)c1 729227849 ZNPBXAREOKQWLE-UHFFFAOYSA-N 429.496 2.098 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc(N4CCNC4=O)ccc3F)c2)CC1 739765219 FRCXVZGEXTXRAQ-UHFFFAOYSA-N 425.464 2.309 10 20 IECD Cc1c(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccccn1 742284669 VXPPKKWHHSUUIO-MRXNPFEDSA-N 427.530 2.452 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 749340194 KOLPLDIXUFJALN-IBGZPJMESA-N 445.585 2.476 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC([C@H]4CCOC4)CC3)CC2)cc1 752998214 ALNGDSNLMVTYBC-YJJPMGAVSA-N 427.545 2.175 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCCN1S(C)(=O)=O 753697616 OPGIFBMRHBTVMW-CQSZACIVSA-N 434.356 2.110 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 756570915 CEOSRBLVMSFDHJ-SFHVURJKSA-N 436.599 2.182 10 20 IECD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 758560452 LJHMMKUJUKVRSA-AWEZNQCLSA-N 448.497 2.456 10 20 IECD O=C(Nc1cnn(CC(F)F)c1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 762441553 NEIXUSWRBULTKI-UHFFFAOYSA-N 443.401 2.473 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)cs1 769335938 WJBHHMWISPSUIL-UHFFFAOYSA-N 432.911 2.225 10 20 IECD CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2NC1=O 769932480 UPKSUOOQTDTCRP-GTNSWQLSSA-N 433.486 2.364 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1OC 773768910 NDXLVFSSSCXTNF-CQSZACIVSA-N 436.530 2.498 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1I 774362463 AATBCYYVUGOKIL-UHFFFAOYSA-N 440.237 2.308 10 20 IECD COc1ccc([C@@H](CCO)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 774848989 VMUWVORTAQTRSO-OAQYLSRUSA-N 431.508 2.000 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCOCC4)O3)cc2F)C[C@@H](C)O1 776897163 SSUNPCWXJXFPAZ-JFIYKMOQSA-N 437.512 2.161 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](c4ccc(F)cc4)C3)CC2)cc1 779219103 HVYOBJWYBMHCHK-LADGPHEKSA-N 429.536 2.391 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C)c(NS(C)(=O)=O)c3)c2)CC1 781271767 QOBDZMJQEUYSRH-UHFFFAOYSA-N 430.530 2.287 10 20 IECD C[C@H](OC(=O)c1cccc(C(N)=O)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781725260 ZUXIVMCRYCQZRW-LBPRGKRZSA-N 443.415 2.140 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 784598414 OCPMQPJNEVIXKC-KDURUIRLSA-N 449.567 2.185 10 20 IECD COc1ccccc1[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nccn1C 785648236 YTFUBNKJNMDSFA-QFIPXVFZSA-N 447.539 2.333 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1ccc(C2CCC2)cc1 787495215 GKFKHBSICXQMNG-UHFFFAOYSA-N 441.553 2.444 10 20 IECD CCOC(=O)c1nc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c[nH]1 788176001 OBNABXNAGGHFKV-UHFFFAOYSA-N 436.471 2.407 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1 788288480 OWWLRTSWUJCORX-UHFFFAOYSA-N 432.565 2.441 10 20 IECD CCCc1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 789383301 VWQIFMFWKBHDQR-OAHLLOKOSA-N 429.546 2.052 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@H]1CN1CCCCC1 789855708 WXVUFYDASFFXBA-OAQYLSRUSA-N 430.618 2.333 10 20 IECD CS(=O)(=O)CC[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 789900444 QKMJAHOWVBNJLA-LJQANCHMSA-N 434.533 2.497 10 20 IECD COc1ccc(CNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c(O)c1 794378538 XYACBGZJHLDSOY-JTQLQIEISA-N 433.258 2.464 10 20 IECD CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccc(N(C)C)cc2C(F)(F)F)NC(=S)N1 794779311 FZQJLFPZVQGPPE-MRXNPFEDSA-N 428.480 2.423 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 795610994 QHJUDTRZHRVXCX-UHFFFAOYSA-N 440.484 2.318 10 20 IECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803299505 LRMVLPBGNICWCB-KKSFZXQISA-N 425.533 2.106 10 20 IECD CCc1ccc([C@@H](O)CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 804149364 LRIJPALSFSZDEN-FRHQNKJESA-N 437.540 2.312 10 20 IECD Cc1nc2n(n1)C[C@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CC2 804361964 NKSMBWLMQQGJFA-WMLDXEAASA-N 444.967 2.224 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768136 CWWDKPPWKOLUJU-WCQYABFASA-N 439.488 2.410 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)c1 810162007 WWFOGVLUAKZFQB-UHFFFAOYSA-N 433.599 2.451 10 20 IECD CCOC(=O)c1ccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nc1 814805118 SAWVZQDSBMXAIW-UHFFFAOYSA-N 426.517 2.209 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H]3CS[C@H](Cc4ccccc4F)C(=O)N3)CC2)cc1 889063363 SFDHEYMIOOJKGM-NHCUHLMSSA-N 443.544 2.326 10 20 IECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 918078680 ABUUUCKRXOAOLU-KRWDZBQOSA-N 448.317 2.360 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)cc2F)C[C@H](C)O1 918141064 RWCJQHSKRVWYEP-GJZGRUSLSA-N 444.463 2.394 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC(=O)Nc3ccc(Cl)cc3)cc2)C1 919782695 BXYYPOHETCCSRZ-INIZCTEOSA-N 443.935 2.480 10 20 IECD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1cccc1 1784332554 WPRBXASPEUOWCJ-SZNDQCEHSA-N 433.892 2.257 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc2ccccc12)c1cc(O)nc(O)c1 1797426391 NRYPGNAUKBBSTR-QDMKHBRRSA-N 434.452 2.312 10 20 IECD Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1804659775 POZBPAWXWOUDHN-FDDCHVKYSA-N 447.495 2.154 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCCn2cccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997805 DRFAYHJDWHWDRN-JPYJTQIMSA-N 449.511 2.489 10 20 IECD C[C@H](Nc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547450 XTXXMOUQBGBNGU-INIZCTEOSA-N 439.516 2.233 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cccc(F)n1 1810754420 QWGQZRGFWTXDRF-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1 1814162234 HOZPJANXSYCKOC-JUALTMEFSA-N 433.411 2.183 10 20 IECD CCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816604992 JCRWJPWDTSHVMS-AWEZNQCLSA-N 426.433 2.386 10 20 IECD COc1cccc2c1C[C@@H](C(=O)N1CCCC13CN(C(=O)c1cc(O)nc(O)c1)C3)CC2 1845925822 ZMWWVLWZKWRMPZ-INIZCTEOSA-N 437.496 2.124 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cccc(-c4nnnn4C4CC4)c3)CC2)cc1 105777654 RLTHZLOHYPRICC-UHFFFAOYSA-N 433.516 2.444 10 20 IECD O=C1CN(C(=O)Cc2occc2C(=O)N2CC(=O)Nc3ccccc32)c2ccccc2N1 497772569 IZWVMAZUDGBIJK-UHFFFAOYSA-N 430.420 2.406 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](NS(C)(=O)=O)C3)c2C)cc1 725796321 SEXBDFWWWNXMKO-GOSISDBHSA-N 447.557 2.077 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@](C)(C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 725798755 ARJCDZLQLCDUNG-OJLQRUNKSA-N 442.535 2.046 10 20 IECD COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3ccc(-n4cnnn4)cc3)n2)cc1 727246681 OVFBQPDIVPLASO-UHFFFAOYSA-N 442.482 2.373 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)cc1 731964090 IWUSZZIPMHRTHK-JOCHJYFZSA-N 430.593 2.205 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c1 743911261 XSTDRDIOYJBEEK-CQSZACIVSA-N 445.903 2.279 10 20 IECD Cc1cc(C(=O)COC(=O)c2cn(CC(N)=O)nn2)c(C)n1-c1ccc(F)c(Cl)c1 745467458 IDKSZEPYKUDEJQ-UHFFFAOYSA-N 433.827 2.003 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 747247183 GFJWMYNTFZBLDD-UHFFFAOYSA-N 426.441 2.067 10 20 IECD COC(=O)c1ccc(Br)c(S(=O)(=O)NCc2cccc(OC)c2O)c1 751306694 UROYWUQLQDGRCZ-UHFFFAOYSA-N 430.276 2.428 10 20 IECD COc1ccc(N2CCN(CC(=O)NCC(=O)N[C@@H](C)c3ccc(F)cc3)CC2)cc1F 753856950 KECKPKPKGBKDCR-INIZCTEOSA-N 446.498 2.089 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)NC(=O)CO4)c2)CC1 768018500 XXKZPURTKQEDFA-UHFFFAOYSA-N 430.530 2.349 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)c1O 774885641 CZRXBFPNIYWGFC-UHFFFAOYSA-N 441.428 2.097 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)CCc3ccco3)cc2F)CC1 775219784 MDSDSHASFNNHJI-KRWDZBQOSA-N 430.524 2.314 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccnc3-n3ccnc3C)CC2)cc1 778241651 CVRJNJRPDDEFFR-MDZDMXLPSA-N 446.511 2.428 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1C(=O)O 780407553 KZKZHAVDAPERMO-UHFFFAOYSA-N 447.513 2.253 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1C(N)=O 784765988 FPJQKLIBJOEWBK-QGZVFWFLSA-N 444.919 2.172 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)cc1 785433696 OLNDFGKTJRFOBS-UHFFFAOYSA-N 442.947 2.397 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1 785442426 KQBUKBLMHJNSOB-QHCPKHFHSA-N 430.549 2.228 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 787709651 YKOXDRUZAHZYPO-OALUTQOASA-N 430.593 2.264 10 20 IECD O=C(NCCN(CCC(F)(F)F)C(=O)c1cccc(O)c1O)c1cccc(O)c1O 790980080 CTKNRHYOTXTNGK-UHFFFAOYSA-N 428.363 2.334 10 20 IECD CC[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734335 SCTQNNQCEHRVLY-FPOVZHCZSA-N 437.544 2.009 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1 798316911 NOAXUPKYUWQQKV-UHFFFAOYSA-N 433.574 2.418 10 20 IECD CO[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771392 LNPFAZBULXYCNI-DMZKTXOQSA-N 447.447 2.453 10 20 IECD COCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309776 BRZYDGYPUKSMDX-XLIONFOSSA-N 429.517 2.496 10 20 IECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCN1C(=O)OC(C)(C)C 803664350 LDEHUZHXELKTLG-ZBFHGGJFSA-N 436.528 2.412 10 20 IECD COc1ccc(OC)c(CCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 803685509 COKJDHLDWXOJQR-UHFFFAOYSA-N 425.529 2.451 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCc4ccccc4[C@@H]3C)CC2)cc1 803752075 XVJORHGWIGHASR-IBGZPJMESA-N 436.556 2.079 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3nc(C4CC4)cs3)cc2F)CC1 805007393 KGXAFOKOIJPJGT-UHFFFAOYSA-N 445.564 2.234 10 20 IECD CC(C)(C)OC(=O)NC[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807289404 TZLNCCNFOCKKEH-XMMPIXPASA-N 442.560 2.442 10 20 IECD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290798 OTQRQAPHVNJAEQ-SFHVURJKSA-N 430.512 2.479 10 20 IECD Cc1nnnn1-c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)ccc1F 807513414 NGOAIXNLGLWUKJ-UHFFFAOYSA-N 439.234 2.377 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCOCC1 807548035 OXKGDLHJNTYJME-GOEBONIOSA-N 425.476 2.304 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc(OC)c1OC 807652620 XOVALMDJIYTVIM-RCCFBDPRSA-N 445.560 2.446 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(OCC(F)F)c1 810368967 MSTOVBPOBDNXAT-UHFFFAOYSA-N 447.438 2.269 10 20 IECD CS(=O)(=O)C[C@@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 813621864 IFKQMZQNQPLREP-CQSZACIVSA-N 431.505 2.333 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1sccc1S(=O)(=O)N1CCOCC1 818515879 DNCCJLRVUXGHLQ-UHFFFAOYSA-N 437.587 2.497 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCN1CCN(c2ccccc2)CC1 916234605 OWUWCVJKDJIZCZ-UHFFFAOYSA-N 437.588 2.487 10 20 IECD CN1C(=O)c2ccc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)cc2C1=O 918293727 DWWCNATZPSCUGQ-UHFFFAOYSA-N 433.420 2.379 10 20 IECD C[C@H](NC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1)c1ccc(N2CCOCC2)cc1 920872847 YABZKZBDGYSJDR-INIZCTEOSA-N 437.500 2.458 10 20 IECD Cc1cc(Cl)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1 1787294624 WROVDXKQJFHNEK-KKXDTOCCSA-N 445.903 2.362 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cccc2ccoc12 1790465460 OBUZYLWSVGHGMV-WBAXXEDZSA-N 437.452 2.146 10 20 IECD O=C(CCc1ccccn1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804708233 UTHXITIDCPSRNF-GAJHUEQPSA-N 447.495 2.235 10 20 IECD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)o1 1823497613 XOWDULOOZMLEBG-CYBMUJFWSA-N 447.542 2.477 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)c2ncc[nH]2)CC1 1825637710 CQPVDDKUTMENNF-FQEVSTJZSA-N 448.527 2.436 10 20 IECD CN1CCC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1830182324 XGDZDOMCFCBVTC-PKOBYXMFSA-N 430.549 2.068 10 20 IECD Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1834988883 PDKGCLDKRDEITR-UHFFFAOYSA-N 438.528 2.300 10 20 IECD COc1ncc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1F 1842215487 WRNULHBMKQHLEG-UHFFFAOYSA-N 435.839 2.425 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(C(F)F)no2)C1 1843118570 VXFHZUJYYYUHKZ-HWKANZROSA-N 435.383 2.259 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 110259778 XQKNEVFEQFLUSJ-GOSISDBHSA-N 426.517 2.363 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)n(C)c2ccccc12 472791374 OPBLSYRIAQZECZ-UHFFFAOYSA-N 435.452 2.423 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C 729784790 AGDCLRIPKAPGFN-UHFFFAOYSA-N 436.512 2.029 10 20 IECD CCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)c1 730235459 ZJSRYDRNEMAXLV-UHFFFAOYSA-N 448.564 2.196 10 20 IECD COC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 734530194 DQAXSFGATDPBND-UHFFFAOYSA-N 445.491 2.338 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(N4CCOC4=O)ccc3F)cc2)C1 741544518 RYWINFSRZJONRW-INIZCTEOSA-N 440.475 2.414 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCN([C@H]2CCC[C@H]2O)CC1 745903150 DLEWEEGFHHSVOV-LSTHTHJFSA-N 438.519 2.497 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)C2CC2)cc1 746989739 CBVWVCISZQHLGH-UHFFFAOYSA-N 429.542 2.427 10 20 IECD CC1(O)CCC(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 749604941 KYNSYAULMFVAND-UHFFFAOYSA-N 442.539 2.435 10 20 IECD O=S(=O)(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn([C@@H]2CCOC2)c1 751999966 JVTJZAKEFGWVTQ-DLBZAZTESA-N 440.953 2.146 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1F 753796383 XMNUFZJSHJSQBE-CQSZACIVSA-N 436.509 2.075 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753866439 ODBLCCQGPIMADR-UHFFFAOYSA-N 444.463 2.091 10 20 IECD COc1ccc(N2CCN(CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1F 754011804 IEWFOBNOSSSPJP-UHFFFAOYSA-N 443.435 2.291 10 20 IECD CCCCN(C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 756335185 GCZZPINQDUSZAG-VQTJNVASSA-N 438.590 2.189 10 20 IECD COCCOc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccn1 759222951 ZKMWILKRPIVKBQ-UHFFFAOYSA-N 431.489 2.095 10 20 IECD COc1ncc(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1C(N)=O 762435517 ABJXERSWQUNXRF-UHFFFAOYSA-N 439.516 2.213 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1F 769650835 FEMJXYKKGGZLAP-NSHDSACASA-N 432.495 2.341 10 20 IECD Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773858553 QYOYZTINZCSEOA-KRWDZBQOSA-N 438.528 2.349 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)Cc1ccccc1 774926903 XUQRCMBJZQWHSO-QFIPXVFZSA-N 440.613 2.145 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1F 783332779 YYZCSJFTBMNKDN-UHFFFAOYSA-N 448.426 2.439 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1 784553039 BZKNTMSPEBHWGA-GOSISDBHSA-N 445.560 2.172 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c(C)c2)CC1 785293666 HRSFQXCBAOTSLD-QGZVFWFLSA-N 440.544 2.234 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccccc3OC(F)F)cc2)CC1 786121176 CJOONJAFNLINAI-UHFFFAOYSA-N 439.484 2.435 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)cc1F 787855996 NQRTVNUBMRLRIZ-UHFFFAOYSA-N 428.508 2.306 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)cc1 788976352 XGGMRNYOXLDSQB-WOJBJXKFSA-N 429.517 2.093 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nnn(CC4CCCC4)c3C)nc12 789186066 LEIRYWBRKHQIKC-UHFFFAOYSA-N 428.449 2.059 10 20 IECD Cc1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789821683 UNYOOVWXLRECTI-KBPBESRZSA-N 434.537 2.479 10 20 IECD COc1cccc(Cl)c1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837242 XIEFAYRFMACQMP-UHFFFAOYSA-N 449.910 2.381 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCCOc2ccccc21 789840451 INSHERRJIZGJEM-FQEVSTJZSA-N 441.503 2.433 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(CCNS(=O)(=O)CC)s1 790408688 GTOXKKQGEDSFIT-UHFFFAOYSA-N 434.561 2.135 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc([C@H]4CCCOC4)nn3C)CC2)cc1 790921926 NPCXLQBOJKOFBQ-INIZCTEOSA-N 441.532 2.046 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)CCOc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 803300278 RTLUEYWTJRZMQZ-QGZVFWFLSA-N 429.492 2.377 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](CCCO)c3ccccc3)CC2)cc1 804317578 IQTRBOPAQGDKJH-JOCHJYFZSA-N 425.529 2.410 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOC[C@H]1[C@H]1CCCO1 804395411 RRPZKGMAAPJHRN-DOTOQJQBSA-N 438.527 2.275 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 804968509 GRXUJMGJOWLHAB-BFYDXBDKSA-N 427.542 2.063 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCO[C@]4(CCOC4)C3)cc2Cl)C1 807954420 RDVRYAYYWBCONS-OPAMFIHVSA-N 435.952 2.210 10 20 IECD Cc1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nc(N2CCCC2)n1 813591041 RTFWYHOBNNSXPP-UHFFFAOYSA-N 442.539 2.485 10 20 IECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cc(OC)ccc3OC)cs2)cn1C 914688918 LZLTXPCCSVEIJV-UHFFFAOYSA-N 436.515 2.326 10 20 IECD Cc1cccc(C)c1NC(=O)CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917020706 LYBJLYDEYDVZAL-UHFFFAOYSA-N 442.535 2.466 10 20 IECD Cn1ccnc1C[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 1319781109 HWTXDBRUHVEBLR-UXHICEINSA-N 438.576 2.286 10 20 IECD O=C(/C=C/c1cc2ccccc2o1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1778110104 QYESDKYUTQGNIJ-ZFTMLNQLSA-N 449.463 2.396 10 20 IECD COc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787242759 ABHLCGCNBBMUEY-UHFFFAOYSA-N 437.456 2.296 10 20 IECD N[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1ccccn1 1788040422 IFCOHEZKYXVQOW-HXUWFJFHSA-N 433.468 2.336 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)[C@H]3CCCO3)C2)CC1 1810217174 NMTFPTHBXHSQNL-HXUWFJFHSA-N 438.528 2.190 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CC2)c1cc(O)nc(O)c1 1816728563 IGVFMNIKWVCAKG-GYHMKYFYSA-N 430.511 2.050 10 20 IECD O=C(Cn1cccn1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823709011 VCROOSOSGJBDNW-LLVKDONJSA-N 447.904 2.330 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccnc(Cl)n2)CC1 1829239255 NMASVIAQYRWQEZ-MRXNPFEDSA-N 445.907 2.483 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2c(F)cccc2Cl)C1 1844864392 VKVZCFTYIOTQTB-UHFFFAOYSA-N 441.937 2.156 10 20 IECD COc1nc(C)ccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038313 LBMZZYSLNDVDGY-RMKNXTFCSA-N 439.468 2.046 10 20 IECD CCOc1cnc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1848337667 VYYQVKUVYOYEBB-GJZGRUSLSA-N 432.864 2.069 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNC(=O)N1CCc2ccccc2C1 735946984 STHSTYGVILFBEX-UHFFFAOYSA-N 438.528 2.022 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1nnnn1C1CC1 742847691 OOWPDDCEVAVEBS-UKTHLTGXSA-N 434.572 2.367 10 20 IECD COCCOc1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cn1 742928458 RIKDYAMLYBTJNR-UHFFFAOYSA-N 429.521 2.059 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCCc4nc(O)ccc43)CC2)cc1 743359378 TXUIZPDDZHGJGB-OAQYLSRUSA-N 425.533 2.295 10 20 IECD O=C(NCC1(O)CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748353306 BOYBCBZBGNILAS-UHFFFAOYSA-N 435.458 2.136 10 20 IECD COC(=O)c1ccc(F)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227087 CXRNBLSVCQXTAY-UHFFFAOYSA-N 440.468 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C(F)(F)F)cnc3O)CC2)cc1F 754212666 OFWWIUYKFDQNFR-UHFFFAOYSA-N 442.369 2.241 10 20 IECD CN1CCCc2cc(CNC(=O)NCCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc21 758428648 AGOWKWSEDGZLEH-UHFFFAOYSA-N 432.502 2.250 10 20 IECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCC(O)CC4)c(F)c3)C2=O)cc1O 761100895 QSXMUXULYPPNQL-FQEVSTJZSA-N 429.448 2.294 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(Cn4cncn4)c(F)c3)no2)c1 761914441 QYULCHBYCLYXHE-UHFFFAOYSA-N 430.421 2.260 10 20 IECD Cn1cc([C@@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 766762807 GUQRNLYOAQMFJY-GCJKJVERSA-N 445.539 2.318 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771052402 DERVCGAHJVZKNO-INIZCTEOSA-N 437.949 2.396 10 20 IECD CCOC(=O)C1=C(COC(=O)/C=C/c2ccc(O)c(O)c2)NC(=O)N[C@H]1c1ccco1 772775195 MRGBKTICXJODAO-FNQPIQQGSA-N 428.397 2.119 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1 785292852 BCERKAQKBBSQRL-HNNXBMFYSA-N 425.485 2.410 10 20 IECD O=C(CN1CCC[C@H](Oc2ncccc2F)C1)NCc1ccc(N2CCOCC2)c(F)c1 785837678 GHXXKZOZCRBCFL-SFHVURJKSA-N 446.498 2.356 10 20 IECD O=C(COC(=O)c1ccnc(OC2CCC2)c1)NCc1ccc(N2CCOCC2)c(F)c1 786644387 APZHEMVSYAZFSX-UHFFFAOYSA-N 443.475 2.462 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3ccc(C(C)C)cc3)CC2)cc1 787342679 QAMUPTHADHRSML-UHFFFAOYSA-N 438.572 2.373 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1nc(C(F)(F)F)cs1 789800832 PYQBPWKHSBLKKM-UHFFFAOYSA-N 446.426 2.070 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@@]4(CCO[C@@H]4C)C3)cc2F)CC1 790717828 DLVRVZVHZVIJLK-IXFSTUDKSA-N 434.556 2.446 10 20 IECD Cc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 793735779 YTQPEMOPRXISDI-QFBILLFUSA-N 440.544 2.043 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 802610948 ZUZRQSYXSCSHNF-UHFFFAOYSA-N 441.532 2.415 10 20 IECD CN(C)c1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 803449082 NKUUFORBSZHSGR-UHFFFAOYSA-N 447.486 2.150 10 20 IECD CN(C)[C@H]1CCC[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451085 YBQJTBUJHOSBCO-WMZOPIPTSA-N 438.519 2.362 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCOc4cc(OC)ccc43)CC2)cc1 804318634 QLTADQFNRYZALR-NRFANRHFSA-N 439.512 2.429 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC(OC(C)(C)C)CC3)cc2F)CC1 805010108 UQVYLPJAYBDDPX-UHFFFAOYSA-N 448.583 2.390 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc4n(n3)CCCC4)cc2F)C[C@@H](C)O1 806842359 IZGZEHSFGSERCY-GASCZTMLSA-N 429.496 2.227 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O 807290811 AIUUNTWIRZYXQK-HSZRJFAPSA-N 446.551 2.029 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1C(=O)N(C)C 807384974 AJVAYSFHCGNWCE-UHFFFAOYSA-N 434.290 2.420 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807385244 GEZDSASNAMRKOA-UHFFFAOYSA-N 441.303 2.203 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](CCCO)c1ccccc1 807431246 BBBWNHOMEPBWRA-QFIPXVFZSA-N 425.529 2.112 10 20 IECD CN(CCOCC1CC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768761 BEOQLQYJNMJWGW-INIZCTEOSA-N 425.476 2.258 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@@H]1CN(C)CCO1 807956711 ROKOOEUSAJRFGY-GUXCAODWSA-N 436.984 2.028 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CC(=O)N(c2ccccc2F)C1 812877293 WAESRHCIYFXRSI-INIZCTEOSA-N 430.455 2.406 10 20 IECD CC(C)C(=O)Nc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918337277 IKKHQGGGSBHWHH-UHFFFAOYSA-N 429.542 2.446 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3sc(C(=O)OC)cc3OC)CC2)cc1 1319598109 KJFCFRKUYMPCOJ-UHFFFAOYSA-N 440.543 2.453 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3CNc3cccc(C)n3)CC2)cc1 1320971210 VJZGNWUABJRPKS-XZOQPEGZSA-N 439.604 2.458 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 1323860068 PODYGNKYJWHHPB-KSZLIROESA-N 432.517 2.117 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC(=O)N(C)c4ccccc43)CC2)cc1 1328226789 SNSRXRUJPQRYLT-HXUWFJFHSA-N 437.496 2.037 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(O)nc2ccccc12 1796601169 ATPGARAXXRMRAD-QDMKHBRRSA-N 434.452 2.312 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccn2ccnc12 1804285680 GUJMLIVMLBKDIO-BJKLQHCMSA-N 448.479 2.416 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1 1810552093 PEXLUWVXOYYWTR-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(O)cc1 1811933316 XVMRLUGXPLKWSG-IIBYNOLFSA-N 434.452 2.227 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1CCSCC1 1814235512 NWEGFFVKFVZMHV-OXQOHEQNSA-N 442.541 2.351 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2cncn2)CC1 1827192039 UVOJRJFSYLSAJW-QGZVFWFLSA-N 447.923 2.276 10 20 IECD Cc1csc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1834985509 HTLBQXQIOIBHDL-UHFFFAOYSA-N 444.557 2.362 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccccc2C2CC2)C1 1846780786 UEEMGEHLJZUVBO-UHFFFAOYSA-N 429.567 2.241 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1F 1847056654 MFNGNRBEDZLKJI-UHFFFAOYSA-N 449.573 2.130 10 20 IECD Cc1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)ccc1F 1848343895 ORDJUMKNJCIHMO-UCLCUNAYSA-N 427.432 2.175 10 20 IECD CC1CCN(c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cn2)CC1 727101771 HJCFSDROXNPTKF-UHFFFAOYSA-N 442.585 2.483 10 20 IECD O=C(CSc1nnnn1CC(F)(F)F)NCc1ccc(N2CCSCC2)cc1 729967287 MHBGWJIKZIBMDC-UHFFFAOYSA-N 432.497 2.197 10 20 IECD CCN1CCN(C(=O)CC2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)CC1 731283521 BPDHMSIQVLFHOL-UHFFFAOYSA-N 433.572 2.368 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCC[C@H](O)C3)c2C)c1 737817276 ZZSXCEKVNMUOSO-IBGZPJMESA-N 428.485 2.307 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN3CCN(S(C)(=O)=O)CC3)c2C)c1 749354492 BONZWSAMAPOXBB-UHFFFAOYSA-N 432.590 2.018 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(S(=O)(=O)NC)ccc2C)cc1 749627653 BESVSSHNKDRDEF-UHFFFAOYSA-N 446.573 2.346 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OCCN(C)C)cc3)CC2)cc1F 754211571 GHQGBJDGLXTKPF-UHFFFAOYSA-N 444.507 2.062 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccn(CC(F)F)n3)cc2F)C[C@@H](C)O1 754924083 VNONMZOCEINRHH-BETUJISGSA-N 439.438 2.156 10 20 IECD COc1cc(N2CCN(C(=O)c3cnc4c(c3)c(C)nn4C)CC2)cc(OC)c1OC 759222918 ZDSTXDYISIHBPG-UHFFFAOYSA-N 425.489 2.265 10 20 IECD COc1cc(N(C)CC(=O)Nc2cc(-n3nnnc3C)ccc2F)cc(OC)c1OC 760858343 XEAGOECSSHDECI-UHFFFAOYSA-N 430.440 2.211 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2cccc(Br)c2O)c1 765751169 QLEIUJQFLLPVQR-UHFFFAOYSA-N 429.292 2.267 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccnc1OCC(F)F)c1ccc(N2CCOCC2)cc1 765860502 NSLBTQSNLDKGTO-CQSZACIVSA-N 434.443 2.378 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)NCCOC)c3)c2)CC1 770287315 XRMZXZFZRQVVBH-UHFFFAOYSA-N 446.573 2.006 10 20 IECD C[C@H](NCC(=O)NCC(=O)N[C@H](C)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 775258169 RYZIARUHDLNQGS-ZWKOTPCHSA-N 442.535 2.307 10 20 IECD C[C@H](NCC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1ccc(N(C)C)cc1 775836640 OTCCETIUQZZCDE-IBGZPJMESA-N 444.601 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@H](CCO)c3ccccc3)CC2)cc1 778389922 KKXSVYQZMZSEIF-MDRMPYQZSA-N 437.540 2.482 10 20 IECD CCOc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCOCC1 779474530 AJUCUVYTYHPCQU-XBXARRHUSA-N 448.497 2.169 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](Oc4ncccc4F)C3)CC2)cc1 785837679 GIZBCDWWVPFLTA-IFMALSPDSA-N 444.551 2.256 10 20 IECD COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)c1 791526815 NBTIKLJLRQPFFT-JOCHJYFZSA-N 443.475 2.489 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccn(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 793661841 AXXIEBIMNKKJNW-GOSISDBHSA-N 433.512 2.203 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3nnn(Cc4ccncc4)c3C)cc2F)CC1 796236025 XYJZGBNZIWFNAO-UHFFFAOYSA-N 437.523 2.241 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](CO)CC3CCCC3)CC2)cc1 799052820 LAZFILLHBWPYPN-JPMGXVIASA-N 429.561 2.205 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(CN(C)C)cc1)c1ccc(N2CCOCC2)cc1 803302354 MLKSDSMWYKLOHI-LJQANCHMSA-N 438.572 2.421 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)C(F)(F)F)cc2F)CC1 806810594 XCSHMTKSHABGKB-QGZVFWFLSA-N 430.446 2.137 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCN1CCOCC1 914069852 FOPJNCRDGWUUOY-SQFISAMPSA-N 425.601 2.178 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(F)ccc1NS(C)(=O)=O 915008621 YPVBXIFGRXMHRP-UHFFFAOYSA-N 437.493 2.079 10 20 IECD COCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1Cl 918246394 MRPVYOYYWXCPNT-UHFFFAOYSA-N 432.908 2.037 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1 918433903 IZTFGAXPMJLQHC-UHFFFAOYSA-N 438.528 2.260 10 20 IECD CCOC(=O)C[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1320473324 VOWFZZJUIOJVPS-ZIFCJYIRSA-N 435.540 2.473 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1NS(C)(=O)=O 1321732975 QCJPJJKLVUFCKS-UHFFFAOYSA-N 432.546 2.236 10 20 IECD CC(=O)NC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786388877 CIVJFNOFFNZKRR-UHFFFAOYSA-N 426.473 2.155 10 20 IECD CC(=O)N(C)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786629214 YBZFYNJOCRYVRM-UHFFFAOYSA-N 426.473 2.109 10 20 IECD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)c[nH]1 1787699232 CZMVWVVPNNEYJH-QITLCBANSA-N 433.892 2.295 10 20 IECD Cc1nc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)o1 1796934641 NNBMXHLNHCOCEY-VBUUOAMHSA-N 435.484 2.336 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1801321387 YWZNDUDMUKLKKK-VDRHBUIISA-N 436.537 2.293 10 20 IECD CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191240 JDJRTYSXCMWVOI-UUHFFZMRSA-N 446.598 2.160 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC(O)C1)CC2)c1cc(O)c(O)c(Cl)c1 1823708116 MHLUAVUGOYMOOR-LDGBHUKOSA-N 437.905 2.204 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cc(O)n1 1827623431 ZDOZEYSESJJKOT-GOSISDBHSA-N 440.500 2.449 10 20 IECD CCOCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715885 VGUCOXSDDAKDRU-NRFANRHFSA-N 440.544 2.436 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CSc3nnnn3C3CCCC3)cc2F)CC1 303312199 PIJLEEFRHFPDCU-UHFFFAOYSA-N 447.584 2.478 10 20 IECD COc1cc(CNCc2ccc(N3CCOCC3)c(F)c2)ccc1OCC(=O)N(C)C 727468705 OEAKSTWHEMTHLR-UHFFFAOYSA-N 431.508 2.428 10 20 IECD Oc1cc2c(cc1CNC[C@@H](O)COc1ccc(I)cc1)OCO2 727471336 YEXWPTGHEPUZFP-CYBMUJFWSA-N 443.237 2.255 10 20 IECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 736070622 ZHGQXYYWCZRDJD-QFUCXCTJSA-N 443.592 2.225 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc1OC 736539011 GJBRFLSVFQYREA-UHFFFAOYSA-N 445.494 2.355 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(S(N)(=O)=O)c(Br)s1 742951938 BQTMAVVDXFHQHI-UHFFFAOYSA-N 446.348 2.263 10 20 IECD Cn1cccc1CNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 743061636 NKYUBMRVRWNPSD-UHFFFAOYSA-N 428.967 2.186 10 20 IECD Cc1ccc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n2)cc1 743248682 NLWAEEBZUHWDJV-UHFFFAOYSA-N 429.483 2.267 10 20 IECD C[C@]1(CCC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC(=O)N1 753418372 TUHMKDLYUDQJPQ-QHCPKHFHSA-N 440.523 2.007 10 20 IECD CCn1c(=O)nc(O)c2c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc(C(C)C)nc21 753644411 MBWKCQIBMJVGTG-LBPRGKRZSA-N 426.473 2.413 10 20 IECD Cc1cc(C(=O)COC(=O)c2ncsc2S(N)(=O)=O)c(C)n1-c1cccc(F)c1 753888381 HNIGJRMMNNITBR-UHFFFAOYSA-N 437.474 2.377 10 20 IECD C=C1c2ccccc2C(=O)N1CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759222098 XTEDDLJSOFWCQY-UHFFFAOYSA-N 437.496 2.488 10 20 IECD COc1cc(N2CCN(C(=O)CN(C)c3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 759226248 WVYLCFCOELFJAA-UHFFFAOYSA-N 444.488 2.406 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)[C@]12CCCO2 759323082 RUOLGIRPHVJDSK-QZNHQXDQSA-N 434.556 2.493 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)n1cccn1 761982429 LEYIMUPMMXMBTQ-YJBOKZPZSA-N 433.940 2.042 10 20 IECD CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 763425756 HOTYMBKRXPUMFI-LJQANCHMSA-N 443.569 2.041 10 20 IECD O=C(CCS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1)OCc1ccccc1 767236588 JAKCICNVPYZCQE-UHFFFAOYSA-N 436.505 2.215 10 20 IECD CC(C)Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 769021981 DLQRGEDIQYDWJH-UHFFFAOYSA-N 438.576 2.326 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 769164825 VYNZJSNNHZMBDE-GOTSBHOMSA-N 430.593 2.433 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)o1 771058606 NQTIXBORVIWSRX-HNNXBMFYSA-N 441.937 2.250 10 20 IECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1ccc(N2CCN(C)CC2)cc1 771851193 QCEIYFUOMZGOST-UHFFFAOYSA-N 437.588 2.447 10 20 IECD CNC(=O)c1ccc(Cl)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772904185 NZXYGLFGFXKCOK-UHFFFAOYSA-N 434.899 2.404 10 20 IECD CS(=O)(=O)[C@@H]1CCCC[C@@H]1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775376367 QKRLOWABKLMYBC-PZJWPPBQSA-N 447.580 2.388 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)cc1 778555196 RKOVTGGDJSRYCP-UHFFFAOYSA-N 438.528 2.323 10 20 IECD Cc1nnc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)s1 779982624 NDULILQSRSPIFD-UHFFFAOYSA-N 442.524 2.102 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCN(C(=O)C2CC2)CC1 781119606 XBAWOEPSNLYUPH-UHFFFAOYSA-N 449.554 2.339 10 20 IECD CCCc1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n(C)n1 784765924 CZWDGZQRSYKIEW-QGZVFWFLSA-N 433.940 2.451 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N2CCOCC2)c1 787611853 HVXIVQMNFHDOKJ-QHCPKHFHSA-N 438.572 2.209 10 20 IECD CN(C)Cc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 788461484 SYZWDMRQZDDPMR-OAQYLSRUSA-N 425.529 2.278 10 20 IECD Cc1cccc(CCNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 805719777 KETGUQUJLHPWBT-KRWDZBQOSA-N 432.471 2.435 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)c2cccc(Cl)c2)CC1 807097954 SQGYSHFRHAOSJY-UHFFFAOYSA-N 442.947 2.315 10 20 IECD CS(=O)(=O)C[C@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 813662561 YPRJVFGNHIBZNO-LSDHHAIUSA-N 431.505 2.333 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@H]1CCS(=O)(=O)C1 914454105 PXSKGEGTEFWBOS-ZMTLZGASSA-N 444.625 2.280 10 20 IECD C[C@@H](OC(=O)Cn1ccccc1=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 917954941 HIJRMBIJIUVVKX-CQSZACIVSA-N 430.416 2.194 10 20 IECD CCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918118283 XXSGAVQVBHHSRG-FQEVSTJZSA-N 443.592 2.226 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3N3CCCCC3)nc12 919154378 JNJAKTIVBVDGMS-UHFFFAOYSA-N 425.445 2.354 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N2CCCS2(=O)=O)cc1 919969590 SSYLCEQLTDWHPP-UHFFFAOYSA-N 447.532 2.257 10 20 IECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 1320858208 VFPAPQQAHGWFMG-UHFFFAOYSA-N 426.473 2.381 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(CNS(=O)(=O)CC)cc3)CC2)cc1 1322870473 XNMHHQNKJNCBCL-UHFFFAOYSA-N 431.558 2.487 10 20 IECD CCc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1816049798 NCRPJWSRJSMQPY-ZDUSSCGKSA-N 439.497 2.446 10 20 IECD O=C(Cn1cccn1)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823709012 VCROOSOSGJBDNW-NSHDSACASA-N 447.904 2.330 10 20 IECD CCN(CC)C[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1824582069 RWVLWUJIVQHQSN-GXTWGEPZSA-N 447.561 2.153 10 20 IECD COCCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195575 RBTBHFIPLCDEGV-OMDQHUAHSA-N 447.513 2.312 10 20 IECD Cn1nc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c2c1CCC2 1843775482 XNNUEIDODJMMEZ-UHFFFAOYSA-N 430.892 2.104 10 20 IECD Cc1nc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)sc1C 1844620868 LIAUQGUKFJRGIC-UHFFFAOYSA-N 437.525 2.370 10 20 IECD CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 623708203 LNQADLUYLPNEAI-UHFFFAOYSA-N 429.523 2.453 10 20 IECD C[C@@H](CS(C)(=O)=O)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 733246246 KCDUWQOWQILXGO-KWJWQAOWSA-N 432.614 2.279 10 20 IECD COc1ccc(C(=O)NCCN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1 736647116 FHWYLOGQFUGKIL-UHFFFAOYSA-N 438.572 2.079 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 743312745 GTNYBPJHZJKJTF-LJQANCHMSA-N 440.519 2.350 10 20 IECD C[C@H](NC(=O)NCCNC(=O)Cc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 748825488 FFWKWQLUMBPELN-KRWDZBQOSA-N 428.508 2.381 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1 751404594 HXRLFGUKLJSZJG-SFHVURJKSA-N 435.521 2.361 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(C(=O)N4CCCC4)cc3)CC2)cc1 758229659 FJQMOFNULRSMHD-QFIPXVFZSA-N 439.556 2.493 10 20 IECD Cc1cc(C(=O)OCC(=O)Nc2cc(-n3cnnn3)ccc2F)c(C)n1-c1ccccn1 761073138 RBONPKKTSGKVGV-UHFFFAOYSA-N 435.419 2.399 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1NC(C)=O 765902872 FJXXPNVSPCSUAQ-UHFFFAOYSA-N 436.262 2.377 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c1 769530756 PRHRSALEWFJMSO-HXUWFJFHSA-N 446.525 2.463 10 20 IECD CC[C@@H](C)[C@@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771062539 ASLYIZHBBBGGDT-XIKOKIGWSA-N 437.474 2.238 10 20 IECD COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN[C@@H](C)c1cc(OC)ccc1O 775368818 GOEKTAHHBOWARO-VBKZILBWSA-N 425.485 2.433 10 20 IECD COC(=O)CN(CC(=O)OC)Cc1cc(Br)cc(Br)c1O 775658562 NEBCFTVYJPNQDN-UHFFFAOYSA-N 425.073 2.065 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781458465 RLLBKXIXBXSSTG-OAHLLOKOSA-N 441.484 2.134 10 20 IECD COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785424447 PNRPDEJYSIZEOI-UHFFFAOYSA-N 446.935 2.484 10 20 IECD C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787903105 JNOBLDANPZKJPV-GOSISDBHSA-N 434.556 2.049 10 20 IECD CN(Cc1nccn1Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317984 BZDGYPVEVQFLNK-UHFFFAOYSA-N 447.539 2.043 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1 788571093 JHGDYQMAGDJQRH-RYRKJORJSA-N 436.503 2.116 10 20 IECD Cc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811272 DOHKNGUPXNRVEI-QGZVFWFLSA-N 429.492 2.171 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC1CCN(c2cccs2)CC1 789811714 GIYFIUIAQADPFJ-UHFFFAOYSA-N 446.548 2.125 10 20 IECD COCn1nc(C)c(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 790012770 IZDFUQNTMGDBMW-ZIAGYGMSSA-N 440.541 2.335 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Br)c(F)c2)ccc1O 790406054 BGMYVAKECRFPNY-UHFFFAOYSA-N 439.284 2.003 10 20 IECD COc1cc(N2CCN(C(=O)CCc3ccccc3C(N)=O)CC2)cc(OC)c1OC 791707106 XBSUYDWVBMJYMZ-UHFFFAOYSA-N 427.501 2.093 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)COc3cccc(F)c3)CC2)cc1 793799534 OCMBWZQYVRJDQK-KRWDZBQOSA-N 429.492 2.457 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1 799253809 WWJDBFXEBWXCRN-VBKZILBWSA-N 441.484 2.135 10 20 IECD Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297832 HRNVDYPIZHXIHV-FOIQADDNSA-N 425.533 2.404 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ccncc3OC)CC2)cc1F 804851368 AFROARIVEHIQPY-UHFFFAOYSA-N 443.523 2.041 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(Oc4cnccn4)CC3)cc2)CC1 805025753 YAHCYIBXPVDNSW-UHFFFAOYSA-N 437.544 2.399 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 807288677 ZKWUSWZKGXTIGA-QGZVFWFLSA-N 425.920 2.123 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 807289152 KNTYAAWBAZVBIB-FQEVSTJZSA-N 436.487 2.130 10 20 IECD CN(C)C(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916632232 RWYWDZAKKUVYFJ-UHFFFAOYSA-N 443.470 2.051 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccccc3Cn3cncn3)cc2)C1 918008063 GNVHXOHLRRRHMZ-OAQYLSRUSA-N 447.543 2.028 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 918220218 IHRBQVGDUGKFIZ-JZXOWHBKSA-N 441.569 2.406 10 20 IECD Cc1cc(C(=O)COC(=O)COC2CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 919385632 HILCRRHEUUSAPU-UHFFFAOYSA-N 434.514 2.427 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)s1 919767802 ZECSDLWNAIDYDG-LJQANCHMSA-N 449.598 2.363 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1ccccc1 919911981 XXUCFUZPAYFSKZ-MRXNPFEDSA-N 428.508 2.291 10 20 IECD Cc1cc(C(=O)CN(C[C@@H]2CCOC2)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920408208 KYYYBSFSVZVLCR-KRWDZBQOSA-N 431.558 2.425 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3nc(C)n(C)c3Br)CC2)cc1 1326506872 QLXIWUJFSAAUQE-UHFFFAOYSA-N 443.367 2.401 10 20 IECD CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c[nH]1 1785567558 KIEZYQWCURGSHA-JQFCIGGWSA-N 442.516 2.026 10 20 IECD O=C(Cc1ccncc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933130 RKDMMHFJPGAYGF-FNLKRUPLSA-N 431.496 2.055 10 20 IECD CC(C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804081850 YRGVIEAXGVOVQY-YWZLYKJASA-N 428.489 2.023 10 20 IECD O=C(CCc1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807459452 NAXATOAKLUWYEO-KSFYIVLOSA-N 435.484 2.168 10 20 IECD O=C(CC[C@@H]1CCOC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813627573 RYBHJGQXHXCCBE-JLDZCNIISA-N 440.500 2.024 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)F)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146723 ZCODDIUVOTVRSH-HNNXBMFYSA-N 430.415 2.460 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427113 PNWDJJNPQWSYJO-QFBILLFUSA-N 441.532 2.259 10 20 IECD COc1cnc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c(F)c1 1845500730 HPOCTTBRZSGYSJ-UHFFFAOYSA-N 435.839 2.425 10 20 IECD O=C(CNC(=O)c1ccc(Br)s1)NCc1ccc(N2CCOCC2)cc1 108807736 VHWSBCASLRZOCK-UHFFFAOYSA-N 438.347 2.393 10 20 IECD Cc1ccc(CCC(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 116394417 RYUDGRQCNLHBAZ-NRFANRHFSA-N 436.556 2.062 10 20 IECD O=C(CCN1CCOCC1)Nc1cccc(CNCc2ccc(N3CCOCC3)cc2)c1 238022369 WKDIADZRNBLEDF-UHFFFAOYSA-N 438.572 2.474 10 20 IECD COCC(=O)N1CCc2cc(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)ccc21 472792548 VESMTWDHBNTGKN-UHFFFAOYSA-N 434.496 2.277 10 20 IECD NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(-n3cnnn3)c2)c1 728836251 XSUSOYOKCRKQCD-UHFFFAOYSA-N 427.468 2.407 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccnc3-n3cncn3)CC2)cc1 731278331 OIKOHHPENHQQBK-UHFFFAOYSA-N 436.520 2.005 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1 734687084 GXKDAUJANMREPS-UHFFFAOYSA-N 435.572 2.478 10 20 IECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1C 745936680 XQAKIDDMRKKZFR-UHFFFAOYSA-N 443.472 2.360 10 20 IECD O=S(=O)(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnn([C@@H]2CCOC2)c1 751979905 MLHDPHNIQGZVFH-MRXNPFEDSA-N 442.488 2.393 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCS(=O)(=O)C2(CCCCC2)C1 753856220 BHRZQDJBGXPFPQ-UHFFFAOYSA-N 439.553 2.305 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2C)cc1OC 757657932 ZCPBBRMRMOWXEZ-UHFFFAOYSA-N 428.488 2.264 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 758004473 UENAPWJNHKRCIQ-GASCZTMLSA-N 435.521 2.325 10 20 IECD CN1CCN(c2cc(CNC(=O)NCc3cccc(Br)c3O)ccn2)CC1 764763457 LXEUFGRQXLRLNH-UHFFFAOYSA-N 434.338 2.301 10 20 IECD CCOC(=O)C1=C(COC(=O)/C=C/c2ccc(O)c(O)c2)NC(=O)N[C@@H]1c1ccco1 772775201 MRGBKTICXJODAO-ZLQZBKBYSA-N 428.397 2.119 10 20 IECD COc1ccc(N2CCC(NC3CCN(S(=O)(=O)c4c(C)n[nH]c4C)CC3)CC2)cc1 779347013 ZNHBOSMEVUWTOQ-UHFFFAOYSA-N 447.605 2.447 10 20 IECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764431 HBIMTLFMESPWEK-CQSZACIVSA-N 441.866 2.227 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)nn1 786018800 DMIMDSFXCFJQBJ-GASCZTMLSA-N 430.480 2.319 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C 787641605 UYDMMVQOKJRTLV-QFIPXVFZSA-N 442.535 2.040 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@](C)(C4(C)CC4)C3=O)cc2F)C[C@@H](C)O1 789655420 YSRZUIUXCVSOJD-GGOJBBCOSA-N 446.523 2.166 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1)C[C@@H](C)O)c1ccc(N2CCOCC2)cc1 803306348 SQBUNVSIBVWVEP-MOPGFXCFSA-N 425.529 2.110 10 20 IECD CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 804975706 RJIHUBNMADTRHK-GJZGRUSLSA-N 446.577 2.400 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCn4c(C5CCCC5)nnc4[C@H]3C)nc12 805789956 OOYUXGNWDCWQIV-CYBMUJFWSA-N 425.493 2.438 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)C2CC2)cc1 806215275 AYABBWHDVHGQGL-FQEVSTJZSA-N 438.503 2.304 10 20 IECD CCOC(=O)c1sc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)nc1C 807098908 FOJAKVCJLSLQQC-AWEZNQCLSA-N 432.546 2.496 10 20 IECD CCN(CC)[C@H](C)CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771399 UUTLHBREVRWHBM-CVEARBPZSA-N 426.508 2.220 10 20 IECD COc1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 810352811 MQLFQKBXOZUIKK-UHFFFAOYSA-N 437.418 2.329 10 20 IECD CNS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 916486065 VSQHUPYDSDZKMK-UHFFFAOYSA-N 434.587 2.147 10 20 IECD CCCN(C(=O)[C@H](C)N1CCCN(c2ccc(OC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 917087814 IMRLODGOZSJMPZ-ICSRJNTNSA-N 437.606 2.022 10 20 IECD Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917836649 RCVKHINGBNHEBU-LJQANCHMSA-N 448.571 2.454 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 917919283 YNZJBFNQBGRYTN-UHFFFAOYSA-N 425.438 2.058 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(Cn2cccn2)c1 918442397 FWDGZDRAMVJZDT-UHFFFAOYSA-N 447.539 2.395 10 20 IECD CCn1c(O)nc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2c1=O 919971795 YAIJXAOYNZOYDQ-UHFFFAOYSA-N 440.475 2.152 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(CNC(C)=O)ccc3OC)CC2)cc1 1319601915 SUDRRIFBVKNYCO-UHFFFAOYSA-N 447.557 2.241 10 20 IECD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)nc2ccccc12 1777876103 FZZJANULECRVQR-DEOSSOPVSA-N 448.479 2.107 10 20 IECD CC(C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126022 BXVINTVLWQWIES-HYBUGGRVSA-N 440.544 2.339 10 20 IECD Cn1c(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)cccc1=O 1787245047 JLGBOLIITOAUDT-UHFFFAOYSA-N 434.452 2.253 10 20 IECD CC/C=C(\C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787541227 BDUKLSXJYMBWQQ-YYBHFMGBSA-N 438.528 2.115 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc(Cl)c1)c1cc(O)nc(O)c1 1792832240 RDHHHMXPVMMXSD-MUJYYYPQSA-N 431.876 2.477 10 20 IECD CC(C)(F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898641 UETUPTBIBHBQOV-AWEZNQCLSA-N 429.583 2.215 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cc(F)ccc3F)CC2)cc1 12069520 JZHUWZKCIHKIMY-UHFFFAOYSA-N 432.471 2.240 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2nnc3ccc(C(F)(F)F)cn23)n(C)c2ccccc12 550247230 CCLRGGQPELPUIY-UHFFFAOYSA-N 444.417 2.481 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1 729063691 KPXLFVFIILZXRW-HNNXBMFYSA-N 441.484 2.218 10 20 IECD COC(=O)CN(CC(=O)NC1(C(=O)OC)CCCCC1)Cc1cc(Cl)ccc1O 732202801 DXWNOUBKJCNLIC-UHFFFAOYSA-N 426.897 2.013 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4cc(F)ccc4F)=NO3)cc2)C1 732637424 VEYGLGRFNPOURP-QVKFZJNVSA-N 442.466 2.476 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NCCCSc2nccs2)CC1 733973701 UVFQVDMVXOUNDC-UHFFFAOYSA-N 444.604 2.447 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)n3nnc(-c4ccccc4)n3)cc2F)CC1 742644802 HYQLBWVYEKGKHN-KRWDZBQOSA-N 437.523 2.499 10 20 IECD CO[C@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 745738094 SRUFZQVWRNYZFT-HXUWFJFHSA-N 430.528 2.413 10 20 IECD C[C@@H](CN1CCN(C)CC1)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745809202 RHCRIKSAWCBFCE-DLBZAZTESA-N 425.524 2.192 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](Cc4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 746679959 RVJNXHDGCYRVAX-NSHGMRRFSA-N 443.567 2.354 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OCCO3)cc1OC 751273380 ULLZKFKYQKBSMH-UHFFFAOYSA-N 428.488 2.029 10 20 IECD CC1(C)C(=O)N(C[C@](C)(O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc21 760145589 MQIHXJUOJUUXSL-VWLOTQADSA-N 437.540 2.215 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(Cn2cncn2)c1 765904308 QODPCGUAAFBPFA-UHFFFAOYSA-N 430.262 2.049 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1[N+](=O)[O-] 768183803 PYNAHRUZWKBUJV-UHFFFAOYSA-N 434.518 2.176 10 20 IECD COC(=O)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(Cl)c1 769933026 VETTXHBQUHNKNM-HNNXBMFYSA-N 426.878 2.451 10 20 IECD CCOC(=O)CNC(=O)C1CCN(Cc2cc(Br)cc(OC)c2O)CC1 770360215 OFYFYPKJIGCTCW-UHFFFAOYSA-N 429.311 2.055 10 20 IECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775675919 FVELZFHEWWMLOU-GMAHTHKFSA-N 427.637 2.251 10 20 IECD CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1cccs1 786259487 QILUONRNMZNBLY-FQEVSTJZSA-N 428.558 2.300 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2[nH]c3ccccc3c2C1 789801962 XWCALQSTPBYHDY-UHFFFAOYSA-N 436.487 2.345 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1CCCCC1 789823753 FXFCVHZKKZIYTR-RCCFBDPRSA-N 434.556 2.046 10 20 IECD COCCN(Cc1scnc1C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856450 UWOSLHKJZABOAA-UHFFFAOYSA-N 448.614 2.296 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3)CC2)cc1 791623415 UVEVOJGOSIRUIK-ZRZAMGCNSA-N 434.584 2.408 10 20 IECD C[C@H](C[C@H]1CCOC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450525 JULQIFGXLFBJNW-HUUCEWRRSA-N 425.476 2.304 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689102 KDJXRAMQWFIXGB-LJQANCHMSA-N 443.569 2.054 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CN4CCOCC4)C3)cc2)CC1 805023884 MUFGLIURLFTTFG-QFIPXVFZSA-N 442.604 2.110 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)[C@H]1Oc1ccccc1 807097561 PPIRPRUXQVKZHA-BHDDXSALSA-N 425.529 2.418 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807513026 PTJPMJNIESBDPJ-UHFFFAOYSA-N 426.256 2.079 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CC[C@H](O)C1 807919843 MOGRDUYXMCJQGL-QFIPXVFZSA-N 439.556 2.404 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nnn(Cc2cc(C)no2)c1C 815952439 LEXKGVGYCBHJGP-UHFFFAOYSA-N 433.852 2.106 10 20 IECD CC(C)(C)OC(=O)N1CC[C@H]2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC[C@H]21 816999668 CCOKWQVOJDNPIK-XJKSGUPXSA-N 439.534 2.235 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 918430340 XWLBJCWAISOQJX-UHFFFAOYSA-N 438.528 2.260 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ccc1[N+](=O)[O-] 919697942 OZFCHQJRENXPEY-UHFFFAOYSA-N 439.451 2.119 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)N4CCOCC4)CC3)c2C)cc1 1317993276 WFOUPZJJHWGFPK-UHFFFAOYSA-N 426.517 2.313 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(F)(C3)C4)[C@H]2C1 1784590406 YKHXJEDKPMFIDA-RIEFPYHGSA-N 438.883 2.237 10 20 IECD COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796599207 FYKSJLDYOQMTTG-BCDXTJNWSA-N 425.485 2.386 10 20 IECD CC(C)COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccn1 1796911164 UYHXFHLYZDYYLY-BCDXTJNWSA-N 440.500 2.488 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nc1 1805867229 DWMJIONHQQLCRR-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccncc1F)CC2)c1cc(O)nc(O)c1 1816724710 BRMOPQZDIKBSSW-JTQLQIEISA-N 429.433 2.023 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3ccncc3F)sc2C1)c1cc(O)nc(O)c1 1817864229 POMGSEARIVWSSF-JTQLQIEISA-N 429.433 2.023 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(O)c(F)c1 1823311411 ZGXRHHSEGBZJFH-LLVKDONJSA-N 444.444 2.334 10 20 IECD COC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828192741 PWYJYFHMRRKAGM-LHXVZLOVSA-N 447.513 2.310 10 20 IECD Cc1nc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccc1F 1842208569 VTUWNQHAHHXPGM-UHFFFAOYSA-N 435.459 2.139 10 20 IECD CC(C)N[C@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)C(C)C 1843441808 DVQPMEMQVCEABT-NRFANRHFSA-N 439.560 2.005 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(CCCCCCC4)C3=O)CC2)cc1 3555659 USXFCPPRFYYUIK-UHFFFAOYSA-N 428.533 2.379 10 20 IECD COc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1OC 108199007 MXDCKOLRUDSISO-UHFFFAOYSA-N 429.542 2.303 10 20 IECD COc1ccc(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1Cl 726894050 VWHMQMJNCIMYIQ-UHFFFAOYSA-N 431.883 2.218 10 20 IECD COc1cc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726977158 XLAMRQULPPNOSX-UHFFFAOYSA-N 444.962 2.062 10 20 IECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)c1cccc(-n2cnnn2)c1 727243646 BUTQKYWTSXPYSM-UHFFFAOYSA-N 442.482 2.358 10 20 IECD CCOCc1cc(CN[C@H](C)C(=O)Nc2cccc(S(=O)(=O)NC)c2)ccc1OC 730017318 BDBFKVDIHDTXBO-OAHLLOKOSA-N 435.546 2.257 10 20 IECD CC[C@@H](C)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)NCCN1CCOCC1 732155939 GMRPNJUNSJXOII-VGSWGCGISA-N 441.576 2.082 10 20 IECD Cc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 736623507 LYLGBOFPYWBDNP-FQEVSTJZSA-N 438.572 2.289 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 742528602 OUKKWBVGGLVEHA-CZAYHTPWSA-N 437.496 2.037 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 746879931 JKMJLICRAXMSAL-UHFFFAOYSA-N 447.557 2.071 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NCc2ccccc2O)c1 748485504 HTZVCLFLMAXZDQ-UHFFFAOYSA-N 433.530 2.294 10 20 IECD O=C(Nc1ccn(CCc2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 759023446 XDWOIMGQGGLXGS-FQEVSTJZSA-N 449.511 2.373 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3cccc4c3OCO4)CC2)cc1 770448261 MZBKGWXGGZQBAU-UHFFFAOYSA-N 426.469 2.249 10 20 IECD CN1CCN(c2ccc(CNCCNS(=O)(=O)c3ccc(Cl)s3)cc2)CC1 771855923 OLSPQHGCQPKZOT-UHFFFAOYSA-N 429.011 2.221 10 20 IECD COc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1NS(C)(=O)=O 771864438 WPBQOOQHWROALW-UHFFFAOYSA-N 439.877 2.395 10 20 IECD COC(=O)[C@@H]1C[C@H](C)CCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 775805459 BYIDNSNESOXKLO-LHUKNYEISA-N 435.540 2.329 10 20 IECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1F 776044185 ZPMPJSRSOWNESA-OXJNMPFZSA-N 427.542 2.207 10 20 IECD COC(=O)C1(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCCC1 778226026 NCJUPGRXBKMCHV-VAWYXSNFSA-N 443.544 2.282 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCCc4nc(C)ncc43)CC2)cc1 778284709 QQPUDJQIXQRXGD-NEQMZLFVSA-N 435.528 2.192 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1 778673551 GVCHRECRINVPLX-IBGZPJMESA-N 448.589 2.163 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)cc1 779500251 OBOLXIJCJGTZAP-DYESRHJHSA-N 433.574 2.185 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 781448342 CBDDCZGZEJUJOR-UHFFFAOYSA-N 443.525 2.290 10 20 IECD CC[C@@](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)(C(N)=O)C(C)C 782100119 CPEIJFYAVZZKTO-SFHVURJKSA-N 425.532 2.274 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1 784030250 LUGWPAKNQSDEOG-UHFFFAOYSA-N 431.514 2.210 10 20 IECD Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 784270889 BPSISBWHPQJXLH-LJQANCHMSA-N 447.605 2.336 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1 785292853 BCERKAQKBBSQRL-OAHLLOKOSA-N 425.485 2.410 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nc(C)cs1 789833719 IWRDENWRVCJWEO-KRWDZBQOSA-N 434.537 2.435 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCCO1 789953885 GMWHTWFRCVXRGM-QZTJIDSGSA-N 443.466 2.232 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cnn(CCO)c3-c3ccccc3)CC2)cc1 793247371 NFAMBZWIWRGYSJ-UHFFFAOYSA-N 449.555 2.103 10 20 IECD C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793727895 WCXQLZCIIZEXKX-LYSIVYOWSA-N 426.561 2.184 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 793808975 CRAYYKJYIGYAFS-KOSHJBKYSA-N 430.593 2.407 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 793940323 ZPEHOVASBYLTSW-IRXDYDNUSA-N 433.549 2.304 10 20 IECD COc1ccc(CNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)c(O)c1 794374461 UHZWRVYWFRKEGY-UHFFFAOYSA-N 443.319 2.148 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C 797611046 JQNVPNPTVIPPDI-ZDUSSCGKSA-N 436.534 2.167 10 20 IECD Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 800599074 JLUJUMHERJZFPH-UHFFFAOYSA-N 448.426 2.397 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1 802144547 RXJPNGYMUFBOKH-GOSISDBHSA-N 427.567 2.192 10 20 IECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCc2ccccc21 803910211 UUFMPCUYWOLFEB-RXVVDRJESA-N 437.540 2.467 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccccc3S(=O)(=O)C(F)F)CC2)cc1 804936863 QRMOOSNCQJWGEN-UHFFFAOYSA-N 446.497 2.202 10 20 IECD CC[C@@]1(C)CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768801 BQEJOMHJFUFXGE-VFNWGFHPSA-N 425.476 2.401 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3nc4cc(C)ccc4n3C)CC2)cc1 808810266 MCIRYGCALRLBJE-UHFFFAOYSA-N 435.528 2.245 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918204769 APOJXELFZKCYDV-UHFFFAOYSA-N 440.544 2.480 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccc(F)cc4)CC3)cc2F)CC1 1320474901 AVZLDESEKFLIFZ-UHFFFAOYSA-N 443.542 2.473 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3CCCC[C@H]3C)CC2)cc1 1325006064 GAYUZOWOBMIIAA-ZCPJJFRWSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCC(=O)N3CCC[C@H](C)C3)CC2)cc1 1341870178 XKJXCTWXUJHUBX-FQEVSTJZSA-N 445.608 2.155 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C1=CCCS1 1784572311 CDJKINAGYMWDMN-RBOXIYTFSA-N 438.933 2.365 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccncc1F 1796934396 LRGAFTPYQVPBCU-ACHSLPGTSA-N 435.459 2.265 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1=CCCC1 1806221836 QOMDVRWFFMMSHV-APWZRJJASA-N 444.582 2.058 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cccs3)CC2)CC1)c1cc(O)nc(O)c1 1834988043 LYFRARCNDUWOGC-UHFFFAOYSA-N 430.530 2.053 10 20 IECD COc1cc(Br)cc(CNCCNS(=O)(=O)Cc2ccccc2)c1O 725847455 LYQNYSSLJTVQBS-UHFFFAOYSA-N 429.336 2.373 10 20 IECD COc1cccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1O 729859238 NDDMDGFWCMOPMV-QGZVFWFLSA-N 449.485 2.169 10 20 IECD CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 730074353 BIYMXMRLLLHYRC-MJGOQNOKSA-N 446.617 2.342 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(Cc4cscn4)CC3)cc2F)CC1 730133431 RSDXAEFINZQFHM-UHFFFAOYSA-N 446.596 2.452 10 20 IECD C[C@@H](Nc1ccn(CC(=O)N(C)C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 734157376 BDQLQDFUORJPQD-CQSZACIVSA-N 445.479 2.186 10 20 IECD NC(=O)C1CCN(c2ncccc2CNC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740913656 CZKJBXNLLACJDC-UHFFFAOYSA-N 434.544 2.159 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1F 747011791 MHRUYYYGFNAOLH-LJQANCHMSA-N 428.464 2.264 10 20 IECD CC(=O)N1CC[C@](C)(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 747086916 VOBIQZGLKUGBBE-DEOSSOPVSA-N 434.448 2.202 10 20 IECD COC(=O)[C@H](O)C1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 749535333 NBINOYHVAHPWPB-HSZRJFAPSA-N 442.512 2.294 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753729677 DZIKRQGEIGGKIP-UHFFFAOYSA-N 435.521 2.403 10 20 IECD COc1cc(N2CCN(C(=O)CCS(=O)(=O)C3CCCC3)CC2)cc(OC)c1OC 759240480 SWOMIQHDNCTGBR-UHFFFAOYSA-N 440.562 2.109 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(NC(C)=O)ccc3O)CC2)cc(OC)c1OC 760086308 UCZYRSCSRCRVFX-UHFFFAOYSA-N 429.473 2.339 10 20 IECD COc1ccc2c(c1)OC[C@@H]2CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 760382735 REELDFAIDJASQB-KRWDZBQOSA-N 430.526 2.113 10 20 IECD CCC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 762087145 QUDYWLZUOOZTLW-OAHLLOKOSA-N 428.455 2.352 10 20 IECD CC(C)CCn1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 766360274 LOHUEBPIIPRYDD-UHFFFAOYSA-N 427.549 2.393 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2ccc(F)cc2F)n1 767034273 BLLXRDUPWAXMFO-UHFFFAOYSA-N 446.479 2.315 10 20 IECD COc1ccc(O)c(CNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)c1 769540726 OBAJSVHJSVMOCQ-UHFFFAOYSA-N 433.530 2.449 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(O)(Cc4cccc(F)c4)CC3)nc12 770699796 HQIXPTCHVRFFNV-UHFFFAOYSA-N 428.464 2.320 10 20 IECD CN(CCN(C)C1CC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 771301876 YTWQNWUXBZJDSY-UHFFFAOYSA-N 441.555 2.178 10 20 IECD C/C=C\C[C@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771621302 PSGLCWRGWQOLIT-PYLYLYNFSA-N 435.458 2.158 10 20 IECD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)n(C)c2)C1 773761567 SLEVUABCYGQIMZ-LSDHHAIUSA-N 435.546 2.218 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@@H]1CC1(Cl)Cl 775163987 ORKHUHQJIWOWQI-KRWDZBQOSA-N 439.387 2.145 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCc2nnc(O)cc2C1 775778104 VPJOTTILRCJAAF-CYBMUJFWSA-N 428.448 2.343 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@](O)(c4ccc(F)cc4)C3)CC2)cc1 776899781 KLMGNQMYKVCLKW-DEOSSOPVSA-N 442.535 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCCc4nc(O)ccc43)CC2)cc1 778224141 RJJQIEQCESJXOB-AXUYNXDZSA-N 436.512 2.194 10 20 IECD CCCOc1ccc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 778259812 CIFLTADPHJFYNX-PKNBQFBNSA-N 438.528 2.400 10 20 IECD CCn1cc(-c2n[nH]cc2C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cn1 778320804 RMVBZRQJPYRAHR-UHFFFAOYSA-N 437.548 2.244 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(OC)c1 778559998 JELNXGDZHIMJNJ-UHFFFAOYSA-N 446.503 2.200 10 20 IECD COc1ccc(Cn2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)n2)cc1 778597980 VOZNQYKVWZIZTK-UHFFFAOYSA-N 425.464 2.400 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1Br 778616885 BQJRDUAGWUKFQH-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CCC(=O)N(CC)CC)CC3)nc12 782522885 GDKQTCFETSZFTI-UHFFFAOYSA-N 431.537 2.472 10 20 IECD Cc1cc(C(=O)COC(=O)c2cccc(F)n2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 783210650 YRZMZHAWIBRKSL-UHFFFAOYSA-N 431.445 2.315 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(CC1)COC(=O)N2 784465931 VMLODLAEXOBRKH-CQSZACIVSA-N 433.464 2.363 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)(F)C1(O)CCCC1 785930885 AGIIODXVHSETKH-UHFFFAOYSA-N 449.477 2.499 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(c3nnc4n3CCCC4)CC2)cc1 788974954 LNVNHSYFALYCST-UHFFFAOYSA-N 438.576 2.483 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCN2CCCC[C@H]12 790271682 ADYZUDIRCGVUNL-ATZDWAIDSA-N 436.503 2.116 10 20 IECD COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 791535457 XVBIPXPMJYRYDA-PGRDOPGGSA-N 436.512 2.206 10 20 IECD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc(N2CCN(C(C)C)CC2)c1 792254520 MXXGRGHANPNLNB-UHFFFAOYSA-N 440.544 2.234 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3c(C)nn(Cc4ccccc4)c3N)CC2)cc1 795776493 UUYCMIKQCCPVLG-UHFFFAOYSA-N 448.571 2.383 10 20 IECD CNC(=O)[C@]1(C)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 797430569 LTRKCOBOOSMREC-LJQANCHMSA-N 428.455 2.210 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@H]3CC(C)(C)C)CC2)cc1 803750623 MEBSVBJBXHBTMN-FQEVSTJZSA-N 430.593 2.361 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1 808347007 XDEYTFNYFFLZBQ-XZOQPEGZSA-N 444.620 2.375 10 20 IECD Cc1cc(C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1-c1ccccc1Br 819619418 ANDMFDHEWLLXCD-UHFFFAOYSA-N 445.321 2.494 10 20 IECD Cc1cc(CCNC(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C)n1-c1ccccc1 916221368 WQEAULKIUVVBAP-UHFFFAOYSA-N 425.577 2.488 10 20 IECD CSc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918463202 IQPAUCZEBMGQGM-INIZCTEOSA-N 426.542 2.365 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 920091279 NNMVVEOPTLAXKY-UYAOXDASSA-N 448.583 2.295 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)CN(C4CCCC4)C3=O)cc2F)C[C@@H](C)O1 1333638698 IPVCOFBTIYZLIC-HZPDHXFCSA-N 446.523 2.262 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCCN3Cc3cccnc3)nc12 1338740709 VNIZXFHKVBQEBX-SFHVURJKSA-N 439.472 2.105 10 20 IECD C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)c1ccccc1 1783281316 RRXBIPBSURPIJQ-WAIKUNEKSA-N 425.485 2.130 10 20 IECD O=C(Cn1ccnc1)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1808613152 JBMDCDLEFNXTRM-UHFFFAOYSA-N 432.908 2.493 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@]1(F)Cl)CC2)c1cc(O)nc(O)c1 1816728784 VFPCDSWTRHBSES-CGMALJKESA-N 426.857 2.100 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCCc2ccncc2)C1 1842072471 AGEYBQPJMPNRBZ-UHFFFAOYSA-N 445.523 2.401 10 20 IECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N1CCN(c3ccc(OC)cc3)CC1)C2=O 4297107 WNBKTYXSPAHMGG-UHFFFAOYSA-N 428.533 2.235 10 20 IECD C[C@@]1(C2CC2)NC(=O)N(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 726566051 XMYKMQDFLNYAGW-NRFANRHFSA-N 436.459 2.094 10 20 IECD CCS(=O)(=O)N(C)C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 731404465 DEQHQQWWRGJSLX-UHFFFAOYSA-N 438.594 2.120 10 20 IECD O=C(O)CCCN1C(=O)/C(=C\c2ccc(OCC(=O)O)c([N+](=O)[O-])c2)SC1=S 731664033 PTGGQBMLAWYROD-KPKJPENVSA-N 426.428 2.124 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)c1 731835079 MGTBWLSDOVJRAG-UHFFFAOYSA-N 436.877 2.440 10 20 IECD CCOC(=O)c1c(NC(=O)CN2C[C@H](O)C[C@H]2C(=O)OC)sc(C)c1-c1ccccc1 731845111 YHCFPCFGHHTSJE-CVEARBPZSA-N 446.525 2.447 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1S(=O)(=O)NC(C)(C)C 740492230 UVTPIBROMUQJJQ-UHFFFAOYSA-N 433.530 2.375 10 20 IECD O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)cc1 740742582 PTFCLMWTUOFWIS-SSEXGKCCSA-N 430.526 2.109 10 20 IECD O=C(Nc1ccnn1Cc1ccccn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 746363349 USRKMXMNEBPPGF-IBGZPJMESA-N 435.484 2.178 10 20 IECD O=C1C[C@H](Cc2ccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)C(=O)N1 747551404 CNPXBXLMXPCFQT-KRWDZBQOSA-N 440.475 2.189 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3nnc(-c4ccccc4)o3)cc2)C1 749176784 UXHIDSBJYKJQNQ-LJQANCHMSA-N 448.527 2.480 10 20 IECD CS(=O)(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 749554542 RUJMZUXFFZHTEQ-UHFFFAOYSA-N 435.521 2.206 10 20 IECD CN(CC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1)c1ccc2c(c1)OCO2 756654110 FGVJPCGTDFKFAO-UHFFFAOYSA-N 445.541 2.343 10 20 IECD COc1cc(N2CCN([C@@H]3CC(=O)N(c4ccc(C)cc4)C3=O)CC2)cc(OC)c1OC 758818271 DFPUOAQJASSKGI-LJQANCHMSA-N 439.512 2.475 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)cc(OC)c1OC 759103490 SBBUATNLOATXKN-UHFFFAOYSA-N 434.514 2.426 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cc(F)ccc3C)CC2)cc(OC)c1OC 759411220 DENUDIWNTIIUED-UHFFFAOYSA-N 431.464 2.447 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@@](=O)C1 762550572 ZGQFUUVYLGUYFK-MZHQLVBMSA-N 428.557 2.095 10 20 IECD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 763280056 PYXKABAXDUPLIF-WMLDXEAASA-N 438.571 2.245 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)nc1Cl 764527042 NKAVSBUGGHLIFS-UHFFFAOYSA-N 447.951 2.369 10 20 IECD CC[C@]1(C(C)C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 768517803 VCQRPBKVJTUOMD-PBPSECFOSA-N 448.539 2.412 10 20 IECD CC(C)(C)n1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 769021393 IFZDXEBSESRMGE-UHFFFAOYSA-N 438.576 2.425 10 20 IECD C[C@@H](NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 775256318 WKRKCHQDOCHQQJ-QGZVFWFLSA-N 446.573 2.063 10 20 IECD COC(=O)[C@@H]1C[C@H](C)CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 775805458 BYIDNSNESOXKLO-JJDSTIRJSA-N 435.540 2.329 10 20 IECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H](C)C1=O 778262618 LSLYPVMOORTINY-FHWLQOOXSA-N 448.583 2.244 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)ccc21 778603925 HGWOCCJDEXNORT-AWEZNQCLSA-N 441.484 2.142 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)c(C)cc3F)c2)CC1 780406989 BNJXUKQBUXBGTL-UHFFFAOYSA-N 435.477 2.302 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nnc4n3CCC4)cc2Cl)C1 785933359 OIYSBJBSAUSTBF-AWEZNQCLSA-N 430.940 2.047 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3nc(-c4ccccn4)no3)cc2)CC1 786259884 RSNUZJOYINUQAB-UHFFFAOYSA-N 434.500 2.049 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccnc(-n4cccn4)c3)cc2)CC1 787239586 ATCJVQSDNZHGTI-UHFFFAOYSA-N 432.528 2.436 10 20 IECD C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812576 MMRVSEBMEVQYGY-HIFRSBDPSA-N 431.430 2.468 10 20 IECD Cc1ncc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789822097 VRGPKONTQASQPY-ZIAGYGMSSA-N 434.537 2.179 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1 789863035 LUVLNGBNBPTIEO-UHFFFAOYSA-N 435.546 2.097 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCCC4(CCCC4)C3)cc2)C1 793727160 WBJZAURXCDITAA-IBGZPJMESA-N 426.561 2.187 10 20 IECD Cc1cnn(C)c1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795964893 VLHCHISRLXBHOG-QGZVFWFLSA-N 437.566 2.339 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(O[C@@H]2CCOC2)c1 803685431 GTLKXVLTNIWJHX-OAQYLSRUSA-N 437.540 2.478 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)CC2)cc1 804317164 URFTYIPRZLLASM-UHFFFAOYSA-N 448.564 2.106 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4ccccc4F)CC3)CC2)cc1 804318209 CYNYVTWOGWZEFM-UHFFFAOYSA-N 440.519 2.268 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 805067652 YGJPYSKUMWCERM-HNNXBMFYSA-N 425.576 2.480 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 806282375 WVGBQDZBAWSAAM-UHFFFAOYSA-N 439.994 2.134 10 20 IECD CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512784 JHSZOJHTFODCNF-UHFFFAOYSA-N 439.299 2.454 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(CCO)C3CCOCC3)cc2Cl)C1 807957096 WPEBLTRNLZMQDP-MRXNPFEDSA-N 437.968 2.192 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C[C@H](C)O)c3ccccc3)CC2)cc1 809460196 STUJBIJBHGTYOE-PZJWPPBQSA-N 439.556 2.405 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H](NC(C)=O)c3cccs3)CC2)cc1 829377807 XHOMRHAFTACGLT-IBGZPJMESA-N 445.541 2.216 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 917911144 BQTYBUSYUVZZLU-UHFFFAOYSA-N 440.612 2.430 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cc3Cl)cc2)C1 918464431 VSGAAXJZFTZNOR-AWEZNQCLSA-N 432.883 2.436 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(S(=O)(=O)N2CCCC2)o1 919969781 HEQZEZFLAOJREP-UHFFFAOYSA-N 447.557 2.203 10 20 IECD C[C@H](NC(=O)Nc1ccccc1CN1C(=O)CNC1=O)c1ccc(N2CCOCC2)cc1 920871282 HEXCRHXAFGADQX-INIZCTEOSA-N 437.500 2.458 10 20 IECD Cn1cnc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc(O)c(O)c4O)CCC3)cc2)n1 1787252636 LLQTWCCFUQGEHC-ONNFQVAWSA-N 449.467 2.393 10 20 IECD NC(=O)c1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1800519314 WXCVAPPKNBNFJB-BTTYYORXSA-N 443.887 2.416 10 20 IECD Cn1cncc1C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1808534073 KYZYYDNIDFRWFV-UHFFFAOYSA-N 448.527 2.058 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)CCc3ccc[nH]3)C2)CC1 1810049307 KROQHBOLOJIKNM-UHFFFAOYSA-N 448.614 2.039 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@H](O)C3)sc2C1)c1cc(O)c(O)c(Cl)c1 1818664294 DIJIVTVQYVARBP-IEBDPFPHSA-N 437.905 2.204 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc(Cl)ncn1 1819978975 IYNYQCHPJSPJGM-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)c2cc[nH]n2)CC1 1824669102 JVDBPAXAQNSVJD-OAQYLSRUSA-N 448.527 2.436 10 20 IECD CCC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825157180 QJVZSUSGCRRCAU-SNVBAGLBSA-N 440.616 2.352 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832308226 JDXDJVRRBJIIMH-BEFAXECRSA-N 441.532 2.492 10 20 IECD CC(C)N[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)C(C)C 1842998287 ZFLRTYADZDDAMM-OAQYLSRUSA-N 439.560 2.005 10 20 IECD COc1nc(C)ccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844544348 XLWUAKFZHWGTCQ-RMKNXTFCSA-N 439.468 2.046 10 20 IECD CC(=O)N1CCC[C@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 10703982 VMFZNCJJLRIKSC-HNNXBMFYSA-N 434.448 2.202 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)n(C)c2ccccc12 572435696 YNWALYBLHFXHRS-ROUUACIJSA-N 440.588 2.451 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 585675423 UYEGDNBLKGWNHI-SYNMBVLASA-N 437.540 2.067 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)cc1C(=O)O 727720838 ZBKUCUCZCPUFKJ-UHFFFAOYSA-N 428.488 2.346 10 20 IECD CCCCn1c(N)c(N(C(=O)CN(C)Cc2ccccc2O)C2CCCC2)c(O)nc1=O 731843491 KKMCONVNCUBHGX-UHFFFAOYSA-N 443.548 2.444 10 20 IECD O=C(NC[C@H]1CCCO1)c1c(NS(=O)(=O)C[C@@H]2CCCO2)sc2c1CCCC2 735646298 OTVJGIJHQUTFFM-KGLIPLIRSA-N 428.576 2.456 10 20 IECD Cn1nc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1C1CC1 741908750 AMSZXOCTADZQDH-UHFFFAOYSA-N 435.507 2.483 10 20 IECD CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C1 743893260 SIAGILCWTBOOJQ-HXUWFJFHSA-N 438.528 2.156 10 20 IECD O=C(COc1ccc(N2CCCC2)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 749792220 ZFYKAPBBGFBFEG-UHFFFAOYSA-N 445.541 2.325 10 20 IECD COC(=O)c1c(C)cccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751238976 GQBHXDCOSRGCDA-UHFFFAOYSA-N 432.542 2.469 10 20 IECD CC[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOCC1 752954586 GNPLBTYGLKRMQJ-SFHVURJKSA-N 440.491 2.193 10 20 IECD COc1ccc(N2CCN(CCCNc3cc(N4CCCC[C@@H]4CO)ncn3)CC2)cc1 753551020 MCZLEBPAHOAGSQ-OAQYLSRUSA-N 440.592 2.461 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1F 754209558 AOTQASTWMPRLMT-UHFFFAOYSA-N 449.454 2.286 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)[C@H]3CCCN(C4CCC4)C3)CC2)cc1 754462285 DMSGPAXFLCCUMU-AWRGLXIESA-N 430.637 2.421 10 20 IECD CC(C)(C)OC(=O)NCC(C)(C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 756912971 AGYPYCZKTNHZIQ-UHFFFAOYSA-N 439.578 2.089 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H]3COc4cc(OC)ccc43)CC2)cc1 760614173 OAGJQHIDPQBKIX-QGZVFWFLSA-N 440.496 2.462 10 20 IECD CCN(CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S)CC1CC1 764248674 ORGHMWOMJGGWOK-ZDLGFXPLSA-N 447.582 2.465 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773992645 DMZIDTMJWRGSCO-HNNXBMFYSA-N 432.546 2.257 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 779478107 FMGMIZIQCIITMJ-LNENJAERSA-N 426.469 2.101 10 20 IECD CNC(=O)[C@H]1CN(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCO1 782096696 DVVVHPQXURSJNY-LJQANCHMSA-N 434.334 2.486 10 20 IECD O=C(CN1CCCN(c2ncccc2F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 784405121 GCUNPAYXRNJHLO-UHFFFAOYSA-N 445.514 2.025 10 20 IECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 784702246 GGRWFMQOBAVHIU-UHFFFAOYSA-N 427.505 2.088 10 20 IECD Cc1cnccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 786035112 JGKBFBPUBICAGM-UHFFFAOYSA-N 427.482 2.485 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCOc3ccccc3[N+](=O)[O-])cc2)CC1 786262057 ILWGGQYKYURLJG-UHFFFAOYSA-N 426.473 2.349 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 786293862 YYUJCLZVWLZLKK-QGZVFWFLSA-N 439.512 2.445 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc(N(C)C)c3)cc2F)C[C@@H](C)O1 786897507 HPVNTFZWJUVNGY-CALCHBBNSA-N 442.535 2.438 10 20 IECD COc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1OC 787021445 ZXFYXJHPTUOBIZ-INIZCTEOSA-N 427.501 2.034 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1N1CCNC1=O 787575070 DYWIYACLCHRXGH-UHFFFAOYSA-N 447.289 2.248 10 20 IECD CCc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1 788312012 ALJQGDVXISLGJJ-UHFFFAOYSA-N 436.556 2.051 10 20 IECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860958 OONQGUCWAKPCNP-GOSISDBHSA-N 438.597 2.423 10 20 IECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)O2 789861065 PLGRLSUODFCRHO-GTPZEUEISA-N 447.601 2.294 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3CCC(NC(=O)C4CC4)CC3)cc2)CC1 793923020 GGRCLVQDXZZQQT-UHFFFAOYSA-N 426.561 2.056 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCC[C@@H](C(C)C)C3)CC2)cc1 803751761 WLJFVLIIIOWESD-UXHICEINSA-N 430.593 2.264 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cnccc3C)CC2)cc1F 804851934 TVGYMINDWRXMKW-UHFFFAOYSA-N 427.524 2.340 10 20 IECD Cc1nc(CN2CCC(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)oc1C 805529396 CHXWDSQFMALJCE-UHFFFAOYSA-N 441.576 2.344 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1 806282880 XFJJWFAWZOVWII-KGLIPLIRSA-N 441.600 2.154 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC1CCN(C2CCCCC2)CC1 807669018 NYNZKOILOYXIFQ-UHFFFAOYSA-N 442.604 2.395 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1)c1ccc(N(C)C)cc1 807674542 MQYMVXQBQYEXGE-MRXNPFEDSA-N 442.947 2.454 10 20 IECD CO[C@]1(C)CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768700 OVRICLBMEFUZEH-QVKFZJNVSA-N 425.476 2.401 10 20 IECD COC[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808856772 ZKKUELMXGKWLPO-QFIPXVFZSA-N 442.604 2.110 10 20 IECD Cc1oc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N1CCCC1 916138639 RPBCIZXNWXYXRW-UHFFFAOYSA-N 447.557 2.481 10 20 IECD COc1cc(OC)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC 917833051 KUFKMIFWMMPTAD-MRXNPFEDSA-N 427.501 2.344 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCCO4)cc2F)C[C@@H](C)O1 918286270 GIAZEZLIFRUOOV-HUUCEWRRSA-N 443.475 2.465 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 1346108932 GNHBLJQARJMFMM-GCJKJVERSA-N 438.572 2.414 10 20 IECD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)n1cccc1 1782009295 VLWIODOKAOGLGR-SZNDQCEHSA-N 433.892 2.257 10 20 IECD CC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803007166 VARXVLIPWLAZEV-QANKJYHBSA-N 433.892 2.237 10 20 IECD CC[C@H](NC)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807348093 DOWZXUILQGVBJN-DKSSEZFCSA-N 446.935 2.464 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C[C@H]2CCCCO2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994097 RMZSIUIQLOECKA-CECAUBDESA-N 440.500 2.167 10 20 IECD Cc1onc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1C 1807994418 WUOCXNPNBHMNHN-FOIQADDNSA-N 437.456 2.126 10 20 IECD CC[C@H](NC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815315926 HPQYUQBEBAQMMO-PWSUYJOCSA-N 438.937 2.432 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]cc3c1CCC3)CC2)c1cc(O)nc(O)c1 1816727307 NDCXFIOGAOBPQN-GFCCVEGCSA-N 439.497 2.306 10 20 IECD O=C(c1ccc[nH]1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901908 VSEJUQGASHWLDT-MRXNPFEDSA-N 434.587 2.108 10 20 IECD Cc1cc(C)nc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843441732 BIKKBOITWLXCLI-UHFFFAOYSA-N 431.496 2.308 10 20 IECD C[C@H](Cc1ccccn1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442191 FVFVQZKULCUQSL-GOSISDBHSA-N 445.523 2.257 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)cc2Cl)C1 1846299743 UKSKQTLWAMPBMS-HWKANZROSA-N 429.860 2.382 10 20 IECD Cc1nn(C)c(C)c1CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846615214 SUNYYJCMWYFXQM-UHFFFAOYSA-N 432.908 2.161 10 20 IECD Cc1ncc(/C=C/C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1846678123 PGKFQYXMGPUJQL-CMDGGOBGSA-N 449.536 2.461 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4ccc(C(N)=O)cn4)CC3)ccc21 490147509 CDJLNLAADRELMS-UHFFFAOYSA-N 435.528 2.361 10 20 IECD CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 730074351 BIYMXMRLLLHYRC-HKUYNNGSSA-N 446.617 2.342 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1NS(C)(=O)=O 733648481 SNQGTYPXVQMAQI-MRXNPFEDSA-N 432.546 2.455 10 20 IECD CC(=O)NCc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 733662205 UDLUFVSYDGFDHG-FQEVSTJZSA-N 425.485 2.175 10 20 IECD Cn1cc(N2CC[C@H](NC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C2=O)cn1 735579330 DKEMZOBZMGDJQE-SFHVURJKSA-N 448.474 2.095 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(Cl)ccc3F)CC2)cc1 743433029 VHYWVMDAUXWDEQ-UHFFFAOYSA-N 434.899 2.365 10 20 IECD CN(CC(C)(C)CN1CCOCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 752652193 YVQJCPGXTGHZOC-UHFFFAOYSA-N 436.572 2.287 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](Cn3cccn3)c3ccccc3)CC2)cc1 754068847 SITQCKBQCAEFHH-UKILVPOCSA-N 435.572 2.406 10 20 IECD C[C@@H](OC(=O)c1cccc(=O)n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 757750793 YPUMKHUODUNVPS-CYBMUJFWSA-N 430.416 2.345 10 20 IECD Nc1nc(C2CC2)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 758536044 LBLVRKOVMFOEDE-UHFFFAOYSA-N 434.493 2.052 10 20 IECD Cc1nc([C@@H]2CCCN(CC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C2)n[nH]1 760960129 NCAFWGCFNDTCQC-JTDSTZFVSA-N 444.555 2.362 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC4CC4)c3)cc2F)C[C@H](C)O1 762413524 CXHVVSZNCHCCFS-GJZGRUSLSA-N 429.496 2.301 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)cc2)C1 765886907 VWKHHHDRGHRXOV-NQIIRXRSSA-N 441.576 2.121 10 20 IECD CCc1nn(C)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 771161771 OPUJHYAOWJICQO-GJZGRUSLSA-N 432.496 2.208 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773844148 CLOSCISDKZPPPC-ZDUSSCGKSA-N 425.518 2.266 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@@H](CN3CCCC3=O)c3ccccc3)CC2)cc1 774913736 MBOOVBBPZYVWIY-QHCPKHFHSA-N 436.556 2.297 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 774961639 HHOMEBUBQCTVHI-HSZRJFAPSA-N 436.556 2.093 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c3nccc(Cl)c23)cc1C(=O)O 776503335 BJQDGUTUYIQRPQ-UHFFFAOYSA-N 444.878 2.087 10 20 IECD CCc1ccc([C@@H]2COCCN2C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)o1 779222462 OESPBDJZNCNELL-REWPJTCUSA-N 429.561 2.407 10 20 IECD CCc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1S(C)(=O)=O 786258222 AQCZUMVHSTXVDN-UHFFFAOYSA-N 443.569 2.251 10 20 IECD CC(C)(O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799000 KZWOPSOJDIQCJP-UHFFFAOYSA-N 443.519 2.078 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(CN(C)C)CCCC3)cc2F)C[C@@H](C)O1 789817790 IPYWAFFVAVCBPR-QZTJIDSGSA-N 448.583 2.294 10 20 IECD Cc1ccncc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822975 XMXYWSIGPLBZDZ-IRXDYDNUSA-N 428.508 2.418 10 20 IECD CCCC[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734116 PYSVKUZYANLALE-SFHLNBCPSA-N 428.577 2.480 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1OC 793915479 WBZPESSXJCNXOY-UHFFFAOYSA-N 429.517 2.096 10 20 IECD COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c(O)c1 794387920 OONWBZNCSDOVDT-HUUCEWRRSA-N 434.514 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cncnc3)cc2F)C[C@@H](C)O1 796166089 RHMKYHVBLDQAMS-IYBDPMFKSA-N 430.480 2.022 10 20 IECD Cc1nccnc1N1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 799325326 AAAVADDFEULJDN-UHFFFAOYSA-N 441.491 2.321 10 20 IECD COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1C 801370507 PKSKYXXZNLSAQQ-OAHLLOKOSA-N 433.486 2.004 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)cc1F 803663250 UWEPWCPYAJAWAV-QFIPXVFZSA-N 436.528 2.271 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)ccc21 803687781 GYHQAIZRMCHMKE-SFHVURJKSA-N 430.549 2.153 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(Br)c2O)cc1C 811459784 NXUUBUHYEJFWNQ-UHFFFAOYSA-N 427.320 2.366 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(Cl)nn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815435543 WTEHDRKAUHDBRQ-UHFFFAOYSA-N 448.888 2.225 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 917715648 SIYQWKVBGMARAE-NFAWXSAZSA-N 431.430 2.466 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN(C(=O)c2ccoc2)CC1 918201284 ANQJTYTXUZRGNK-UHFFFAOYSA-N 430.480 2.359 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 918295253 CBGBWKIMANZCIS-FQEVSTJZSA-N 437.496 2.448 10 20 IECD CC(C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803238578 ORPIMZGYMWYPJY-KYNGSXCRSA-N 447.919 2.483 10 20 IECD O=C(/C=C/C1CC1)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1814906265 GJCSZRMQWPHMFX-PSKZRQQASA-N 433.559 2.228 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(Cl)n2)[nH]n1)c1cc(O)nc(O)c1 1817846260 OBCAPBBNRNEOIX-CYBMUJFWSA-N 443.851 2.279 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2nccc2c1 1819209181 NHAKXRJAMKAXCX-KRWDZBQOSA-N 447.455 2.483 10 20 IECD CCOC(=O)c1cnn2c(C(=O)Nc3c(C4=S=CC=C4)nc4ccccn34)ccnc12 576670360 QKINLQUSHGSXCR-UHFFFAOYSA-N 432.465 2.432 10 20 IECD COc1ccc(Cl)cc1NCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 727102189 WHPQPMRLJCFTTM-UHFFFAOYSA-N 437.949 2.312 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCN(c2ccccc2Cl)C1=O 732293378 HRXPJEFIOAULQI-INIZCTEOSA-N 437.905 2.295 10 20 IECD CC(C)[C@](C)(O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732886762 VNYLFJSQBRAJEH-JOCHJYFZSA-N 430.528 2.149 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnnn1-c1ccc2c(c1)OCO2 734979600 ABZXPQVQTSVAEH-UHFFFAOYSA-N 426.502 2.208 10 20 IECD COCCNC(=O)CN1CCN(CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)CC1 741602290 CCUQJOYQHFNXOB-UHFFFAOYSA-N 444.551 2.105 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3CCCN3C(=O)OC(C)(C)C)nc12 745453326 KBALOBSGZWYZMP-AWEZNQCLSA-N 448.476 2.444 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccnn3Cc3ccccn3)CC2)cc1 746390920 KUITZKUJZAVEFU-UHFFFAOYSA-N 434.500 2.059 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cn(CC(C)C)cn3)CC2)cc1 749285709 ONPDQNSGWGVYEZ-UHFFFAOYSA-N 435.594 2.038 10 20 IECD CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CN(C)c2ccc(OC)cc2OC)C1=O 752111101 LNWBTQYCKIXJTE-JOCHJYFZSA-N 426.473 2.029 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)CC2)cc1 754127443 JCYZRJCCMFIRKS-BHDDXSALSA-N 428.577 2.464 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnnn3-c3cccc(C)c3)CC2)cc1 758198936 YYJQMCHVLGWJST-FQEVSTJZSA-N 440.573 2.255 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(C)c3C(F)F)cc2F)C[C@@H](C)O1 758965161 ITCXZAYTBIMLCO-TXEJJXNPSA-N 439.438 2.365 10 20 IECD COc1ncc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C(N)=O 762226704 XJGVUSWTHHXAGG-STQMWFEESA-N 431.468 2.264 10 20 IECD CN(CCCNC(=O)CNc1ccc(Cl)cc1C(=O)c1ccccc1)S(C)(=O)=O 762776608 NLIPZZMOIQJALJ-UHFFFAOYSA-N 437.949 2.381 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCS[C@@H]4COCC[C@H]43)cc2F)C[C@@H](C)O1 767904465 DUXZKIVKONFRIX-IMAQQZIHSA-N 437.581 2.262 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3cccc(-c4nnnn4C)c3)c2)CC1 768017601 PZWDGAQIADXYHQ-UHFFFAOYSA-N 441.561 2.208 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO 769042495 UZMVYGRNLJGEIG-LADGPHEKSA-N 438.572 2.205 10 20 IECD CNS(=O)(=O)C1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775692939 QTYGGQMCMMHGHW-UHFFFAOYSA-N 442.173 2.431 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc4c(c3)CCO4)CC2)cc1 778278226 WJDPNQNLIZEPJZ-CMDGGOBGSA-N 435.524 2.194 10 20 IECD C[C@H]1CCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 783918121 DKZJIDNJNKFZDR-AWEZNQCLSA-N 448.501 2.315 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@@H](C)CCC[C@@H]3C)CC2)cc1 785531334 UWKWZZCDIWFECD-PMACEKPBSA-N 430.593 2.361 10 20 IECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786659127 IRAZQLXMXJYXMH-GCJKJVERSA-N 443.592 2.191 10 20 IECD COc1c([N+](=O)[O-])ccc(CNC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 789776022 WKMDJYYNTUSEFR-QGZVFWFLSA-N 447.463 2.255 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1cccc(F)c1 789798878 FHFHCTPZJDRNND-SFHVURJKSA-N 447.482 2.391 10 20 IECD COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)c(O)c1 794383945 ULECZJWLYASAMD-UHFFFAOYSA-N 443.319 2.344 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1)c1ccc(N2CCOCC2)cc1 803303177 ISJBHAZIFCFVPC-ZVDOUQERSA-N 442.604 2.470 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CCN1CC(C)(C)O 803677103 FWZGJHQFAHMROG-IBGZPJMESA-N 444.620 2.375 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1F 804852486 AZYUEIXWICZATJ-DGGJZMOXSA-N 435.540 2.473 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCN(C(=O)C4CCCC4)C3)cc2)CC1 805025793 UJTKQBDZFLEKMB-OAQYLSRUSA-N 440.588 2.446 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 807674259 JEHRNBPCPLESOY-MRXNPFEDSA-N 440.519 2.490 10 20 IECD COc1c([N+](=O)[O-])cc(N2C[C@H](C)S(=O)(=O)[C@H](C)C2)c([N+](=O)[O-])c1Br 811865547 FPNDVAINJJVRTB-OCAPTIKFSA-N 438.256 2.286 10 20 IECD COC(=O)C1(CS(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CCCCC1 813680139 LMWLNUDZAAXDFA-UHFFFAOYSA-N 428.526 2.410 10 20 IECD Cn1ncc(I)c1C(=O)NCc1cccc(Br)c1O 816496782 WWRCSHJEZDGWNI-UHFFFAOYSA-N 436.047 2.423 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC4(CCOCC4)[C@H]3C3CC3)CC2)cc1 818781706 KRSWTJGVESWHEF-XXXZYALBSA-N 439.556 2.318 10 20 IECD Cc1cc(C(=O)O[C@H](C(=O)N2CCC[C@@H](C(N)=O)C2)C(C)C)c(C)n1-c1ccccn1 914903372 LTARHHUQPPJHJY-XLIONFOSSA-N 426.517 2.394 10 20 IECD C[C@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccc(S(N)(=O)=O)c1 916197513 VVYYOCYBUQTMNV-YJBOKZPZSA-N 433.530 2.491 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3=NN(Cc4ccccc4)C(=O)CC3)cc2)C1 917836185 KKNAWDRVMMUSJR-FQEVSTJZSA-N 447.539 2.183 10 20 IECD CCNC(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 918458020 ZZVCUOXYZTXMIS-UHFFFAOYSA-N 438.528 2.397 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 919729975 JEIIAGRYLDLGSP-UHFFFAOYSA-N 444.962 2.059 10 20 IECD O=C(Cn1nc2n(c1=O)CCCCC2)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1318216587 KUWXEXLQAJNVSB-UHFFFAOYSA-N 435.475 2.158 10 20 IECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)cn1 1340912119 QTMYFOVHFVOMFG-UHFFFAOYSA-N 435.531 2.090 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cn1 1796240696 QDKVJYVISHQEOZ-DDFRPRHYSA-N 441.459 2.232 10 20 IECD C[Si](C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)co1 1796600738 HTOYMXYTWZRVRX-MUJYYYPQSA-N 429.549 2.197 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H]1CCOC1 1803354264 QDJXEEQYLSLFGP-DPKIQTSOSA-N 430.501 2.272 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289260 ADBZWVNNMSIJOF-HZVDOMFNSA-N 448.472 2.016 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844538 CJDTZBUIAZZVHI-UZLBHIALSA-N 437.456 2.255 10 20 IECD Cc1c(F)ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1N 1842990414 GBECJYCWZGBPGE-XBXARRHUSA-N 441.459 2.364 10 20 IECD O=C(CC[C@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249736 RYBRBHXFGVXFQU-MRXNPFEDSA-N 436.512 2.374 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(CCCN3CCOCC3)CC2)n(C)c2ccccc12 572315288 GZLJRHMJJAXHMZ-UHFFFAOYSA-N 440.588 2.454 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1 726627895 PDYQWBRQXKEUEQ-UHFFFAOYSA-N 427.501 2.227 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 732053779 FISJZXYWGRSYQJ-QHCPKHFHSA-N 442.604 2.349 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn4nccc4c3=O)c2C)cc1 732864976 WAQDTTMDPOTPBE-UHFFFAOYSA-N 449.467 2.123 10 20 IECD O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NCCCSc1nccs1 733974724 LSLVMDJOVPNWHL-UHFFFAOYSA-N 428.557 2.377 10 20 IECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)cc1 739924258 OWPWFCZWPJXRBL-UHFFFAOYSA-N 435.521 2.194 10 20 IECD COCCNC(=O)CN1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 741602819 IYXCKNZLXYENGK-UHFFFAOYSA-N 438.532 2.421 10 20 IECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749556143 XECIKFAQXJIOHM-KKIUXKEOSA-N 442.585 2.467 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc4c3O[C@H](C)C(=O)N4)CC2)cc(OC)c1OC 759223978 YBMWAMPQNCWNSF-CQSZACIVSA-N 441.484 2.394 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3CCCO[C@@H](C)C3)CC2)cc1 764116703 PMTHAWMQZQXUIE-NRFANRHFSA-N 447.624 2.007 10 20 IECD O=C(CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)NCC(F)(F)F 764579524 RJZVGCLESCDWOQ-UHFFFAOYSA-N 448.353 2.012 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1Cl 765930796 KGCGPVTUMIVUEX-UHFFFAOYSA-N 440.681 2.423 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1OC 766320296 PRRJGEGNDRPJJN-UHFFFAOYSA-N 443.503 2.349 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 768511431 IXXDUOKSDHQUJP-HZPDHXFCSA-N 440.479 2.110 10 20 IECD COc1cccc(C)c1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 773508523 FFCTXNXPEVDHCZ-UHFFFAOYSA-N 443.500 2.317 10 20 IECD Cc1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)o1 774103463 FWHVWBIICRLLCM-UHFFFAOYSA-N 439.447 2.276 10 20 IECD CCOC(=O)N1CCC(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 775015386 VDACOAFKNOOJPB-UHFFFAOYSA-N 429.473 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](C)[C@@H](n4ccnc4)C3)CC2)cc1 778327318 WOIRZWCXHWXEEP-JTGUCPBQSA-N 437.544 2.206 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1 779581763 ABDMWGCHKMAKNZ-KRWDZBQOSA-N 437.587 2.422 10 20 IECD COc1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1OCC(N)=O 784109898 ZHTCPPKORNVOIY-UHFFFAOYSA-N 440.500 2.303 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3CCOC)cc2F)CC1 786305615 GSCLWGWZTYWZDF-UHFFFAOYSA-N 442.535 2.411 10 20 IECD CC(C)Oc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787989133 PHYYWQOXSFDPKJ-IBGZPJMESA-N 427.501 2.398 10 20 IECD COCCOc1cccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 787994551 PDPAKYAKJZDEQJ-UHFFFAOYSA-N 441.528 2.076 10 20 IECD CCc1cc(N2CCC(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)ncn1 788929040 FYOMTLKUFYAPCQ-UHFFFAOYSA-N 436.560 2.041 10 20 IECD COc1nc(Br)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 789561102 PGXGUULCQQWVLV-UHFFFAOYSA-N 425.258 2.313 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@@H]1CCc2ccccc2C1 789841466 YWGZEVCAAQBHEV-QGZVFWFLSA-N 439.531 2.324 10 20 IECD CC(C)n1cc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 789842239 CGWHTUMBHRTXLU-HNNXBMFYSA-N 431.512 2.058 10 20 IECD Cc1cnc([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 789848052 YERSXQOQNLLQOQ-CYBMUJFWSA-N 434.537 2.088 10 20 IECD COCCCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789862942 YTCHJMOPBGVCEN-UHFFFAOYSA-N 442.585 2.316 10 20 IECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 789877813 IHYXMEBDLASPJV-UHFFFAOYSA-N 449.502 2.082 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1 797745190 XPMFRYUSJHQPQF-YEJXKQKISA-N 434.514 2.033 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@H]3CCc4ccccc43)CC2)cc1 803747504 RPZKZYLEYJGHQU-QHCPKHFHSA-N 436.556 2.079 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3cnn(C(C)C)c3)cc2F)CC1 805009117 GXXZEPLYKKGAMW-KRWDZBQOSA-N 444.555 2.239 10 20 IECD C[C@H]1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 807972690 UCYSMIKLQXDSPN-VQTJNVASSA-N 442.604 2.156 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 808569151 ZLANJBDKESZJDN-LJQANCHMSA-N 442.466 2.103 10 20 IECD CCCc1nnc(SCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1N 813464598 FUPZRGPNZDSAAX-CYBMUJFWSA-N 440.520 2.423 10 20 IECD C[C@H](OC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(N)=O 913364034 VSEJISZLVYKZSM-KIFNTFBYSA-N 429.317 2.067 10 20 IECD Cc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2C)cc1 918337803 OIOMDYBZDAKSCM-UHFFFAOYSA-N 439.541 2.049 10 20 IECD COCCOc1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920924747 FDHGVQKMWGOCJI-QGZVFWFLSA-N 427.501 2.364 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1 1342434202 JKPXKVGAXIJZTQ-HNNXBMFYSA-N 447.875 2.185 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)C3CC4(CCC4)C3)C2)C1 1784847800 XHTGOCYNDXEZKC-ISTCRNMPSA-N 442.512 2.227 10 20 IECD CCN(C)[C@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792315766 ANALYKDPKGIRJK-CQSZACIVSA-N 448.614 2.321 10 20 IECD Cc1cc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)no1 1796934744 RDQOAFXSNMDKLU-IXYPHHJPSA-N 447.495 2.427 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)ccc1C 1799723456 SXCUWRSEUUKBLA-MUJYYYPQSA-N 447.582 2.116 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990236 GZMHFEQSJPAESI-GAJHUEQPSA-N 448.479 2.286 10 20 IECD Cc1[nH]ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902794 VZUONRSGZLSBKT-KRWDZBQOSA-N 448.614 2.417 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)CC2)cc1 110354584 NHGRLLJLPIWREM-UHFFFAOYSA-N 440.456 2.114 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 729523916 YHRQIYCIOJHYQB-UHFFFAOYSA-N 448.527 2.015 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(C(=O)OC)s3)cc2F)CC1 730268824 HXGXAPLYZHGWQY-UHFFFAOYSA-N 441.550 2.294 10 20 IECD CC[C@H](C)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)NCCN1CCOCC1 732155933 GMRPNJUNSJXOII-HTAPYJJXSA-N 441.576 2.082 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(OC)c(C)c3C)CC2)cc1 735315532 UJUSNDYUJLTMKN-UHFFFAOYSA-N 433.574 2.421 10 20 IECD CC(C)Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n(C)n1 737131013 JRGYTUFLCXJTPA-UHFFFAOYSA-N 427.549 2.082 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C 737209548 SDVQNECDNBCCGM-UHFFFAOYSA-N 438.528 2.097 10 20 IECD 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CC1(CO)CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 762682530 BALHPNVGJHUVDW-UHFFFAOYSA-N 449.485 2.336 10 20 IECD Cc1cc(C(=O)CN2CCS(=O)(=O)C[C@@H](C)C2)c(C)n1-c1ccc2c(c1)OCCO2 763899284 QYWXCMNYFJWGQB-HNNXBMFYSA-N 432.542 2.415 10 20 IECD CC[C@@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](O)C(F)(F)F 766244218 RSJBEKBJLQBYPC-QZTJIDSGSA-N 432.487 2.208 10 20 IECD COC(=O)[C@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(C)c1 767879711 BGBNRRFNIYNHAN-NZQKXSOJSA-N 445.535 2.130 10 20 IECD CC(C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccnc2)no1 769749469 NQCYDBVDZKOONM-INIZCTEOSA-N 431.474 2.336 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)NC(=O)C(C)(C)C)n3)CC2)cc1 771065348 FBQQDMWWIDBPQI-OAHLLOKOSA-N 429.521 2.193 10 20 IECD CCc1nn(C)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 771161769 OPUJHYAOWJICQO-GASCZTMLSA-N 432.496 2.208 10 20 IECD COc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nc1I 773766520 OGHAJJMTTGPRKT-VIFPVBQESA-N 428.226 2.467 10 20 IECD 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CC(C)(F)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126447 WNANXMLNMCDWDV-WZONZLPQSA-N 444.507 2.041 10 20 IECD O=C(C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccc1 1782005011 SQGFIKBMLKPJSP-JOCHJYFZSA-N 444.871 2.078 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnc[nH]2)cc1 1794714406 IASKLMYYYKUROF-HATOLVCRSA-N 433.512 2.334 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)n[nH]1 1796417921 AHPGSEUKXJKORW-SEDYWJOHSA-N 426.473 2.054 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnc2c(Cl)cccn12 1796600633 WRNVZNKRWLOSGT-BTTYYORXSA-N 441.875 2.360 10 20 IECD Cc1cc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)no1 1798516388 HSCIJIXTPIRULU-NCVWWPNMSA-N 439.468 2.465 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc(O)nc(O)c1 1800715004 UBYRZKMMFOIRNX-CLLJXQQHSA-N 433.848 2.123 10 20 IECD Cc1cscc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802079980 BMGRPKWPERJDPF-VBUUTPMESA-N 444.509 2.090 10 20 IECD O=C(Cc1ccc(F)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285895 ZMEFYFFJTRRQAP-DDFRPRHYSA-N 441.459 2.232 10 20 IECD O=C(c1ccc2nccn2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551422 KPRUWQMQUPBNEO-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)CCC1 1814406100 KRKXCIOIQGJJMC-ZDUSSCGKSA-N 435.575 2.452 10 20 IECD COc1nccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1843114885 JHENOFRGVNSCIZ-UHFFFAOYSA-N 435.839 2.425 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cccc(C(F)(F)F)c3)cc2)CC1 726976467 LJLRRYRQVGBGFL-UHFFFAOYSA-N 448.488 2.419 10 20 IECD COCc1cccc(S(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1 727447368 YYDDDGQXNLVLGA-UHFFFAOYSA-N 433.574 2.332 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNS(=O)(=O)c1ccc(Cl)cc1 728302044 PEZBIESPGLFSND-UHFFFAOYSA-N 437.949 2.114 10 20 IECD CN(C)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 729600550 SIJDXXGUWGJHGP-LJQANCHMSA-N 441.555 2.178 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H](C)CS(C)(=O)=O 732993164 CFOPONBGFDIRGB-JYJNAYRXSA-N 429.558 2.404 10 20 IECD CC(C)(C)OC(=O)N1CC(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 746146306 DXBTWKCNQNRKPL-GOSISDBHSA-N 430.549 2.262 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](c4nc(C)no4)C3)CC2)cc1 746517497 UBOPHZGEBVAWGQ-SFHVURJKSA-N 428.537 2.098 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(-c2ccccc2F)c1 746835119 MILHLSHQBYNTRQ-UHFFFAOYSA-N 428.489 2.176 10 20 IECD CC(=O)c1cc(Cl)cc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)c1O 750047235 KUBMILMDZYNGIT-UHFFFAOYSA-N 431.924 2.197 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(OCCN(C)C)c3)CC2)cc1F 754215245 OJERYNGMIHJVLG-UHFFFAOYSA-N 444.507 2.062 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4ccncc34)cc2)C1 756159380 OCJPKHZOHMGGCO-GOSISDBHSA-N 431.496 2.191 10 20 IECD COc1ccc([C@H](CO)N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764351439 MNUSYVOQSBIZDU-KNQAVFIVSA-N 440.544 2.272 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2)CC1 769846803 DUDJLCIQFMRJEI-UHFFFAOYSA-N 435.462 2.446 10 20 IECD Cn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Cc1ccccc1 770234873 ADHCTGWIDDALLD-UHFFFAOYSA-N 438.553 2.176 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O 770641201 FCKIKIRXBVFNFY-UHFFFAOYSA-N 437.496 2.329 10 20 IECD C[C@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 773829084 ZBJIAVPLCVVZJK-STQMWFEESA-N 427.523 2.282 10 20 IECD COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN1CCOc2cc(N(C)C)ccc21 774753815 PYMLQDFRDAFMTK-HXUWFJFHSA-N 436.512 2.333 10 20 IECD Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)c(C)c1O 775291471 IAFSMKOTONBGTO-UHFFFAOYSA-N 440.543 2.139 10 20 IECD C[C@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N(C)C)cc1 776247882 XGZUCHVPIXRFBO-HNAYVOBHSA-N 426.517 2.437 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSCC(=O)Nc1cc(C)on1 777828968 RGOVSCAWHVTHFW-UHFFFAOYSA-N 441.893 2.216 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1F 785603285 STWBGBIPRAIKKJ-IBGZPJMESA-N 427.455 2.286 10 20 IECD Cc1cc(C(=O)COC(=O)CN2[C@@H](C)CC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785733247 OQFCWLGZLRZOEW-GASCZTMLSA-N 447.557 2.340 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCc3ccc4c(c3)CC(=O)N4)cc2)CC1 786655053 BWZGNZHVVHQFMP-UHFFFAOYSA-N 434.540 2.489 10 20 IECD CC(C)Oc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 786858172 NSDAUGMGAZJQRX-UHFFFAOYSA-N 429.492 2.382 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1OC 787299883 ZWVRYMWLXPANNL-UHFFFAOYSA-N 427.501 2.245 10 20 IECD CC(C)(C)Oc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 788311564 XCMMQDMSOFRHLD-UHFFFAOYSA-N 426.517 2.028 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCN(C2CCC2)C1 789813278 RNRFLPRSJRYOLJ-MJGOQNOKSA-N 446.567 2.048 10 20 IECD CCc1ccnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 789823313 ZZUCJMPGDAPEQT-IYBDPMFKSA-N 428.508 2.329 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1nnnn1C1CC1 790204187 LGDFGYIIZYEPRD-GFCCVEGCSA-N 439.442 2.424 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cccc(Cn2cccn2)c1 793812773 MYLDKXLKGUKTEI-UHFFFAOYSA-N 447.539 2.043 10 20 IECD O=C(NCCN1CC=CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794114634 HLJUISGWPKDQDW-UHFFFAOYSA-N 446.485 2.093 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](S(C)(=O)=O)CC3)cc2F)CC1 800705842 TYJILCNFUUJSOU-SFHVURJKSA-N 440.585 2.076 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304999 HCNRWOBDQFCKPE-MJGOQNOKSA-N 429.517 2.057 10 20 IECD C[C@H](NC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803308534 GKEGPAPKXPIDRF-SJORKVTESA-N 448.564 2.072 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1F 803661700 KJBQRMVRVZWUDX-UHFFFAOYSA-N 449.486 2.472 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1Oc1ccccc1 803665215 ZCPAALYRTHBTHL-NRSPTQNISA-N 429.492 2.249 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC4(CCOCC4)CC3)CC2)cc1 803673763 FDOLFLZRPZZJSL-SREVYHEPSA-N 427.545 2.319 10 20 IECD CCOC1CC2(CCN(C(=O)/C=C\C(=O)N3CCN(c4ccc(OC)cc4)CC3)C2)C1 804629678 FDPONYDWZYYSKP-HJWRWDBZSA-N 427.545 2.318 10 20 IECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCN(Cc2ccccc2)C1=O 806280602 GIEBCHFURWHDIT-INIZCTEOSA-N 432.571 2.001 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 807290823 AQOQHWPLFLWMTA-DEOSSOPVSA-N 448.567 2.086 10 20 IECD O=C(O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)Nc3cc(Cl)c(O)cc3F)cc2)C1 808115233 UGGSKHFMEHDUIV-VIFPVBQESA-N 428.825 2.423 10 20 IECD CC(=O)N1c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C[C@@H]1C 917918545 TXNINYNJPHUUHT-HNNXBMFYSA-N 447.532 2.438 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(CC(=O)O)ccc2OC)cc1C 919958015 OKBIYNPTNSYZAT-UHFFFAOYSA-N 442.515 2.193 10 20 IECD O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969543 PYTOAZPUZCGJNN-UHFFFAOYSA-N 427.398 2.284 10 20 IECD Cc1ccoc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1787565548 RYXALNWOKATARG-HTERZNMPSA-N 442.468 2.012 10 20 IECD CC(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1798959949 AIKINIBKKAWRJW-RMFSNUHRSA-N 425.485 2.133 10 20 IECD Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995181 DSWBAHVUFDUOME-KKSFZXQISA-N 433.468 2.225 10 20 IECD Cc1nn(C)c(C)c1CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502371 QAYIBOTYEKLWQV-UHFFFAOYSA-N 432.908 2.161 10 20 IECD Cc1nnnn1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 731131303 JTXNQNVGRSHHPH-UHFFFAOYSA-N 433.516 2.462 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)NC(=O)OC(C)(C)C)cc1 742754225 NZAZDHMTUXNJMW-INIZCTEOSA-N 432.481 2.240 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)C1 749178602 MJZLGBFQSSZIGZ-YADHBBJMSA-N 435.572 2.312 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755346768 SLJKJZZUWYBEDY-ZWKOTPCHSA-N 434.581 2.483 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 759592476 KXBJTGJMVBXQOO-ONNFQVAWSA-N 431.466 2.322 10 20 IECD CC1(C)C(=O)Nc2ccc(S(=O)(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc21 760317666 LYYYVZMZRXPXFD-UHFFFAOYSA-N 442.541 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3C[C@H](O)c3ccccc3)CC2)cc1 763431873 XENKSLXVQLJTMB-UPVQGACJSA-N 439.556 2.168 10 20 IECD CCC(CC)NC(=O)[C@H]1CN(S(=O)(=O)c2cccc3nonc23)c2ccccc2O1 765074209 CJCXANVQJHTERU-QGZVFWFLSA-N 430.486 2.484 10 20 IECD CCN1C[C@H](C)N(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@H]1C 766254804 RXGNXYPWLYNNGS-SJORKVTESA-N 432.590 2.339 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3ccnn3[C@H]3CCS(=O)(=O)C3)CC2)cc1 776060309 VOMANDUQAXHGIK-KRWDZBQOSA-N 433.534 2.042 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CCN(C)C)C(C)(C)C)CC2)cc1 778284508 NWGYOQUEVBAPAU-AXUYNXDZSA-N 430.593 2.383 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 778288321 XOEZBBCRBYUYLS-KUFMOJEASA-N 440.588 2.377 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@H](C)O)cc1 779501496 AJBSCADHHYMXGF-AVRDEDQJSA-N 445.585 2.329 10 20 IECD CCC1(CC)CCN(C(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785529097 LGFMJTDBNRLSBR-UHFFFAOYSA-N 430.593 2.362 10 20 IECD Cc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)c1C 788312867 NQCYDHPTJBYOIB-UHFFFAOYSA-N 436.556 2.105 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 788891844 KBXQKTHSRYGGPE-QGZVFWFLSA-N 448.564 2.074 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(O[C@H]2CCOC2)cc1 789900130 FUQPJRSYALIOFR-NRFANRHFSA-N 430.526 2.019 10 20 IECD C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735908 ZPJRCAWSPIQKGY-DHJUGAMNSA-N 448.567 2.444 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCCC[C@@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796145877 FMYMSJIQTBDBGZ-UZLBHIALSA-N 448.541 2.409 10 20 IECD NS(=O)(=O)Cc1cccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 800718162 BPZSZBDMRVMCCR-LJQANCHMSA-N 433.530 2.072 10 20 IECD Cn1ccnc1[C@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803451861 ZNPBBFXFFLJRSN-HNNXBMFYSA-N 447.486 2.123 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1)C1CCCCC1 803676602 ARPXVDXPENYDEF-FGZHOGPDSA-N 428.577 2.051 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(c4cccnc4)C3=O)cc2)CC1 805023410 GYYUGOJSSXPPDC-QFIPXVFZSA-N 449.555 2.246 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387028 VRNJMJCRWHDQAE-UHFFFAOYSA-N 438.253 2.251 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(S(N)(=O)=O)ccc1Br 808095053 PTDCCQWNEPCFKC-UHFFFAOYSA-N 434.308 2.218 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCCN1CCNC1=O 808500495 OILJWYPMYZHWIE-QBFSEMIESA-N 425.557 2.298 10 20 IECD COCC(=O)NC1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 917075634 LQJHMWWJKFQESS-UHFFFAOYSA-N 447.242 2.006 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1Cl 918461804 MLIFBIYTKUXEFH-UHFFFAOYSA-N 444.919 2.386 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)/C=C/c3cnn(C)c3)cc2F)C[C@@H](C)O1 918996619 FURXOWUBOLEWDX-LFZXJUCQSA-N 430.480 2.046 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 919860313 SHTHDEGFOZVYPH-UHFFFAOYSA-N 426.473 2.198 10 20 IECD CCCN(C(=O)[C@H](C)N1CCN(c2ccc(OCC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 1319847908 QMALKMDYXQTMDP-AZUAARDMSA-N 437.606 2.022 10 20 IECD CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1322140108 INOVVWWRUSYSRD-UHFFFAOYSA-N 430.528 2.252 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccsc1)CCO2 1785508781 LXTHAOZNMOZURI-ZZNNXKBLSA-N 430.482 2.022 10 20 IECD CCN(CC)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821673928 OQZVNCKMSNYPIQ-WMLDXEAASA-N 444.536 2.500 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824203933 RLNNXMZZPZIIEK-MOPGFXCFSA-N 430.549 2.210 10 20 IECD CC(C)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828249066 DNBHVRSNRKLEOE-ZXCPCRMDSA-N 438.600 2.128 10 20 IECD CCOC(=O)[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 15350505 VGPYEAHBZFCFSB-KRWDZBQOSA-N 447.557 2.199 10 20 IECD CO[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 728083008 SZBYMESOXANTPF-HNNXBMFYSA-N 435.458 2.352 10 20 IECD Cc1nc(-c2cnn(C)c2)sc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 734423977 ZKKJPLZQKSRWRY-UHFFFAOYSA-N 445.570 2.017 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F 737118361 SULHERHZUFNQCW-UHFFFAOYSA-N 437.479 2.389 10 20 IECD CCSc1cccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 737245303 HJOVUWGEFZMKDL-UHFFFAOYSA-N 447.582 2.288 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cccc(N4CCCS4(=O)=O)c3)c2)CC1 739766598 RZOUNIRTPJOGEJ-UHFFFAOYSA-N 442.541 2.181 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)NCC1CCN(S(=O)(=O)C(F)F)CC1 740916640 AJORKYBYGMUHMG-UHFFFAOYSA-N 428.505 2.126 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742805786 NYMIBFSTUBDITF-INIZCTEOSA-N 439.484 2.475 10 20 IECD COc1ccc(C[C@H](CO)CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1O 745778361 BCZQQTRKVAERIQ-MJGOQNOKSA-N 443.544 2.449 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@]4(CCc5ccccc54)C3)CC2)cc1 754071352 PXXVEVWZNOGTKT-OZXSUGGESA-N 437.584 2.352 10 20 IECD C[C@H]1Cc2cc(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)ccc2N1S(C)(=O)=O 759591220 GEADIDLJBJBPGJ-GBVBUYCNSA-N 431.466 2.248 10 20 IECD COc1cc(N2CCN(C(=O)NCC3(SC)CCOCC3)CC2)cc(OC)c1OC 760124887 XEJRGKXFUWSXJJ-UHFFFAOYSA-N 439.578 2.456 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(-n4cccc4)cc3)cc2)CC1 766042019 DIPLEKFUOIKHAL-UHFFFAOYSA-N 445.566 2.191 10 20 IECD CN(CC(=O)O)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 769449011 OWJAKMZAHYVKAL-WDZFZDKYSA-N 429.317 2.193 10 20 IECD COCCCOCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 775924714 NTIFVWQYAWPUKM-CQSZACIVSA-N 425.437 2.385 10 20 IECD CCc1noc(CC)c1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778317603 DFDANAPCJGTMLL-ZHACJKMWSA-N 426.517 2.329 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 781448959 JRRMMIPJRVPWCU-UHFFFAOYSA-N 431.489 2.420 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 782815807 VEEQMAVSFWJESP-KTKRTIGZSA-N 440.456 2.456 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)Cc3ccccc3)cc2F)C[C@@H](C)O1 796270864 WIIKJTVRSINXME-YVHKJVDXSA-N 444.503 2.202 10 20 IECD C[C@H]1CN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 797356785 FRYQSPWECJMYNC-ZAMGYDSWSA-N 436.420 2.390 10 20 IECD COc1cccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 803690855 YJSAPWLHEYIMGN-HNNXBMFYSA-N 434.443 2.093 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 807096408 IDFFJUDVGMACGT-IBGZPJMESA-N 426.492 2.128 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2ncnc3sccc23)CC1)c1ccc(N(C)C)cc1 807675279 VZJVECZSXMSXHP-HNNXBMFYSA-N 438.557 2.283 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(N(C)C)cc1 808568416 KGDIMINVFMXXRU-FZKQIMNGSA-N 430.455 2.130 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc2[nH]ccc12 808921535 CJNKMANBUVPWTK-UHFFFAOYSA-N 436.468 2.046 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)sc1C(C)=O 815369823 LRDUIRGKHCSICA-UHFFFAOYSA-N 432.502 2.186 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccccc3S(C)(=O)=O)CC2)cc1 915337827 XALGIJMWYIGMDL-UHFFFAOYSA-N 446.573 2.433 10 20 IECD COC(=O)[C@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c2ccccc2O1 918456581 SSZSQUWBJSWTHN-OAQYLSRUSA-N 437.496 2.211 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2o1 918464690 ZJHHTXMUAUOLSI-MRXNPFEDSA-N 435.484 2.093 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cc([N+](=O)[O-])c[nH]1 919698098 SHFYCYVEQGMLCV-UHFFFAOYSA-N 425.424 2.109 10 20 IECD COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920890317 WCOSRLMHGUJXSY-INIZCTEOSA-N 427.501 2.148 10 20 IECD Cc1c(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cnn1-c1ccccc1 1345474348 WIZYZOYYTYDUGL-UHFFFAOYSA-N 429.454 2.298 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1347341635 QQCKCEZYUFWAFH-UHFFFAOYSA-N 439.484 2.352 10 20 IECD CC1(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)COC1 1785928973 WMXFNWXXJSYNPH-UHFFFAOYSA-N 433.555 2.017 10 20 IECD CSCC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719006 QHGDJVXKSRWZRG-QVHKTLOISA-N 428.938 2.117 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1C 1808726118 YNDYOBZKIDEDOH-IIBYNOLFSA-N 435.484 2.168 10 20 IECD Cc1noc(C)c1CC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546667 IXFWGFVORBUKMT-UHFFFAOYSA-N 428.489 2.185 10 20 IECD CC(C)n1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725796 LYVMQCDCENCUIQ-LBPRGKRZSA-N 442.501 2.266 10 20 IECD CC[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876818 ZLOSGAFCWXKMJA-IIMRFPQDSA-N 432.517 2.207 10 20 IECD CN(C)c1cccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843442387 HGBARFILTMIOSM-UHFFFAOYSA-N 445.523 2.363 10 20 IECD Cc1cc(C(=O)COC(=O)C2(C)CCOCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 726839468 MHTAULTZIKTZKA-UHFFFAOYSA-N 434.514 2.284 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccc(O)cc3)cc2F)C[C@@H](C)O1 726872314 DYBFHRFQTHTHKE-HZPDHXFCSA-N 429.492 2.120 10 20 IECD NC(=O)[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(F)cc1 727465163 UWPUHFODUZPQRQ-OAQYLSRUSA-N 438.482 2.398 10 20 IECD CC1CCN(c2cccc(NS(=O)(=O)c3cnc4c(c3)c(O)nc(=O)n4C)c2)CC1 740758365 DUVOSJGVGDGHSI-UHFFFAOYSA-N 429.502 2.071 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 745903149 DLEWEEGFHHSVOV-AHRSYUTCSA-N 438.519 2.497 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCC(=O)Nc1ccccc1Br 746492261 HDJPLXVBBQNUFQ-UHFFFAOYSA-N 447.333 2.469 10 20 IECD CN(C)c1ncnc2c1cc(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)n2C 748023507 FFBRDHCQHQBPTI-UHFFFAOYSA-N 426.496 2.065 10 20 IECD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)C1 748485502 HSJZJOTVUIYPCG-IYBDPMFKSA-N 445.541 2.314 10 20 IECD COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751235698 BEOKYRYKQSKNMF-UHFFFAOYSA-N 432.542 2.302 10 20 IECD CCN(CCS(C)(=O)=O)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753200856 ACSVNSQBIOYEQR-CQSZACIVSA-N 428.510 2.156 10 20 IECD COCCOc1cc(C)ccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754213179 OSQNOKMWAIXHAW-UHFFFAOYSA-N 445.491 2.455 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCCN(S(C)(=O)=O)CC3)c2C)cc1 754640698 AGLVSGKHXXNFNT-UHFFFAOYSA-N 447.557 2.031 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)cc1 759691962 VLXXUFUSRZQXDJ-UHFFFAOYSA-N 431.558 2.500 10 20 IECD COc1cc(N(C)CC(=O)Nc2cc(-n3cnnn3)ccc2Cl)cc(OC)c1OC 760856707 HLEYEKOPOCJKSA-UHFFFAOYSA-N 432.868 2.416 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763897412 ZEKFSIFLXAFIMV-LSDHHAIUSA-N 440.521 2.156 10 20 IECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)cc1 766047146 GMDSAYXSPOYVEF-UHFFFAOYSA-N 427.500 2.209 10 20 IECD CCOc1ccc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c(O)c1 768206814 IRPMZJCWAXVFTA-UHFFFAOYSA-N 433.530 2.289 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc(O)cc(O)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 768598810 SULBFMQRBLLPBX-UHFFFAOYSA-N 444.465 2.192 10 20 IECD COCCCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccccc2C)c1C 770166348 MACSFDDHUBVJTC-UHFFFAOYSA-N 436.530 2.084 10 20 IECD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770575535 GJMJTTPZASUVKP-BBRMVZONSA-N 433.521 2.337 10 20 IECD Cc1ocnc1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770762710 ZNCZKDNOLMCGTQ-UHFFFAOYSA-N 425.468 2.238 10 20 IECD COc1cc(Br)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1OC 774361579 HFWNIJWCTATJTR-UHFFFAOYSA-N 439.262 2.175 10 20 IECD COc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 774668936 MXBQVJBOQOGNSO-INIZCTEOSA-N 427.501 2.034 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780408324 ZJCMCFBYCYGFRV-UHFFFAOYSA-N 435.477 2.082 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(OCC(F)F)cc3)c2)CC1 783827220 KFXMCUXMDONOIE-UHFFFAOYSA-N 446.497 2.366 10 20 IECD COC(=O)c1nc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)cc2)sc1C 785444638 SNVGVGQGRZCSLU-INIZCTEOSA-N 430.530 2.284 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)CC2)cc1 785802045 GJBJEMVYILLENK-FPAYPSAMSA-N 442.434 2.243 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)CC1 786256614 HFIIGQGUQLCKAY-LJQANCHMSA-N 438.503 2.164 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(Cn4cccn4)cc3)CC2)cc1 788466130 ZIAFKYHIBOHFIT-UHFFFAOYSA-N 447.539 2.341 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC([C@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 789824546 IUPSUGPYDAUNEL-DRSNIGMVSA-N 447.551 2.473 10 20 IECD C[C@@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCCC1 790183086 FAWKJKGPVHYBPQ-INIZCTEOSA-N 438.519 2.221 10 20 IECD COc1ccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)c(O)c1 794388867 BGGQGFFFDCWGCV-INIZCTEOSA-N 442.534 2.256 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2Br)cc1 797431648 UZQNPOUWSIWQMV-UHFFFAOYSA-N 438.300 2.265 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)cc1F 803663249 UWEPWCPYAJAWAV-JOCHJYFZSA-N 436.528 2.271 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)NC(=O)OC(C)(C)C 803685383 FLIPEKFKJDFMCO-SFHVURJKSA-N 432.565 2.351 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4ccc(Cl)cc4)C3=O)ccc21 803687336 BZGMCRSNTVRNEP-LJQANCHMSA-N 440.931 2.260 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3nc(C)c4ccccc4n3)CC2)cc1 804286055 GNEYXRLGJDKWQW-UHFFFAOYSA-N 433.512 2.302 10 20 IECD Cc1nccn1CCCN(C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769828 ISACZDUXYFHMGD-QGZVFWFLSA-N 449.502 2.427 10 20 IECD CC[C@@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854563 ZYVJDSVQJKFZRZ-FQEVSTJZSA-N 432.634 2.435 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(S(N)(=O)=O)cc1 819519135 OSGBTWGGSOZPED-UHFFFAOYSA-N 433.530 2.336 10 20 IECD CN(C)S(=O)(=O)c1cccc(C2=N/C(=C/c3ccc(N4CCOCC4)cc3)C(=O)O2)c1 916547613 BYQPQFNITBOPKQ-XSFVSMFZSA-N 441.509 2.118 10 20 IECD Cc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1S(=O)(=O)N1CCOCC1 918374442 GAIKBVSBLCXGLS-UHFFFAOYSA-N 445.541 2.105 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cnc4ccccc4c3)cc2)C1 918463239 JWSTWHNRFXQWDR-SFHVURJKSA-N 431.496 2.191 10 20 IECD CCc1cc(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c(O)c(C(C)(C)C)c1 919940927 QPHZILWTGDIGHP-UHFFFAOYSA-N 449.573 2.451 10 20 IECD O=C(CN1CCC[C@@H](C(=O)NC2CC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1116329791 MJSNGGAFADXZFE-OAHLLOKOSA-N 431.492 2.391 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1778341611 ZZCPZEUEVJJYMD-YJLYGGOZSA-N 438.528 2.045 10 20 IECD O=C(CCc1ccoc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007422 HVOBPIKBNNOZHW-OAQYLSRUSA-N 434.876 2.421 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c(Cl)c1 1787294262 GSRFVIKYWFRELI-OWQGQXMQSA-N 445.903 2.362 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)ccc3Cl)C[C@@H]21)c1cc(O)nc(O)c1 1787294473 SNSDVSQDLQMKGD-KCTSRDHCSA-N 449.866 2.192 10 20 IECD C/C=C/C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808470900 ZVHHUYLAUMCENW-CBBDXRRGSA-N 431.496 2.456 10 20 IECD Cc1cc[nH]c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816174012 KNHRTUOFHBIFCF-CYBMUJFWSA-N 446.558 2.212 10 20 IECD O=C(CNc1ccc(F)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038840 DBMJAYKHYMQUFU-YCRREMRBSA-N 441.459 2.271 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCS(=O)(=O)C1 16021905 SSMKPQLSFORPGG-KWJWQAOWSA-N 430.598 2.033 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc4c(cc3Cl)NC(=O)CO4)CC2)cc1 20491842 UPMDTBBXYFCLCZ-UHFFFAOYSA-N 437.905 2.190 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3cc(OC)cc(OC)c3)CC2)cc1 726627480 MOLKDCHOKCLIMR-UHFFFAOYSA-N 427.501 2.227 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](N3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 727159676 QFAWXJQIZWFIMM-LJQANCHMSA-N 430.574 2.094 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1F 731409046 JKALSYAPQRGOKH-UHFFFAOYSA-N 444.507 2.394 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)c3cc4occc4s3)CC2)c1 741302191 SDIMHIZNSAFZTA-UHFFFAOYSA-N 449.510 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccc(F)cc3)n3nnnc3C)CC2)cc1F 753730334 HTHXVZOPMWLIIO-HXUWFJFHSA-N 442.470 2.401 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)c3cc(C)n(-c4ccccn4)c3C)C2)cc1 760208231 CRTDSUXLELPXNS-UHFFFAOYSA-N 440.525 2.301 10 20 IECD COC(=O)c1cn([C@@H]2CCCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)C2)nn1 762571095 KQGIZGVZVQOBFZ-VQIMIIECSA-N 442.520 2.009 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766983950 VFQGOHGGIGXTCP-PGRDOPGGSA-N 444.601 2.340 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CN3CCOCC3)c3ccc(C)cc3)nc12 774834094 YBTZHOSCBVGDBZ-HXUWFJFHSA-N 439.516 2.083 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CCN(C(C)C)CC1 774854598 BHWLTLBHBPIJRY-UHFFFAOYSA-N 426.355 2.492 10 20 IECD COc1ncc(/C=C\C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 775136973 ZPGMTJWEVOKCIH-KTKRTIGZSA-N 443.415 2.456 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)c1 779243329 NPKIETXHIDHQQT-UHFFFAOYSA-N 426.441 2.166 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCC[C@H](C)CC3)CC2)cc1 785529010 UJZOMRURKUYAGR-PMACEKPBSA-N 430.593 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(Cl)cccc3S(C)(=O)=O)cc2)CC1 786657401 XIPUHCGKJSDYRY-UHFFFAOYSA-N 449.960 2.342 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN1CCC[C@@H](C)C1 787676853 RWGREJSQCUFUNM-CQSZACIVSA-N 426.355 2.351 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC([C@@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 789824549 IUPSUGPYDAUNEL-JKSBSHDWSA-N 447.551 2.473 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)CN(C)C 789824877 KUEUJFVEHLRDAT-ZACQAIPSSA-N 436.572 2.148 10 20 IECD CC(C)c1nc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 789839877 BWNXODIJRCVXJX-UHFFFAOYSA-N 448.564 2.342 10 20 IECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 790912170 OABJHQUWORDKDE-ZWKOTPCHSA-N 442.516 2.166 10 20 IECD C[C@@H](c1cccs1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793731530 FLIPEBOYSFUYNZ-DOTOQJQBSA-N 428.558 2.286 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 795772846 BGFPWXQAGPZGBZ-UHFFFAOYSA-N 432.542 2.450 10 20 IECD CN(CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCCC1 803449303 VKDAYRQHPHPZEI-UHFFFAOYSA-N 438.519 2.364 10 20 IECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCc2ccccc21 803910210 UUFMPCUYWOLFEB-NQIIRXRSSA-N 437.540 2.467 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCN(c4cccnc4)C3=O)cc2)CC1 805023406 GYYUGOJSSXPPDC-JOCHJYFZSA-N 449.555 2.246 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N=c3ccnc4n(C)[nH]cc3-4)cc2Cl)C1 807072946 DBFAPYKBVRQBLF-AWEZNQCLSA-N 440.935 2.486 10 20 IECD CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 807290644 ZJFWORBWYXVVEG-KRWDZBQOSA-N 441.532 2.454 10 20 IECD CCC[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768334 HGDGDELBVIOGDX-YJBOKZPZSA-N 425.476 2.401 10 20 IECD CN(CC1(O)CCCC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770963 QKGXKVKFSCCTPL-OAHLLOKOSA-N 425.476 2.137 10 20 IECD O=C(NCc1cccnc1OCC(F)F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809633876 VLVGYCHMXDPNOO-QGZVFWFLSA-N 449.454 2.255 10 20 IECD CC(C)OCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)no1 811973505 XWOIKHFQWIXFNZ-NVXWUHKLSA-N 444.536 2.257 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@@H]1CCS(=O)(=O)C1 914454103 PXSKGEGTEFWBOS-IGVUGNCQSA-N 444.625 2.280 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 915777747 AFDDLIJYCWEGTE-UHFFFAOYSA-N 436.512 2.014 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1cccc(N2C(=O)CNC2=O)c1 916689004 OAWLBKDRAOLVPZ-UHFFFAOYSA-N 437.500 2.273 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(-n2ccnc2)c1 918763344 IULHOJPXYAPCGG-UHFFFAOYSA-N 433.512 2.336 10 20 IECD C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCCC1 920445000 GNIOLYUIWRITPC-AWEZNQCLSA-N 448.501 2.315 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(Br)c(C=O)n3C)cc2)CC1 1322433860 HHSHFSPHOXHCCQ-UHFFFAOYSA-N 447.333 2.199 10 20 IECD Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)ccc1F 1782004760 MIGKKVWDKHSUCL-OAQYLSRUSA-N 449.866 2.351 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@@H]1CCc2ccccc2[C@H]1O 1796601117 VPVXIJILJAWHLK-XQYWQHOKSA-N 437.496 2.041 10 20 IECD O=C(c1ccc2nonc2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551063 AHHSHFHWZMDMGW-UHFFFAOYSA-N 437.456 2.188 10 20 IECD O=C(Cc1cscn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817545632 ADIRFMIDFDYTQR-CQSZACIVSA-N 428.474 2.221 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1cc(O)nc(O)c1 1828153839 YJOLIZJVCQEPRG-PWSUYJOCSA-N 434.543 2.318 10 20 IECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 729259600 QBHYBJDKIWXIJL-UHFFFAOYSA-N 437.544 2.306 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N(C)C1CC1 729599717 KMWZNBZZTJDSQP-KRWDZBQOSA-N 441.555 2.224 10 20 IECD NC(=O)[C@@H]1Cc2ccccc2CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741447227 KJHFXGHIRCCENN-QFIPXVFZSA-N 439.471 2.313 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)CC2)cc1 742033342 LUWJBCCDUAVUEL-HNNXBMFYSA-N 441.557 2.419 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1 743906616 ORPCWIQGTGWTTP-SNVBAGLBSA-N 426.878 2.274 10 20 IECD CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748042706 MOBXGCPJRLFNEO-NWDGAFQWSA-N 425.532 2.288 10 20 IECD Cc1cc(CCNC(=O)CCc2nc3c(O)nc(=O)n(C)c3[nH]2)c(C)n1-c1ccccc1 749161923 MQVGQLJRCHHXOA-UHFFFAOYSA-N 434.500 2.061 10 20 IECD NC(=O)c1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 751059086 SQTHCDFHQMUBJB-UHFFFAOYSA-N 431.495 2.283 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227111 FEIUJPICOFJBCO-UHFFFAOYSA-N 440.468 2.191 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)cc1 751407224 UAIZWEDZRVXOLZ-GOSISDBHSA-N 434.562 2.152 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NCCCSc3nccs3)CC2)C1 759602462 VLWXOIFCBBXUAG-IAGOWNOFSA-N 439.651 2.457 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 760896257 FRLBWWBHHHYADX-SFHVURJKSA-N 446.548 2.384 10 20 IECD Cc1cc(C(=O)CN2CCS(=O)(=O)C[C@H](C)C2)c(C)n1-c1ccc2c(c1)OCCO2 763899286 QYWXCMNYFJWGQB-OAHLLOKOSA-N 432.542 2.415 10 20 IECD CN1CC=C(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 776040813 FDKCDIDZIQRLJP-UHFFFAOYSA-N 439.539 2.003 10 20 IECD O=C(CS(=O)(=O)c1ccccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 776286206 XYQKXTKGJKFMKM-UHFFFAOYSA-N 426.897 2.406 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1C 780407212 JHNUGJBCXCKOCG-UHFFFAOYSA-N 430.530 2.423 10 20 IECD CN(C)C1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 782561819 RLBHBBXXYZNBOM-UHFFFAOYSA-N 441.555 2.226 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@@H]3c3ccc[nH]3)CC2)cc1 785527817 FYSCTOOXJKBDNN-JOCHJYFZSA-N 439.560 2.015 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(c4cccc(OC)c4)=NO3)CC2)cc1 792096972 NBHLTVRLELICMO-QHCPKHFHSA-N 438.528 2.135 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCc4sccc43)cc2)C1 793734132 QFEQFCQNGTXPEC-APWZRJJASA-N 440.569 2.260 10 20 IECD CO[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798775506 XNOPJJHBOPOFEV-QFIPXVFZSA-N 433.420 2.065 10 20 IECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)CC2 803300805 KLOKOFJERHNAEH-XLIONFOSSA-N 439.560 2.152 10 20 IECD COc1ccc(COCCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 804038788 DGTHYYGRSMEFNB-UHFFFAOYSA-N 441.528 2.122 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H]([S@](=O)CC)C2)cc1F 804851552 GFWFYMBQQIAFIM-ZYWUZIHQSA-N 425.570 2.484 10 20 IECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCSc2nccs2)C1 806281291 SWMXLWREKSLXMF-CABCVRRESA-N 426.608 2.285 10 20 IECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806794347 YAKIIJPVBUOCTB-NRFANRHFSA-N 439.512 2.130 10 20 IECD COc1cc(N2CCN(CN3C(=O)C4(CCC4)[C@@H]3[C@@H]3CCCO3)CC2)cc(OC)c1OC 811763990 MPDLRSQTMJVXDR-AVRDEDQJSA-N 445.560 2.352 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnc2nc(O)nc(O)c2c1 917380495 AUMKWCPZLMGCNS-UHFFFAOYSA-N 449.389 2.221 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 917832608 DDSNUADNDGIKQP-OAHLLOKOSA-N 441.444 2.443 10 20 IECD CC(C)S(=O)(=O)CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919605067 PHALAUXTLFEJRW-CYBMUJFWSA-N 443.477 2.155 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)Nc1ccccc1 919800229 OKTQEYUONMRWEN-UHFFFAOYSA-N 434.475 2.197 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)CCC1CCC1)CCO2 1785503220 CWTUFSAHBQRSDV-CJHOVAGGSA-N 430.501 2.227 10 20 IECD CC[C@H](C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792217831 PBLLSJCHVASSHA-RWNQJQHJSA-N 432.517 2.233 10 20 IECD CC(C)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792218270 UQXKNXQKOGGPDT-ONQJJZRUSA-N 432.517 2.233 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(F)cn1 1804285827 WEFVBBOEWPFZCY-FJYVKWIBSA-N 427.432 2.303 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc(O)ccc3F)CC2)C1 1810554194 FUFJEDZWHIZYFH-UHFFFAOYSA-N 429.448 2.496 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1 1823476714 IXWYDQMSGZBAKD-HEWZJLJBSA-N 440.456 2.211 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827429318 SPXBKEPUKNPSLK-VQIMIIECSA-N 441.532 2.492 10 20 IECD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1832235961 JUBIYMUWKFRAAO-YJBOKZPZSA-N 427.505 2.184 10 20 IECD CC(C)c1nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)co1 1842168220 KRAWVWRISGSYKR-FNORWQNLSA-N 427.457 2.445 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccc3[nH]ncc23)C1 1843260444 IJFZDJJJJOLAON-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CC(=O)Nc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845500799 QCYXGQCFDRUBGU-UHFFFAOYSA-N 444.875 2.235 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc1 110468585 HIRHBSHXHMYSRS-UHFFFAOYSA-N 432.546 2.207 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC(=O)NCCc3ccccc3)cc2F)CC1 303276233 HKTSHNDQFWGLOA-UHFFFAOYSA-N 441.551 2.126 10 20 IECD Cc1cc(C(=O)CN(C)CC(=O)OC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 725801439 JZOCYQNUQHGQKL-UHFFFAOYSA-N 435.546 2.198 10 20 IECD COC(=O)CN(CCC(=O)N1CCN(c2ccccn2)CC1)Cc1cc(Cl)ccc1O 731845289 UTHAGPBOMQHNJO-UHFFFAOYSA-N 446.935 2.155 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CC(N)=O)Cc3ccccc3)cc2F)C[C@@H](C)O1 732808241 KDMOOHYXLHAOJO-QZTJIDSGSA-N 442.535 2.043 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H](C)N1C(=O)OC(C)(C)C 733363750 FZTOBLBWFMDYII-CHWSQXEVSA-N 427.523 2.234 10 20 IECD CC[C@H]1COCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734660350 AAOAHVLTYZCZGX-SFHVURJKSA-N 428.512 2.263 10 20 IECD O=C(CCN1CCN(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 746135176 WFCQPFUARMNTLB-UHFFFAOYSA-N 426.536 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cccc(CS(N)(=O)=O)c3)cc2F)C[C@H](C)O1 749404316 JJIXDYLGRPZZSB-GJZGRUSLSA-N 435.521 2.158 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c[nH]1 751361236 RFYOLNDJEVSJTL-AWEZNQCLSA-N 427.910 2.103 10 20 IECD CCOC(=O)CC[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 752055922 YIWLFYCHWGCVJI-GOSISDBHSA-N 435.540 2.334 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(CCO)[C@H]3CCc4ccccc43)CC2)cc1 754049316 CRUKFCSLBWFPET-RDGATRHJSA-N 425.573 2.160 10 20 IECD C[C@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS1(=O)=O 758890330 ZKPWOHNVZWQOCV-LSDHHAIUSA-N 431.505 2.475 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)[C@]12CCCO2 759319635 CSQJTMUYVJVQFK-MIZPHKNDSA-N 449.548 2.271 10 20 IECD COc1cccc([C@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC(C)C)cc3)C2=O)c1 759928574 NPONUGLXRFCJGH-QHCPKHFHSA-N 440.500 2.417 10 20 IECD CC(C)(O)CN1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 760164674 JXZOYQITVRNNRY-UHFFFAOYSA-N 426.508 2.355 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccnn3-c3cc(C)ccn3)CC2)cc1 760220244 WXEBCPOIFXEHMM-UHFFFAOYSA-N 434.500 2.308 10 20 IECD O=C1C[C@H](c2cccc(NC(=O)C(=O)NCc3cccc(Br)c3O)c2)CN1 765927381 QRBVDLYIQXQWIK-ZDUSSCGKSA-N 432.274 2.013 10 20 IECD COc1cccc(CNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c1O 769508223 SWIMRKITTALMCL-UHFFFAOYSA-N 428.557 2.130 10 20 IECD COc1ccc(Cn2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)n2)cc1 778569315 KXMUEZGCLKLJCX-UHFFFAOYSA-N 449.511 2.032 10 20 IECD O=C(Nc1cnn(CC2CC2)c1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765945 DMZQUCOHYMRLQF-KRWDZBQOSA-N 431.924 2.371 10 20 IECD O=C(NCc1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 785782729 ZFIPBCPFJPPRGJ-UHFFFAOYSA-N 437.418 2.354 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](NC(=O)c3cccs3)C(C)C)cc2)CC1 786258544 ZSCJTYKHGVTJLL-NRFANRHFSA-N 442.585 2.487 10 20 IECD CCOCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 787514618 POXMVHFAJQTYJF-UHFFFAOYSA-N 443.519 2.256 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccsc1)N(C)C)c1ccc(N2CCOCC2)cc1 787655252 QXTQJJMRBZJCFR-UZLBHIALSA-N 430.574 2.181 10 20 IECD Cc1ccc(-c2nc(CCNC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)co2)cc1 788313700 UMQQNBMJBLAJIV-UHFFFAOYSA-N 448.523 2.462 10 20 IECD O=C(N[C@@H]1CCN2CCC[C@@H]2C1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788571089 JHGDYQMAGDJQRH-JFIYKMOQSA-N 436.503 2.116 10 20 IECD COCCC(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950800 QPSYCXDFOZZFID-UHFFFAOYSA-N 445.482 2.337 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c(O)c1 797389186 UGFXWYDTDHDSSB-UHFFFAOYSA-N 425.416 2.005 10 20 IECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)CC2 803300806 KLOKOFJERHNAEH-YLJYHZDGSA-N 439.560 2.152 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1nc2c(s1)CCCC2 804086001 FXJWZQZYYGTQEC-UHFFFAOYSA-N 442.585 2.176 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 807291169 GYYIOAULHJQRIH-PXNSSMCTSA-N 442.560 2.441 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1ccccc1F 807636126 XPZGCKPNGNXGME-QGZVFWFLSA-N 429.492 2.204 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1)c1ccc(N(C)C)cc1 807678866 LLFNOZXZJVMHDI-MRXNPFEDSA-N 429.952 2.323 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc(CC(F)(F)F)cs1 815409860 HZJZXOWJTSWJIL-UHFFFAOYSA-N 428.436 2.339 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)N(C)Cc1ccccc1O 916670329 HCCSZAIBUFDNRC-UHFFFAOYSA-N 449.529 2.476 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4nc(O)[nH]c4c3)cc2F)C[C@@H](C)O1 917917813 HVTCJAFUAUMGGM-CHWSQXEVSA-N 434.493 2.500 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccnc(N4CCCC4)c3)cc2)C1 918005894 PHCSHZJAMRNRMU-FQEVSTJZSA-N 436.560 2.383 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3cccnc3)cc2F)C[C@@H](C)O1 918211724 MSUHECQSINJPFU-HZPDHXFCSA-N 429.496 2.064 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cc1 918311297 ULNNHSFNJFGGAD-UHFFFAOYSA-N 437.544 2.066 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)c4ccsc4)CC3)nc12 920090248 SYUSJMPUPMIFOV-UHFFFAOYSA-N 429.502 2.068 10 20 IECD C[C@@H](NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)c1ccc(N2CCOCC2)cc1 920887621 FXLZABJOKUEOLJ-CCMRYFRJSA-N 432.590 2.426 10 20 IECD CC1(C)CCc2nc(O)c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2C1 1261747669 VWUDKVGCBBQIAY-UHFFFAOYSA-N 443.569 2.467 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(NC(C)=O)c(F)c3)CC2)cc1F 1321440099 IUIZGUNYEYFBDA-UHFFFAOYSA-N 425.457 2.443 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)c1ccc(Cl)cc1 1324120728 IVLVHHWUICHEAU-WBMJQRKESA-N 434.876 2.160 10 20 IECD C/C=C(/C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221728 MKBINDPJLPSFLX-FXMSQDKQSA-N 430.501 2.297 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2 1785507010 IHIRVVYULOGCQR-XAFBZQIESA-N 448.859 2.207 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnn(C)c2)cc1 1794750305 AKUOWFLYEHOZBZ-IUTQVRIDSA-N 447.539 2.345 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1nc2ccccn2n1 1800714808 HLFLFCNBSYEDPQ-BTTYYORXSA-N 441.875 2.360 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817848500 NHSQYCYLKUXFQI-OAHLLOKOSA-N 426.433 2.061 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818147876 NZYVZHKFWIFGAK-KSSFIOAISA-N 438.488 2.230 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)nc1 1848204650 URWQUHYVPXLVHM-IRMPMDNSSA-N 437.496 2.355 10 20 IECD Cc1cc(C(=O)COC(=O)C2=NN(C)C(=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 17734305 AEXZTFCHNBZSHK-UHFFFAOYSA-N 425.441 2.199 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 27797045 WPCQVOVJNLWJLJ-MRXNPFEDSA-N 437.496 2.247 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 725805835 YLVIYLFNZRAHDJ-GOSISDBHSA-N 432.565 2.190 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(Cl)c1 726975974 HOXWCDYVJIUXHX-UHFFFAOYSA-N 428.963 2.362 10 20 IECD Cc1ccc(F)c(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 727978460 MAIOFOAFYDIAHG-UHFFFAOYSA-N 437.566 2.384 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(CC(C)(C)O)CC1 728054662 YNCBWOIMSALNQV-MRXNPFEDSA-N 435.524 2.178 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 750296495 JVNNAIQKTWDXMJ-KHISNQGASA-N 434.606 2.267 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccccc3C(=O)OC)cc2F)CC1 751074239 GVFPOHDJTWBIHB-UHFFFAOYSA-N 435.521 2.233 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC3(c4ccc5c(c4)OCO5)CC3)CC2)cc1 754162524 FEOVGKVVFUIURW-HXUWFJFHSA-N 425.529 2.186 10 20 IECD CC(=O)N1CC[C@H](CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 755148862 ZUWLXNGWBFAUJV-CQSZACIVSA-N 435.436 2.311 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](c4nccn4C)C3)CC2)cc1 756662659 WXBYGRVDCPHYMU-LJQANCHMSA-N 426.565 2.140 10 20 IECD COc1cc(N2CCN(C(=S)Nc3ccc(C(N)=O)cc3)CC2)cc(OC)c1OC 758921734 XLZWKCLGIQCHBU-UHFFFAOYSA-N 430.530 2.330 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc4c(c3)ncn4C)CC2)cc(OC)c1OC 759100044 ZFFPIMRAODTCSM-UHFFFAOYSA-N 446.529 2.110 10 20 IECD O=C(NCc1cccc(Br)c1O)c1nc2ncc(Br)cn2n1 765765175 OUHBTRBGISHQMG-UHFFFAOYSA-N 427.056 2.285 10 20 IECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765924948 BRDCACCCXIQRIF-UHFFFAOYSA-N 436.306 2.350 10 20 IECD CCCC[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768523124 XUCREGHDABGUHV-DAYGRLMNSA-N 434.512 2.166 10 20 IECD O=C(CCn1nnc2ccccc2c1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915506 LKMYNFJVKLRNDM-QGZVFWFLSA-N 441.919 2.321 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 774561056 LRAVOSYQRSYYQE-HOTGVXAUSA-N 429.492 2.381 10 20 IECD C[C@@H](NC(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1ccc(N(C)C)cc1 775617215 JNNLUHDSFCTYCC-MRXNPFEDSA-N 446.577 2.112 10 20 IECD Cc1cc(Br)cc(CNCc2ccccc2S(=O)(=O)N(C)CCO)c1O 776175538 OOPIHUSXBDRTFX-UHFFFAOYSA-N 443.363 2.366 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(N4CCCC4)nc3)CC2)cc1 778233569 HBOKALNAIRTJET-KHPPLWFESA-N 449.555 2.212 10 20 IECD COc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1OC 780407170 HDXBZWFSIUGKDX-UHFFFAOYSA-N 433.530 2.482 10 20 IECD CC[C@](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)(C(N)=O)C(C)C 782100117 CPEIJFYAVZZKTO-GOSISDBHSA-N 425.532 2.274 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 787198043 MLFGWCVWQNBOPK-HDICACEKSA-N 439.560 2.002 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)cc2)CC1 787320158 SJPZHSFCVSQQJU-SELNLUPBSA-N 430.593 2.105 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](COCc2ccccc2)C1 788312541 ITDWRBCZDYAYSP-JOCHJYFZSA-N 437.540 2.205 10 20 IECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789801197 ZJKVJUIBWXEBHP-FQEVSTJZSA-N 445.491 2.034 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccn4ccnc4c3)cc2F)C[C@@H](C)O1 789819497 NSAGILQVONGZDX-IYBDPMFKSA-N 439.491 2.020 10 20 IECD Cc1nc2c(s1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CCC2 789833711 IPURYTJQOLBZGB-SFHVURJKSA-N 446.548 2.362 10 20 IECD CCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 789843705 NSIMNESZKZHXDM-UHFFFAOYSA-N 447.482 2.257 10 20 IECD C[C@](O)(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 789856230 QXPDKTXPGOSPFY-QHCPKHFHSA-N 427.570 2.270 10 20 IECD COc1ccc(N2CCC(N[C@@H](C(=O)N(C)Cc3nnc4n3CCC4)C(C)C)CC2)cc1 793248186 YPIIOTKFIOQGMV-HSZRJFAPSA-N 440.592 2.475 10 20 IECD CN(C)c1ccc([C@H](CNS(=O)(=O)N(C)CC2CC2)NC(=O)OC(C)(C)C)cc1 795250095 YPFQLRVMWFBPEQ-SFHVURJKSA-N 426.583 2.495 10 20 IECD CO[C@@H]1[C@H]2C[C@@H]3CN(CC(=O)c4cc(C)n(-c5ccc(S(N)(=O)=O)cc5)c4C)[C@H]1[C@H]3C2 796329544 LTMLVCHYNMAROL-FMPLQYSASA-N 443.569 2.279 10 20 IECD COc1cc(N2CCN(C(=O)c3ccnc(NC(=O)C4CC4)c3)CC2)cc(OC)c1OC 803106093 VRNAOGXHGRWMCF-UHFFFAOYSA-N 440.500 2.418 10 20 IECD CNC(=O)OC[C@@H]1CCCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 806334936 XRGIORKBCGWQAL-FQEVSTJZSA-N 447.580 2.127 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290145 QVUFOOHMSQVSMU-FXAWDEMLSA-N 442.560 2.441 10 20 IECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386612 BVCKXDOWMUNVMH-UHFFFAOYSA-N 436.306 2.480 10 20 IECD COC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 808029424 MSGPWHFHRDIQLD-HKUYNNGSSA-N 432.565 2.473 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 808300295 FSYBOTWZJOKUME-UHFFFAOYSA-N 435.521 2.437 10 20 IECD O=C(NCc1ccc(Cn2cncn2)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918201196 PPRBQVHRKGFGJZ-UHFFFAOYSA-N 438.507 2.426 10 20 IECD CCN(CC)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 918284686 NYAIUJNOPAIECB-UHFFFAOYSA-N 429.496 2.158 10 20 IECD Cc1cc(C)n(-c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cn2)n1 918311921 WURVFIVLGMASMX-UHFFFAOYSA-N 448.527 2.318 10 20 IECD COc1ccc(OCCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918336068 UQCDLRLDIAKEFS-UHFFFAOYSA-N 432.542 2.405 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc2nc(O)[nH]c2c1 919761434 ARTKJUQLCSVFGM-UHFFFAOYSA-N 447.474 2.454 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 920786313 JJELFKAHKNOSIZ-UHFFFAOYSA-N 427.526 2.210 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCN1C(=O)CCc2ccccc21 1255148763 PQYPOPYHASQCHZ-KRWDZBQOSA-N 426.469 2.058 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)C1 1317966948 PIBXHEAIEYLVBO-LJQANCHMSA-N 440.519 2.294 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2cccc(Cl)c2F)nn1 1321365921 BOUJARFIQJXXOF-ZDUSSCGKSA-N 448.838 2.375 10 20 IECD CCC(=O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811808499 CKDIZKQORKAVHJ-UGSOOPFHSA-N 431.876 2.445 10 20 IECD CCOCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826459445 APJYRDAOVUIGPZ-PDFOZTTASA-N 432.517 2.473 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2)CC1 1826701571 ANUDMGMAYGSKDY-LJQANCHMSA-N 430.549 2.212 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1cc(O)nc(O)c1 1828153840 YJOLIZJVCQEPRG-ZYHUDNBSSA-N 434.543 2.318 10 20 IECD O=C([C@@H]1CNc2ccccc21)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442104 YKOCOOKAMWSVRZ-LJQANCHMSA-N 443.507 2.192 10 20 IECD COc1nc(C)ccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442719 WGAQAOCNIZWNDC-UHFFFAOYSA-N 447.495 2.009 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 472797369 XDXJHXOJAAAPKQ-UHFFFAOYSA-N 435.513 2.439 10 20 IECD Cc1c(CNC(=O)[C@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)n(C)c2ccccc12 473268328 HQCVHZIBFZGXAD-IBGZPJMESA-N 432.480 2.033 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)nc2Cl)cc1C(=O)O 728015628 TUFLCLAIWJVFDK-UHFFFAOYSA-N 440.286 2.259 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H]4CNC[C@@H]4C3)c2C)c1 728914013 LHTWHQMABSUQBO-KDURUIRLSA-N 439.512 2.001 10 20 IECD Cc1cc(C(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)c(C)n1-c1ccccn1 732972177 YHFYDCZROCNELP-UHFFFAOYSA-N 426.489 2.483 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 734016558 SQFZOASOTWLIGD-GOSISDBHSA-N 449.485 2.169 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738900343 WHZQRBFRWALRSG-UHFFFAOYSA-N 444.557 2.301 10 20 IECD CCN(CCCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(C)(=O)=O 743559193 YTXWVNRRHKEZDK-OAHLLOKOSA-N 448.536 2.228 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCn4c(CCc5ccccc5)nnc4C3)nc12 746476893 PLOGTZVXEIYRFZ-UHFFFAOYSA-N 447.499 2.004 10 20 IECD CN(C)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCOCC1 748039943 UKOQDONEUHFGCC-UHFFFAOYSA-N 439.559 2.095 10 20 IECD NC(=O)[C@H]1CC(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)=NN1c1ccccc1 751302736 QDQRQDMNRIPAMX-GOSISDBHSA-N 425.452 2.455 10 20 IECD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1F 753744359 KBHVDJJYBBJQTR-UHFFFAOYSA-N 447.941 2.176 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(Br)cn3C)CC2)cc1 760993242 FIPJSJQOPRRABH-UHFFFAOYSA-N 436.306 2.302 10 20 IECD C[C@H]1CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763902004 SHSXJVQLJQKQSV-GJZGRUSLSA-N 440.521 2.156 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(C)c1 765926519 MMXVMESMQVWAMX-UHFFFAOYSA-N 434.290 2.468 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3c(C)cccc3OC)CC2)cc1 772854080 OHEUILJHBYZEBN-UHFFFAOYSA-N 440.544 2.279 10 20 IECD COC(=O)c1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)cc1F 772905812 JIBBIRLQGYQSSJ-UHFFFAOYSA-N 437.418 2.455 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)c1 775255868 TUFJSHVZBRYGPK-GOSISDBHSA-N 440.544 2.280 10 20 IECD C[C@@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccc(N2CCOCC2)cc1 775258305 WSUXFIYSBSBDOF-CQSZACIVSA-N 428.558 2.462 10 20 IECD CS(=O)(=O)[C@H]1CCCC[C@@H]1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775376364 QKRLOWABKLMYBC-FPOVZHCZSA-N 447.580 2.388 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cc1 775408823 CKWXPZWRHHSJEW-IBGZPJMESA-N 444.601 2.245 10 20 IECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 781440666 KSHPQGYJXDWXSD-GASCZTMLSA-N 443.475 2.481 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc4[nH]ccc4cc3C)CC2)cc1 782107551 PSANHBIDLPBYSN-UHFFFAOYSA-N 435.528 2.362 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1 785439749 VCLVHWCXLNAIJI-UHFFFAOYSA-N 428.920 2.007 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)Cc3cccc(C)c3)CC2)cc1 786226311 GYSJPGDRPSTBMU-JOCHJYFZSA-N 440.588 2.419 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CSCN3C(=O)CC(C)(C)C)cc2)CC1 786655608 GGKBSGQEYOQDJQ-FQEVSTJZSA-N 446.617 2.309 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nn(-c4ccc(F)cc4)cc3O)cc2)CC1 787330498 ZNZSDRTXGWZCBB-UHFFFAOYSA-N 437.475 2.316 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H](COC)Cc1ccccc1 788318912 JISZWNSWDCXASB-QHCPKHFHSA-N 439.556 2.246 10 20 IECD CCC[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789827730 VEUIDEDQHFDUTR-SAHWJRBASA-N 435.540 2.209 10 20 IECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1ccccc1 789856140 OWPQKMHCFYMBKO-FCHUYYIVSA-N 438.597 2.418 10 20 IECD CC(C)(O)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789868443 NRYNEXLKKZCEBO-UHFFFAOYSA-N 427.570 2.400 10 20 IECD CC(C)Cc1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 792330461 MXKMGTAMHOQSSU-UHFFFAOYSA-N 425.533 2.139 10 20 IECD CN(C)S(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 793528890 KGUGVQDOFMNLSG-UHFFFAOYSA-N 445.585 2.005 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H]4[C@@H](CO)[C@@H]4C3)c2C)c1 794863502 ITVSKEDRLCBNMQ-AERCQKQUSA-N 440.496 2.020 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(F)c1 795616269 QRCJAOAYQKWYIF-UHFFFAOYSA-N 435.477 2.115 10 20 IECD O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)c1 799391490 PETWETNHEHNQJF-UHFFFAOYSA-N 428.470 2.355 10 20 IECD COc1ccc(CN2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cc1F 807678281 WATUIYDMXVHVHT-QGZVFWFLSA-N 442.535 2.422 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)cc1 808112711 ZUMJPJIMRGIRFB-NTKDMRAZSA-N 441.528 2.329 10 20 IECD Cc1cc(=O)oc2cc(OCC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc12 917832543 AEFABFNVVMTRGC-SFHVURJKSA-N 449.507 2.498 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 918220217 IHRBQVGDUGKFIZ-JFIYKMOQSA-N 441.569 2.406 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918296659 XJRCVIXMBWXFFC-HXUWFJFHSA-N 439.512 2.169 10 20 IECD COc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918463590 LFHXOWSVCXCQNW-OAHLLOKOSA-N 444.919 2.305 10 20 IECD O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918642916 GMFBGWDEJPPRIF-UHFFFAOYSA-N 446.529 2.338 10 20 IECD C[C@H](NC(=O)N1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(N2CCOCC2)cc1 920921525 KORONUBMBITWOZ-SFHVURJKSA-N 438.528 2.457 10 20 IECD Cc1cccc(F)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777851338 GCXKYEDMJCNSER-UZUQRXQVSA-N 443.475 2.382 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C1CCSCC1)CCO2 1782008311 YYZNMDMMSNZFSO-FQEVSTJZSA-N 440.949 2.338 10 20 IECD CC(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)c1ccccc1 1796137042 UTNZPNNGPOCUBF-GMQQQROESA-N 439.512 2.136 10 20 IECD CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1799773520 IXUUQLLJWQRIPG-MUJYYYPQSA-N 447.582 2.197 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cncc(F)c1 1816529832 NZEFCUNMHRIOTQ-HNNXBMFYSA-N 426.408 2.370 10 20 IECD O=C(Cc1ccc(F)cn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817540746 RTUMLKXHNFPMJB-MRXNPFEDSA-N 440.435 2.299 10 20 IECD CCOCCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828200080 KSMPWBTUGHRLOS-GBVBUYCNSA-N 447.513 2.312 10 20 IECD C[C@@]1(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CC=CCC1 1834988385 LTKGQOJNSXIANZ-XMMPIXPASA-N 442.560 2.424 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(F)s2)=NN1c1ccccc1 1848273553 SJNNNKWSHQHFBC-HOTGVXAUSA-N 426.473 2.496 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 437009219 FWRNQDINQUUAGW-UHFFFAOYSA-N 429.542 2.022 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(OC(F)(F)F)c2)SC1=S 728083272 HXKCTJGRORNSQV-DHZHZOJOSA-N 426.463 2.336 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1 729065023 XYCYORXYRBJMKF-JTQLQIEISA-N 428.413 2.213 10 20 IECD CCS(=O)(=O)C[C@H](C)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733196741 GHGHTBGWXJYRON-AWEZNQCLSA-N 428.510 2.156 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN([C@H]4CCCN(C)C4)CC3)cc2F)C[C@@H](C)O1 734660020 JMNKMWKDWQEFHR-SBHAEUEKSA-N 447.599 2.361 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3csc(C(=O)OC)c3)cc2F)CC1 742293501 KPTPSFKIOLHHGF-UHFFFAOYSA-N 441.550 2.294 10 20 IECD Cc1cc(NC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)no1 742750034 LQCJOBNYOIZFGR-MRXNPFEDSA-N 431.493 2.370 10 20 IECD CCOc1cc(F)ccc1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743433141 XKHNGMOBTGQTAL-UHFFFAOYSA-N 444.507 2.110 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC1(O)CCOCC1 743761056 XSIDQUPYEQPGMX-SDNWHVSQSA-N 426.585 2.387 10 20 IECD CCN1CCO[C@@H](C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 748457178 GXARVKSBFPRKNV-IFXJQAMLSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)[C@H]3CCCN(C4CCC4)C3)CC2)cc1 754462291 DMSGPAXFLCCUMU-ZFGGDYGUSA-N 430.637 2.421 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755703596 KLNSCKQIUNQCNT-DLBZAZTESA-N 449.548 2.436 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)cc1F 759788150 QULOTJPJOCXPTD-UHFFFAOYSA-N 435.521 2.297 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccnn3-c3cc(C)ccn3)CC2)cc1 760212691 LJBAFYBSWRUOLI-UHFFFAOYSA-N 434.500 2.262 10 20 IECD O=C(NCCCSc1nccs1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1 765895431 YEDNANILGPZXCD-QGZVFWFLSA-N 434.587 2.395 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1cnn(Cc2nnc3n2CCCC3)c1 770316428 OXICWIYTRRFJJX-UHFFFAOYSA-N 436.520 2.018 10 20 IECD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 771624569 YPCLVUMFALXHQN-GOSISDBHSA-N 435.521 2.190 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN3CCCc4ccccc43)CC2)cc1 778232564 JVQFFBPIIXDIKF-SEYXRHQNSA-N 448.567 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ncn(Cc4ccccc4)n3)CC2)cc1 778244829 DHLHOJFLABAKIG-QXMHVHEDSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3c(C)cc(C)nc3OC)CC2)cc1 778253327 HEVWJDQXVHVUMS-KTKRTIGZSA-N 438.528 2.237 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c([N+](=O)[O-])c1 780408393 FMZUDWSJCOUTLP-UHFFFAOYSA-N 434.474 2.073 10 20 IECD COc1ccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)cc1OCC(N)=O 784057764 FHIZGGWKZGMPFS-UHFFFAOYSA-N 440.500 2.446 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1F 786123170 YXCRTQWVTMHNCQ-UHFFFAOYSA-N 444.507 2.302 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3ccc4ccc(=O)oc4c3)cc2)CC1 786259169 LSMSLGBVWWSBJA-UHFFFAOYSA-N 435.480 2.157 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)ccc(OC)c3OC)CC2)cc1 788178315 OWXUHTGYRSAJHR-UHFFFAOYSA-N 432.448 2.357 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C[C@@H]3CCOC3)C3CC3)cc2F)C[C@@H](C)O1 789812552 MGJYGYIIKJKUHN-NUJGCVRESA-N 433.524 2.083 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCCO1 789953878 GMWHTWFRCVXRGM-MSOLQXFVSA-N 443.466 2.232 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C)cc(Br)c2)ccc1O 790406077 BNDPRLHTUJOSQV-UHFFFAOYSA-N 435.321 2.172 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@]1(N(C)C)CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 793809019 DPXNJPZCUFIZNA-YDIMBITNSA-N 430.593 2.327 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@]2(CCOC2)O1 794307746 DNFWVJTWJHPWKK-YJYMSZOUSA-N 438.527 2.275 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)COc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 797492926 JRBDMHOPAOJLSW-UHFFFAOYSA-N 443.456 2.183 10 20 IECD CCCCn1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)n1 803298039 NGJXEIBJWQCUFQ-KRWDZBQOSA-N 427.549 2.322 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCC[C@H](N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 803309526 ZFIIKGQMFNLLFE-UGKGYDQZSA-N 428.577 2.177 10 20 IECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806276233 LOKZVFIGKGVHQD-UHFFFAOYSA-N 428.580 2.068 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(c2ccc(Cl)cn2)CC1 807292471 YLTCVVFCBWNOPU-UHFFFAOYSA-N 425.920 2.076 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807383903 QWUUQCAFCZSLBB-QGZVFWFLSA-N 449.502 2.475 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807678850 KRWSJZAGRZMRHD-WMZOPIPTSA-N 431.558 2.299 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3nc(-c4ccco4)no3)CC2)cc1 900580108 DJPMOKWTQMLEEN-UHFFFAOYSA-N 440.456 2.163 10 20 IECD CCOC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 915778687 PEOGVXQHTLNJLA-UHFFFAOYSA-N 425.485 2.484 10 20 IECD COC(=O)c1cc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)oc1C 916974625 OGGRNVBWCWJTCZ-UHFFFAOYSA-N 433.480 2.099 10 20 IECD CCN(CC)CCOc1ccccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 919814401 WZPXYSNRBZXTRZ-UHFFFAOYSA-N 435.546 2.414 10 20 IECD O=C1CC(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)c(O)c(Cl)c4)CCC3)cc2)=NN1 1789480961 TXYFKDMIJCSIFP-UHFFFAOYSA-N 442.859 2.375 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1nnc(-c2ccccc2)o1 1796600748 IRZPVTTUNLRZRR-MUJYYYPQSA-N 435.440 2.108 10 20 IECD CCc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807883377 LRYYYYDAWUCHRG-JTSKRJEESA-N 447.495 2.479 10 20 IECD COC(OC)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811797909 XHMDCUPCYYTGFT-SUMWQHHRSA-N 449.891 2.085 10 20 IECD O=C(CCc1cncnc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426274 QYBNKORTYPIAJZ-LJQANCHMSA-N 439.516 2.149 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3)CC2)CC1 1838032370 PKHHKSMIJOMHDQ-QGZVFWFLSA-N 435.546 2.001 10 20 IECD O=C(CCOc1ccccc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038841 DDLSOVCRBZVGJQ-CSKARUKUSA-N 438.480 2.489 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3ccc(-c4nnco4)cc3)C=C2)CC1 518547805 YARWEHGVQRCNHB-UHFFFAOYSA-N 432.527 2.342 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)ccc3Cl)cc2)C1 728143360 PUSDAJSANCXVDV-CQSZACIVSA-N 432.883 2.436 10 20 IECD COc1cccc(CNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)c1O 729858787 CCBWSQSQOBBDFP-UHFFFAOYSA-N 443.319 2.148 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 753861573 SHCYNAXZTMUHPA-UHFFFAOYSA-N 448.564 2.183 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)nc(C)n4C)CC2)cc1F 754211633 IZKCDRBHZHOSFO-UHFFFAOYSA-N 425.464 2.317 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 764251422 XXMQBJVRCAOBEV-MRXNPFEDSA-N 425.485 2.055 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)cc(Br)c1F 764667488 RUHGIEUBMHNOGU-UHFFFAOYSA-N 425.210 2.335 10 20 IECD Cc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1CC(C)C 767015588 IUZHVXUTPBOVHA-UHFFFAOYSA-N 432.496 2.296 10 20 IECD CCOc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c([N+](=O)[O-])cc1OCC 774357222 PVGOSGBXOLWMDG-UHFFFAOYSA-N 433.417 2.101 10 20 IECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCCC1 784555927 HFKDCDYUTAAGBY-GOSISDBHSA-N 430.549 2.311 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 785490236 XSLYILBHRUDRJE-OAHLLOKOSA-N 434.514 2.358 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)c3ccccc3)cc2F)C[C@H](C)O1 785621693 GNXOXFZVECPLKO-ROUUACIJSA-N 442.535 2.308 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1nnc2n1CCCCC2 786055689 MIZWHTYLNIMFMT-SJLPKXTDSA-N 441.532 2.095 10 20 IECD C[C@H]1C[C@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 787908799 GLESPOIZVXXZSH-OALUTQOASA-N 448.583 2.153 10 20 IECD Cn1ccc2cccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c21 788327295 IZIVVRGCONMTGA-SFHVURJKSA-N 433.512 2.135 10 20 IECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798377 GOFGRIQHDOXIAR-UHFFFAOYSA-N 443.475 2.056 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCO[C@]2(CCSC2)C1 789862926 YSJVKAKJCWTPSL-LAUBAEHRSA-N 435.615 2.027 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CS[C@H]1CCS(=O)(=O)C1 791247315 DUMALFAUDIFSID-KRWDZBQOSA-N 442.603 2.295 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3c(F)c(F)cc(F)c3F)cc2)C1 800901183 PKJRVXJVSCYIRW-LBPRGKRZSA-N 445.438 2.423 10 20 IECD COc1ccc2c(c1)OCCN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 801968222 XBECXRMMVRZDFZ-UHFFFAOYSA-N 429.492 2.182 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803308769 JRFOOFNANVJORP-ZWKOTPCHSA-N 441.528 2.293 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cc1F 803663158 RQIBYVVJPAXGPH-UHFFFAOYSA-N 430.499 2.382 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)c(N)c2)c(C)n1-c1ccccc1 803705832 QGTOKPAJLPXOLN-UHFFFAOYSA-N 427.482 2.363 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@H](C)N1CCOCC1 804771787 NZLICGAXOZYQFB-OALUTQOASA-N 442.560 2.100 10 20 IECD CCN(C[C@@H]1CCOC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769856 JCHBKGCCEGIBLL-HOTGVXAUSA-N 425.476 2.258 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 808346716 LOBSSDCGMOFBIV-RBBKRZOGSA-N 431.577 2.405 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 808622950 YWBUAAINWXQQQV-IBGZPJMESA-N 446.910 2.425 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(F)(F)[C@H](CO)C3)cc2F)C[C@@H](C)O1 812858889 FGXJGSJNAGILLE-UXLLHSPISA-N 429.483 2.005 10 20 IECD CC(C)(C)C(=O)NCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 826561685 GFEDSPDZZWTQGI-UHFFFAOYSA-N 436.464 2.496 10 20 IECD Cc1cccc([C@@H](CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)NC(N)=O)c1 914643917 YIIZSJGFPMYMBK-HXUWFJFHSA-N 426.517 2.362 10 20 IECD CC(=O)c1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c(F)c1 919809822 NGKDVEBFJQGSDO-UHFFFAOYSA-N 435.477 2.068 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1n[nH]cc1I 1321271111 QASJGBBOUCXULL-UHFFFAOYSA-N 449.632 2.189 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(CC)CC(=O)NCc3cccs3)CC2)cc1 1336434392 FFYXBVUHCARTJD-UHFFFAOYSA-N 444.601 2.434 10 20 IECD CC(C)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787540255 QDVWUBOCJJFCBC-CUWPLCDZSA-N 440.544 2.195 10 20 IECD O=C(Cn1ccccc1=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788180569 AUIQWFVCNOIGDR-UHFFFAOYSA-N 434.452 2.102 10 20 IECD O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1cc(O)nc(O)c1 1789689857 HBJSZTVVSPFAPJ-UHFFFAOYSA-N 438.400 2.186 10 20 IECD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800717847 AEUDWGXRTVSBDO-REBRKWNGSA-N 445.907 2.294 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@H](O)CC1)C2 1804291045 BWMUDYCUWYSUTC-PAAQBCISSA-N 430.501 2.006 10 20 IECD COCC1(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)CC1 1805998085 PCAHVUGGONMWEA-GQCTYLIASA-N 444.528 2.474 10 20 IECD CN(C)CC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806463141 IXWUGZHUTRWJOR-AUUYWEPGSA-N 432.908 2.027 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ccon1 1816591711 QFDJASFJPMVYLR-GOSISDBHSA-N 447.455 2.497 10 20 IECD Cn1ncnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290863 LAMUAZWAJGACSI-CYBMUJFWSA-N 445.867 2.223 10 20 IECD CN1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827424829 PGRWNPFAGJMPJD-LJQANCHMSA-N 430.549 2.068 10 20 IECD COc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427496 ZRWCHUDGWCJFKM-GOSISDBHSA-N 440.500 2.444 10 20 IECD CCOCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1837704173 PBTKNPNFNAMDHJ-UHFFFAOYSA-N 440.924 2.400 10 20 IECD CC[C@H](C)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839432619 SDTKYZBEXWRCRS-LHSJRXKWSA-N 440.924 2.257 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccccc3S(=O)(=O)N(C)C)CC2)cc1 110469873 KGVLHYNTVCUZLJ-UHFFFAOYSA-N 446.573 2.414 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4ncccc4C(N)=O)CC3)ccc21 486134822 OAASYJRYSDOZOR-UHFFFAOYSA-N 435.528 2.361 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n(C)c2ccccc12 550513559 OSBDSPCHKIAUAG-CALCHBBNSA-N 449.555 2.428 10 20 IECD CC[C@H](C)N(C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727225478 AMHYKCHNMCTBTN-SFHVURJKSA-N 443.571 2.472 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCc4nc(C)ncc4C3)cc2F)CC1 730114299 IWYJXIJSLBINKP-LJQANCHMSA-N 426.540 2.423 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC4(CC3)C[C@@H]4C(=O)OC)cc2F)CC1 733847708 PUXDKMFBCZWUQE-GOSISDBHSA-N 432.540 2.452 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)cc1 737078945 JKYXIXOLGQUMMV-HXUWFJFHSA-N 439.516 2.308 10 20 IECD CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 742567236 WDMRJEWQHGJNAM-INIZCTEOSA-N 438.532 2.093 10 20 IECD COc1ccc(CCN2C[C@@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc1OC 753640470 QTRMCXUSSXMFRU-YJBOKZPZSA-N 442.512 2.253 10 20 IECD Cc1cc(C(=O)NCCCN2CCNC(=O)C2)c(C)n1-c1cccc(Br)c1 753862766 KZCPNOYKGGPAEA-UHFFFAOYSA-N 433.350 2.408 10 20 IECD Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NCc1ccc(N(C)C)cc1 761753016 DQTJADCRNFBCPS-UHFFFAOYSA-N 432.590 2.221 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCCN3C3CC3)CC2)cc1 765798591 RKFJMGPNPMIRJI-VIOKTNGOSA-N 426.561 2.033 10 20 IECD CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCN1CCOC 766764561 OHRIFHDNOOSYIL-LJQANCHMSA-N 436.572 2.429 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](c4nccn4C)C3)CC2)cc1 767782599 WLUQBVGLIQIWJW-IBGZPJMESA-N 426.565 2.140 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 767937701 RLVGWKXOLWVAEQ-FGZHOGPDSA-N 434.556 2.229 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)c2)CC1 768015330 GKUHGARWVVWGIB-UHFFFAOYSA-N 428.558 2.304 10 20 IECD CCOc1ccc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c(O)c1 768200003 JOPGTNONRLSZEM-UHFFFAOYSA-N 435.502 2.425 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cnn(-c2ccccc2F)c1 768716454 WDROUUDOVRVJRU-UHFFFAOYSA-N 437.475 2.445 10 20 IECD CCOC(=O)c1c(NC(=O)CN2CCOc3cc(N(C)C)ccc32)sc(C(N)=O)c1C 774751539 FXKYOAWKTZNXPF-UHFFFAOYSA-N 446.529 2.236 10 20 IECD CC[C@@H](NCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1)c1ccccc1O 775526359 RBYRKRGSKSXPPT-GOSISDBHSA-N 442.559 2.238 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)N1CCc2ccccc2C1 777826610 OLSXXPWJDOSJCR-UHFFFAOYSA-N 445.903 2.315 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC4(CCCCC4)C3)CC2)cc1 778293954 JOGIYOQWLPCOKG-KTKRTIGZSA-N 427.545 2.462 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCO4)cc2F)C[C@@H](C)O1 782776912 VIBSTYBSHGUIDE-ZIAGYGMSSA-N 429.448 2.423 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccnc(N4CCCC4)c3)CC2)cc1 786503744 IJEXCBZHXXOVHV-UHFFFAOYSA-N 437.544 2.046 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1sccc1Br 788309675 GAFROBFIPLIKKP-UHFFFAOYSA-N 438.347 2.280 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C12CCCCC2 788321262 UKIFMWZXAYYZRI-LEWJYISDSA-N 429.561 2.384 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2ccc(S(C)(=O)=O)cc2)cc1 788954605 MCPDMJMHMLQBQO-UHFFFAOYSA-N 431.558 2.211 10 20 IECD C[C@H](NC(=O)C(=O)NCC(C)(C)N1CCC[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 793908576 KADQLFSDSLLHIY-MOPGFXCFSA-N 430.593 2.327 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@]2(CCCOC2)O1 796612284 NQLBLZUGMSBPHF-FLFXDLLNSA-N 449.567 2.325 10 20 IECD Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297833 HRNVDYPIZHXIHV-MGPUTAFESA-N 425.533 2.404 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 806948231 YXMAZKFDTAEUAD-QKPAOTATSA-N 425.476 2.445 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1F 810359113 AYKGRLKDNIIYQQ-UHFFFAOYSA-N 447.438 2.484 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCCC3)cc2)c1 915082721 XVDUAAJJZLCCFY-UHFFFAOYSA-N 429.542 2.474 10 20 IECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCc1ccc(N2CCSCC2)cc1 918618094 WRRQIIDLRZBIGA-UHFFFAOYSA-N 440.481 2.060 10 20 IECD O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NCc1ccc(N2CCOCC2)cc1 919790711 ZWZPPIOJGXSJIR-UHFFFAOYSA-N 441.551 2.284 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 919969540 PUIHZUXAMUXOKF-UHFFFAOYSA-N 431.420 2.396 10 20 IECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 1254720909 CBXYZZJKQZPGGJ-QZTJIDSGSA-N 430.574 2.386 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)cn1C 1322211940 DKPXNSBJBVBEKB-UHFFFAOYSA-N 448.526 2.372 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccccc1)C2)c1cc(O)nc(O)c1 1777848067 ZSHUXGZLZNBLNP-SHNIVAPPSA-N 437.496 2.334 10 20 IECD O=C(COc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795191553 GTKNLPHMRPURTD-YVWYUNDQSA-N 446.887 2.033 10 20 IECD CC(=O)O[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(C)C 1798277556 YAAXNVAYVDCCSI-IUIMINKPSA-N 446.500 2.043 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc2n(n1)CCCO2 1800718015 HUOGUWBABLFSMU-BTTYYORXSA-N 446.891 2.296 10 20 IECD O=C(CCCn1cccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801415418 UFNCXNKRXKMAAD-CWPLJXCYSA-N 447.919 2.236 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)nc3F)CC2)C1 1810549333 LVHLZSIIFNELBO-UHFFFAOYSA-N 432.427 2.325 10 20 IECD CCc1noc(C)c1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038784 PJFLYXRSMLLMOF-SOFGYWHQSA-N 427.457 2.193 10 20 IECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 726277398 NCUXLHVHJGZKLS-UXHICEINSA-N 432.565 2.026 10 20 IECD COc1cccc(CNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1O 729565998 KONSGZJHGABNSG-UHFFFAOYSA-N 425.489 2.176 10 20 IECD O=C(COCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)NCc1cccnc1 731187673 IBRMLVDGFLJXFG-UHFFFAOYSA-N 448.470 2.101 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4cccc(F)c4F)CC3)CC2)cc1 734486762 QCZYBDOZFZLKFN-UHFFFAOYSA-N 430.499 2.444 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCc1cccc(S(=O)(=O)NCCOC)c1 735587393 UTVDNWQVBXXONO-UHFFFAOYSA-N 435.546 2.439 10 20 IECD O=C(CN1CCC[C@@H](OCC(F)(F)F)C1)NCc1ccc(N2CCOCC2)c(F)c1 738318252 BOCUCWAYIKWUHH-MRXNPFEDSA-N 433.446 2.322 10 20 IECD O=C(CN1CC[C@@H](CN2CCOCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741809051 NZZBCEDOLGNAQL-KRWDZBQOSA-N 433.508 2.055 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)n1cccn1 742800802 SZEBEJIBBLJNTN-HZPDHXFCSA-N 435.475 2.289 10 20 IECD CS(=O)(=O)c1ccc(OCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 746373304 ZEZCASAULJHSMV-UHFFFAOYSA-N 436.505 2.151 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(CO)C[C@@H]3c3ccccc3)CC2)cc1 753078919 BRTASTIENAERHU-MGRKDHQOSA-N 449.551 2.182 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccc(OCc2ccccc2)cc1O 753539743 SYJZEHHDWBRSLI-LJQANCHMSA-N 432.542 2.096 10 20 IECD COc1ccc(N2CCN(CN3C(=O)C(=O)N([C@@H](C)c4ccccc4)C3=O)CC2)cc1F 754015191 XCCAYNMITVKTNX-INIZCTEOSA-N 440.475 2.466 10 20 IECD C[C@@H](NC(=O)c1ccccc1S(=O)(=O)CCN(C)C)c1ccc(N2CCOCC2)cc1 767327651 OOVNAEJUKUKELH-GOSISDBHSA-N 445.585 2.350 10 20 IECD C[C@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769761216 ZVHGRISPOULOGM-QGZVFWFLSA-N 447.557 2.127 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)cc2F)cc1 770480611 CKSQLCPWJLJIBN-QGZVFWFLSA-N 435.521 2.361 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CSc4nncs4)n3)CC2)cc1 771059025 XDFQGWJGLYRVHJ-UHFFFAOYSA-N 432.531 2.113 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(C(=O)N(C)C)c4)n3)CC2)cc1 771064338 AINPDDLAFPEBIG-UHFFFAOYSA-N 449.511 2.338 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cnc4sc(C)cn4c3=O)cc2F)CC1 771660799 DZWIRMZQPOHWAC-UHFFFAOYSA-N 429.521 2.275 10 20 IECD CC(C)N(CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 774792107 ZVEPTOALDHDENY-QZTJIDSGSA-N 436.572 2.291 10 20 IECD COc1ccccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 775050862 FUHWQYBGINWZJP-IAGOWNOFSA-N 443.519 2.423 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(OC)ccc3O)CC2)cc1 775642214 CLLKPHCQSSTVJQ-UHFFFAOYSA-N 434.514 2.084 10 20 IECD COc1ccc(OC)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 786649279 MPXFFIDMLDECQY-IBGZPJMESA-N 428.485 2.233 10 20 IECD COC(=O)[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCC1 792344205 IKUGRKXKCIMVMQ-BBWFWOEESA-N 435.540 2.472 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)cc1F 804853142 KXTRIOVHMAJFJZ-UHFFFAOYSA-N 445.539 2.237 10 20 IECD COCCN(CCOC)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 804990606 ZFYTWOJZMUJCOY-HXUWFJFHSA-N 448.608 2.353 10 20 IECD CCN(CC)CCO[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805025184 KANNASGMLMKQEQ-QHCPKHFHSA-N 444.620 2.498 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2cc(CC)ncn2)C1 806270609 XXWLGHKAFOYMTP-LJQANCHMSA-N 425.533 2.268 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386646 CYRBOBQCSKVMLX-UHFFFAOYSA-N 435.200 2.470 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807634518 HJBQGRUCUYFHCL-PKOBYXMFSA-N 442.512 2.492 10 20 IECD CC[C@@]1(CO)CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768412 JGKBQSZUULTUMN-VFNWGFHPSA-N 425.476 2.137 10 20 IECD COCCOCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284836 RBZRAGRLBOYNCE-UHFFFAOYSA-N 445.491 2.080 10 20 IECD O=C(Cc1csc(-c2ccccn2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335039 KYAZIFRJFOBDIA-UHFFFAOYSA-N 442.566 2.299 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2cnn(C(C)C)c2n1 918340530 QYJKBTASFSFYJT-UHFFFAOYSA-N 441.557 2.485 10 20 IECD CC(C)(C)c1nnc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 918440220 PKYLCCNKRNRPQJ-UHFFFAOYSA-N 435.525 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)CC2)cc1F 1327665187 CMDMWQOFSCMFQE-QGZVFWFLSA-N 425.501 2.147 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221482 ABXOWNZMSGWYIU-ZGFKMZHHSA-N 444.528 2.377 10 20 IECD CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787995707 WZKNJLCXCOEWHT-SCLBCKFNSA-N 448.614 2.354 10 20 IECD O=C(Cc1cc([N+](=O)[O-])ccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598945 OTFHEXVPVBZIMM-QDMKHBRRSA-N 444.419 2.035 10 20 IECD Cc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931050 KGZGANBNLNVOPR-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C1CC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)n[nH]2)C1 1818147868 NWJHYUFYXRZVPB-IBGZPJMESA-N 448.483 2.174 10 20 IECD CO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822447998 CUOQUSMSKZOTNF-KBXCAEBGSA-N 438.488 2.230 10 20 IECD Cn1ncnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1825720361 JYPJGTNVKQLFLC-INIZCTEOSA-N 447.923 2.427 10 20 IECD CCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828246963 LNKVBPBUAMUMAU-SNVBAGLBSA-N 440.616 2.352 10 20 IECD COc1ccc(N2CCN(CCCNc3cc4[nH]cnc(=O)c4cc3[N+](=O)[O-])CC2)cc1 29186150 WCMBZKSZPCZCMI-UHFFFAOYSA-N 438.488 2.464 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](NS(C)(=O)=O)C3)c2C)cc1 725796323 SEXBDFWWWNXMKO-SFHVURJKSA-N 447.557 2.077 10 20 IECD COc1ccc(N2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCCCO4)CC2)cc1 727109754 ITIJNSYZLAHKDZ-UHFFFAOYSA-N 440.500 2.327 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 730810170 BZCXKEXLIXGJMT-CHWSQXEVSA-N 426.466 2.297 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1F 731346284 UKICFGOQFCQHIT-UHFFFAOYSA-N 438.503 2.360 10 20 IECD Cc1nc(-c2cnn(C)c2)sc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 734320024 JECMHHARDRYOAY-INIZCTEOSA-N 438.557 2.484 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1 740813038 OQMLYOLXQXZHAB-UHFFFAOYSA-N 446.572 2.433 10 20 IECD CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 746037607 HBEAUBUJPAULAE-UHFFFAOYSA-N 426.542 2.477 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc(OC)cc1 746110019 ZYNWGPHAYFHKAL-UHFFFAOYSA-N 435.521 2.194 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cnn(CC(=O)N(C)C)c3)cc2F)C[C@H](C)O1 747554889 VLSCCFWPRWWVPV-GJZGRUSLSA-N 432.500 2.046 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1F 747604245 FAYKHPJLSYYBRL-UHFFFAOYSA-N 436.870 2.438 10 20 IECD CCCN(CCC)S(=O)(=O)N1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 752982012 LAQYOGKMZCATPG-UHFFFAOYSA-N 430.527 2.101 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 753644890 PCJKGWVLCABOTB-OAHLLOKOSA-N 448.541 2.255 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br 754787010 WTXPJFZRYOKXIM-SNVBAGLBSA-N 431.243 2.185 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c1 768361712 UXBGPTPHCRJXEK-UHFFFAOYSA-N 435.527 2.205 10 20 IECD CCc1nn(C)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 771161775 OPUJHYAOWJICQO-HUUCEWRRSA-N 432.496 2.208 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1 778217494 HFKPEARJKWGMQT-OILJVOJPSA-N 436.556 2.319 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(OC)c3)cc2F)CC1 782106530 DEGUJNLJZUXJQE-UHFFFAOYSA-N 432.471 2.370 10 20 IECD C[C@H](NC(=O)c1ccc(Br)s1)C(=O)OCC(=O)c1ccc(O)c(O)c1 783085423 UZZJPTIOPYCNKT-QMMMGPOBSA-N 428.260 2.466 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)c1 786122324 RXVSJIPFCHISHI-UHFFFAOYSA-N 431.558 2.459 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)N1CCN(C)CC1 786624239 CJUIEOGZXRVAIQ-QFIPXVFZSA-N 444.620 2.442 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 788913200 VIKYKIMAKGWEPE-JOCHJYFZSA-N 448.567 2.253 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 789822335 AEIOJOQUXOGEPR-HDICACEKSA-N 448.583 2.388 10 20 IECD COc1cnccc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826738 RBJYEDMHGMADRO-OWCLPIDISA-N 444.507 2.337 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1c(C)nn(C)c1C 789856182 PUJDJKOKMLKLME-LJQANCHMSA-N 429.590 2.474 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCN(C(C)=O)CC4)CC2)cc1 790117300 NNDIKYKHUOMDEG-UHFFFAOYSA-N 443.569 2.153 10 20 IECD CC[C@]1(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOC1 790243920 WFTMKHPXSQVZPT-QFIPXVFZSA-N 428.512 2.311 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cnc4n3CCCC4)cc2F)C[C@H](C)O1 792242430 KUTMATPDVPFEKD-HOTGVXAUSA-N 444.507 2.445 10 20 IECD CCN1CCC(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 793816026 XHGVNSQRCUCWTA-UHFFFAOYSA-N 438.519 2.221 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@@H]3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 793936994 AJAQJDDBHIEHIU-IAGOWNOFSA-N 433.549 2.304 10 20 IECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C2CC2)O1 803449980 BFHPIRZQXRAIJO-IFXJQAMLSA-N 437.487 2.399 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](CNC(=O)C(C)(C)C)C3)ccc21 803686159 XQHJOISCCFCZCU-GOSISDBHSA-N 428.577 2.086 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(CS(C)(=O)=O)c1 803704178 ZFYQEKXXCCNANE-UHFFFAOYSA-N 445.585 2.351 10 20 IECD CC(C)(C)[S@](=O)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806194907 MUDSBQFZSHILMQ-ILHIWHGASA-N 445.532 2.036 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 807101797 BSWNPPQOHZXFFT-OAQYLSRUSA-N 436.556 2.027 10 20 IECD CCC(O)(CC)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771185 SHRXICNBVPEJQD-OAHLLOKOSA-N 427.492 2.430 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(O)c(OC)c3)CC2)cc1 916196513 JLNOTQQSBAWUJM-UHFFFAOYSA-N 428.533 2.421 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)cc2)C1 917833567 BEMUSDLYSINPQZ-KRWDZBQOSA-N 448.483 2.412 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4cccs4)CC3)cc2)C1 918118247 PSCCDNKCKZVEKH-IBGZPJMESA-N 441.601 2.477 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CC(=O)N(c2ccccc2)C1 921076977 LCNLKHUZPYUJAR-KRWDZBQOSA-N 426.492 2.392 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1325913535 JPZJYVCAVAAEMW-QGZVFWFLSA-N 437.949 2.105 10 20 IECD C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816013868 BAHBBOUBSUSCIN-XJKSGUPXSA-N 439.476 2.055 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C(=O)c1ccccc1 1816713900 VKDJEFBCWANZDH-INIZCTEOSA-N 435.440 2.405 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n(C)c1 24207251 IEDRTXDHJBBFBM-UHFFFAOYSA-N 448.589 2.164 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)n(C)c2ccccc12 472775545 PXHYTYPDQQDZDP-UHFFFAOYSA-N 447.539 2.443 10 20 IECD Cc1ccc(NC(=O)[C@H](C)N(C)Cc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 731843102 VKLLIEUICIZAJF-KRWDZBQOSA-N 447.557 2.181 10 20 IECD Cc1nc(CN2CCC(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)oc1C 732305902 GYMGHUNNZHKKRI-UHFFFAOYSA-N 436.534 2.011 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(CC)[C@@H](C)CS(=O)(=O)CC)cc2F)CC1 733646409 HFCRLPFIUCQKDL-KRWDZBQOSA-N 442.601 2.322 10 20 IECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)no1 740491524 MAADUZPAAYAFQI-UHFFFAOYSA-N 426.395 2.347 10 20 IECD COCCN(CC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(OC)c(OC)c1 746474920 PBCXKFGSBLVUON-UHFFFAOYSA-N 435.565 2.262 10 20 IECD C[C@H](O)C[C@@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748374097 HQJSGGWYYBOMFK-OLZOCXBDSA-N 437.474 2.238 10 20 IECD COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NCc3ccccc3O)cc2)C1 748444107 VLQYWMSLMSORPG-MRXNPFEDSA-N 447.513 2.288 10 20 IECD CCN1CCO[C@H](C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 748457179 GXARVKSBFPRKNV-KUHUBIRLSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3COc4cc(F)cc(F)c43)CC2)cc1 753304796 WELUNBXHKAPDEI-OVKVCFKUSA-N 443.450 2.428 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc4c(c3)OCCO4)CC2)cc1 754001823 WPWPLKIUEUWUQV-NRFANRHFSA-N 427.545 2.081 10 20 IECD CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 760886998 QIOIXTQEOAHCFA-MRXNPFEDSA-N 446.573 2.225 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccn(C)c4c3=O)cc2F)C[C@@H](C)O1 768517998 XJBDFPGMOSSIPI-IYBDPMFKSA-N 426.492 2.409 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1C(=O)c2ccccc2C1=O 769864138 FLLOSJWTEVRFLR-UHFFFAOYSA-N 425.460 2.353 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1 772777604 WFIIIDPUTLFYCV-CLFYSBASSA-N 425.441 2.031 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C 773723446 SIXOXBXKWILXIP-LLVKDONJSA-N 430.411 2.462 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773987785 HKZWNYJZPYTOEX-MRXNPFEDSA-N 447.557 2.273 10 20 IECD COc1ccc(N2CCN(CCN[C@H]3CCS(=O)(=O)c4ccc(F)cc43)CC2)cc1 775497606 SRUWISHDMBYHMT-NRFANRHFSA-N 433.549 2.465 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 777960412 GQJHPWRZASFLQM-UHFFFAOYSA-N 437.493 2.444 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCN4C(C)=O)c2)CC1 780407084 FLGACFILAVSXNK-UHFFFAOYSA-N 442.541 2.065 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)cc4c3CCC4)c2)CC1 780407988 SLLWARCMXMKXNL-UHFFFAOYSA-N 443.525 2.343 10 20 IECD CC(=O)N[C@@H](CC(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 783405191 UIPFGCBTPHMLAO-FQEVSTJZSA-N 442.539 2.109 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)N(C)C)cc1 793716377 AZFKCNHWACKQDS-CVDCTZTESA-N 438.572 2.428 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]3C)CC2)cc1 795120881 JVKGISQKJFITHV-ONTIZHBOSA-N 446.636 2.145 10 20 IECD C[C@@H]1CN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 797356786 FRYQSPWECJMYNC-ZLOXQWCVSA-N 436.420 2.390 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3cccc(-n4cncn4)c3)cc2)CC1 805022833 FTWQYZMQLSJXDX-UHFFFAOYSA-N 432.528 2.436 10 20 IECD CC(C)(C)OC(=O)NC1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1 807291322 CKNGOQBOJOASOU-UHFFFAOYSA-N 428.533 2.243 10 20 IECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2 807514588 YQSYUQAKZZSXRS-ACRUOGEOSA-N 444.576 2.166 10 20 IECD C[C@H](NC(=O)C(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(N(C)C)cc1 807670757 HYWZHASGXGJUHR-IBGZPJMESA-N 437.588 2.490 10 20 IECD CCN(C[C@H]1CCCO1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769397 UDQZZSDSQXUTGQ-MAUKXSAKSA-N 425.476 2.401 10 20 IECD Cn1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c2ccccc21 809319274 BHNACXQRFDLODW-GOSISDBHSA-N 436.512 2.145 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCc3nnn(C)c3C2)NC(=O)OC(C)(C)C)cc1 810448207 WJHCIFLOVCCNID-QFBILLFUSA-N 442.564 2.368 10 20 IECD CCN(CC)CC[C@@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816487536 QSJXMHXIFWAJBM-HNNXBMFYSA-N 441.575 2.077 10 20 IECD Cc1nnsc1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 817020327 MJQSWICLZYQBTO-UHFFFAOYSA-N 449.470 2.191 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 916565428 DNNMIIMKTGUIJI-PCCBWWKXSA-N 427.545 2.435 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(Cl)c3)cc2)C1 918464095 QBEOGHYUHJOPGL-CQSZACIVSA-N 432.883 2.436 10 20 IECD C[C@@H](Cn1ccnc1)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919784223 MUKZYACXPRMODV-KRWDZBQOSA-N 438.511 2.027 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(C)CC(=O)Nc3cccc(OC)c3)CC2)cc1 1320365074 GVRLJWRLDPEOAC-UHFFFAOYSA-N 440.544 2.313 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 1321269194 ZDBXEYWHHSTUSE-DOMZBBRYSA-N 434.518 2.284 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1 1781531095 LNOQSTQEAPDPPZ-FQEVSTJZSA-N 435.839 2.043 10 20 IECD COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nc1 1827959950 IMZLELGVILLZIB-IBGZPJMESA-N 440.500 2.444 10 20 IECD O=C(COc1ccc(O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847433864 NXOZPPUDHUFQHT-IRXDYDNUSA-N 432.860 2.351 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 727178602 XODAQHNERBFBNI-YRNVUSSQSA-N 439.353 2.339 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)c(F)cc3F)cc2)C1 729784336 IONKOTQBWHZXQQ-CYBMUJFWSA-N 434.418 2.061 10 20 IECD CCn1cc(CN(C)CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cn1 733796804 WODUVMDCJCPJIM-UHFFFAOYSA-N 429.546 2.273 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nc(CC)n(-c4ccccc4)n3)nc12 735548167 SMHBJVMDMBVBIY-UHFFFAOYSA-N 436.428 2.112 10 20 IECD O=C(NC[C@H]1CCCO1)c1c(NS(=O)(=O)C[C@H]2CCCO2)sc2c1CCCC2 735646303 OTVJGIJHQUTFFM-ZIAGYGMSSA-N 428.576 2.456 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(N4CCOCC4)c3)CC2)cc1 743305983 SLOOIBSFPYQBHF-UHFFFAOYSA-N 439.560 2.476 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1OC 745822276 IQWNKJXPLBOTDQ-UHFFFAOYSA-N 433.439 2.305 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4ccccn4)nc3O)CC2)cc1 746846656 DTFFPEJMYVVTHS-UHFFFAOYSA-N 433.512 2.410 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 749638481 DIVAKRIKVBOBAG-UHFFFAOYSA-N 436.509 2.298 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c1 751057809 IIJYRDZNCLZOII-UHFFFAOYSA-N 432.498 2.121 10 20 IECD CS(=O)(=O)Cc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751136907 NPUSOMWUNILDTI-SFHVURJKSA-N 439.555 2.307 10 20 IECD CCc1nnc(O)c(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1CC 754571308 VEFARWBTODVFKD-UHFFFAOYSA-N 431.512 2.407 10 20 IECD COCCc1noc(CN(C)[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 758805114 SCNUXTZBTSEPPT-CQSZACIVSA-N 448.479 2.493 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cnn(C(F)F)c1 768217562 NJSHDQPJPPSKOQ-UHFFFAOYSA-N 432.475 2.065 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](c1cccs1)N1CCOCC1 774812589 YLSVZPNKKRRQDG-GOSISDBHSA-N 431.558 2.382 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(N(C)C)cc1 774855329 CAVTZKYBBRTYEH-HTAPYJJXSA-N 442.535 2.259 10 20 IECD C[C@H](NC(=O)CNC(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(F)cc1 775258166 RYZIARUHDLNQGS-MSOLQXFVSA-N 442.535 2.307 10 20 IECD COC[C@H](C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 778528691 GSQLGFLJXINGDX-HRCADAONSA-N 447.511 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)CN3[C@@H]4C[C@H]5CC[C@]4(CS3(=O)=O)C5(C)C)CC2)cc1 779957755 IPVKRZMLTMDTGN-HCLVMJGWSA-N 447.601 2.184 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCNc1nccc(C(F)(F)F)n1 786981983 SZHVVFQLBAYURV-UHFFFAOYSA-N 438.454 2.138 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCOCC3)cc2Cl)C1 787755914 JUWXPJSUYGNMPJ-IAGOWNOFSA-N 436.984 2.029 10 20 IECD CCOCCCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H](C)C1 788911474 OAQVZUZEMLYCMM-DENIHFKCSA-N 430.593 2.156 10 20 IECD Cc1cccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789801368 RXGLKAVIELCEEH-NRFANRHFSA-N 426.492 2.346 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@@H](c2ccccc2)C1 789841046 QTUFCLMSJBCGRF-LJQANCHMSA-N 425.504 2.419 10 20 IECD C[C@@H]1CCCC[C@@H]1CCNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793724953 PQLSBZKOASKVHH-RLLQIKCJSA-N 428.577 2.337 10 20 IECD CO[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771790 PKDLLJBICYBMQC-WHEQGISXSA-N 447.447 2.453 10 20 IECD Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 800596906 IQDWHOFGVGZJRW-UHFFFAOYSA-N 434.399 2.273 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN2C(=O)NC[C@@H]2C1 802432721 JKYXPNZVDXMBOR-LJQANCHMSA-N 435.532 2.213 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297529 YYWQGLLEUABQEI-MSOLQXFVSA-N 441.528 2.293 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661860 BYFKHZMLIDFDSG-RHSMWYFYSA-N 436.528 2.270 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3nc(C(C)C)cs3)cc2F)CC1 805007903 UNSXWOCOILGMPL-UHFFFAOYSA-N 447.580 2.480 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@]4(CCCOC4)C3)cc2F)CC1 805009386 JOWAVXJQAYACOU-DEOSSOPVSA-N 446.567 2.003 10 20 IECD COCCN(CCN(C)C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807955264 RCMHBQUWFHMFSY-QGZVFWFLSA-N 439.000 2.229 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(S(N)(=O)=O)c(C)o1 819525597 KUCTYMZTJYCXEC-UHFFFAOYSA-N 437.518 2.238 10 20 IECD CCN1CCN(c2ccc(N/C=C3\C(=O)NC(=S)N(CC(C)C)C3=O)c(C)c2)CC1 920980203 CJWZLJITUOTOKS-QGOAFFKASA-N 429.590 2.332 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1778346878 JKOKSMDDHWCLBZ-AHSVPJFESA-N 430.501 2.083 10 20 IECD CC[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)CC1 1787294929 DMCTUIQMCRYWQX-QAGGRKNESA-N 431.533 2.303 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccs3)C[C@@H]21 1792218516 JCMIZTOOHBDNJN-XQVRWPTMSA-N 444.509 2.172 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)(F)F)c1)c1cc(O)nc(O)c1 1794881780 UVUXNLWKKCTKQF-BTTYYORXSA-N 436.390 2.472 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)ccn1 1796934453 GJLHDTBZCONTHN-GGPHIMKMSA-N 447.495 2.135 10 20 IECD CC(C)n1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1797107074 JPDDHEWLJOFDFV-BTTYYORXSA-N 433.896 2.489 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2CCN(C(=O)C(O)O)[C@@H]2c2cccnc2)cc1 1811262496 PSUPKLPTUGLEHY-RBBKRZOGSA-N 448.523 2.119 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)on1 1825019779 QMULCWIXBLLFSO-GOSISDBHSA-N 428.489 2.265 10 20 IECD CC[C@H](OC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(N)=O 726996202 FWXHROYWOSKWDZ-ZWIPKHHJSA-N 443.344 2.457 10 20 IECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 727139745 MGLUFRISNQKTKS-SFHVURJKSA-N 439.578 2.087 10 20 IECD CCOc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1C 727614955 FGCKOMSWAWRXPN-SFHVURJKSA-N 438.528 2.350 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2nc(-c3nc[nH]n3)no2)cc1 729351508 BJMCLQRZMJXILC-QGZVFWFLSA-N 425.493 2.061 10 20 IECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)NCC(=O)N1CCCC1 731034633 KFNSJKMQGXKDRD-UHFFFAOYSA-N 430.549 2.203 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(CS(N)(=O)=O)cc2)cc1 736554875 ZLABEFJHNMDSAR-OAQYLSRUSA-N 431.558 2.363 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCN(S(C)(=O)=O)CC1 745416244 HERGDWQLYLHXIW-UHFFFAOYSA-N 434.356 2.110 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 746989144 DYAHYJVGUGCGQS-GASCZTMLSA-N 442.491 2.102 10 20 IECD COC(=O)[C@@H](O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 747417585 UQSUCJJFQAEORC-QAPCUYQASA-N 441.475 2.212 10 20 IECD CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 749648672 NUHGKCDKTDULGA-UHFFFAOYSA-N 432.546 2.004 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)[C@@H](O)c3cccc(F)c3)CC2)cc1 752905623 NYLNWKZZMPHSKZ-HTAPYJJXSA-N 430.524 2.378 10 20 IECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 755071836 HLMWCSUMQFFVHB-KRWDZBQOSA-N 446.529 2.392 10 20 IECD C[C@@]1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCO1 755122301 NMCUNMQOZFINKI-QFIPXVFZSA-N 428.512 2.311 10 20 IECD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(Br)cc(Cl)c1O 756535425 PYIUOSNTEIBZFO-LLVKDONJSA-N 440.791 2.036 10 20 IECD O=C(NC[C@@H](CO)Cc1ccco1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 761124014 KJVJSJWAQWCYKX-ZDUSSCGKSA-N 436.511 2.429 10 20 IECD Cn1cnc2cc(NC(=O)C(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)ccc21 769026587 XNYJUAFVHGNMHE-UHFFFAOYSA-N 446.555 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4Cc5ccccc5C(=O)O4)n3)CC2)cc1 771067994 QDQKHXBIUQNDRQ-FQEVSTJZSA-N 448.479 2.424 10 20 IECD COCCOc1ccc(-n2nc(C)c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)n2)cc1 773744370 AFTUZNDWTOLBPU-AWEZNQCLSA-N 426.473 2.373 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1OC 773844161 CPNFXBFKFBZGPA-AWEZNQCLSA-N 448.545 2.339 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Cc1ccccc1 774926879 XSAGIZXRUFYVIF-FGZHOGPDSA-N 439.556 2.189 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3cccc(Cl)c3)cc2)C1 775131350 SJLSTPMCJKFTFA-SFHVURJKSA-N 442.947 2.017 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 782107684 SSDIXRDDYIPYDV-CQSZACIVSA-N 431.514 2.496 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 785302103 ATXPSXHXSBTRSP-AWEZNQCLSA-N 439.443 2.133 10 20 IECD CCOC(=O)[C@H](C)N(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CC1 787365644 AAUTYEIXDUZCKY-INIZCTEOSA-N 447.557 2.340 10 20 IECD Cc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788321560 XMOKAIOVPOXEJD-UHFFFAOYSA-N 438.572 2.038 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1OC 788933624 QZLPKFUTUIGLTN-UHFFFAOYSA-N 441.528 2.288 10 20 IECD COC1CCC(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789819484 NLEDUWVLQRJOBD-XNYRCJLNSA-N 435.540 2.377 10 20 IECD CC(C)CN(CCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789823078 YOZMBILDCGPZOH-ROUUACIJSA-N 436.572 2.102 10 20 IECD COc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789826736 RBJYEDMHGMADRO-JYJNAYRXSA-N 444.507 2.337 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 789864519 PBFCTKVOMKZHSJ-UHFFFAOYSA-N 430.549 2.378 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3Cc3ccccc3)cc2)C1 793716742 FDUWYXYAGASCPS-FYYLOGMGSA-N 448.567 2.238 10 20 IECD C[C@@H]1CCC[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793725701 RLTYBPIQFOQWJJ-HBFSDRIKSA-N 428.577 2.337 10 20 IECD C[C@H](CC1CCCCC1)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793733633 NLGVGJRQFIJYLF-YLJYHZDGSA-N 428.577 2.480 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1 802609493 BUCSPALLMNAKMX-UHFFFAOYSA-N 433.530 2.376 10 20 IECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677021 CUHSCUNTMLLZLI-IAGOWNOFSA-N 437.606 2.352 10 20 IECD COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 804969491 QPOHZGOMEWSCAM-SFHVURJKSA-N 433.402 2.299 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C(F)(F)F)[C@H](CO)C3)CC2)cc1 806620322 SFVSTHIKFKGZLR-QFBILLFUSA-N 444.498 2.020 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807678849 KRWSJZAGRZMRHD-SJLPKXTDSA-N 431.558 2.299 10 20 IECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1 817943479 OHAUAFRTTIOTES-UHFFFAOYSA-N 440.484 2.167 10 20 IECD CCNC(=O)NC(=O)COC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 913362133 UEJBILRUQLZDMF-XFXZXTDPSA-N 441.556 2.118 10 20 IECD O=C(NCCNS(=O)(=O)Cc1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916517277 OGXIHOOXHUTSRY-FQEVSTJZSA-N 447.557 2.202 10 20 IECD CS(=O)(=O)C[C@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 917120752 MTGCQQBQRKMLJH-HNNXBMFYSA-N 440.521 2.157 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)NCc1ccc(N3CCOCC3)cc1)C[C@@H]2O 919791974 LCAIDABJNGXAMN-IBGZPJMESA-N 427.501 2.299 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)Cn4ccnc4)CCO3)C2)cc1 1781750331 BPTDDMSCKNJVNH-RUZDIDTESA-N 447.539 2.434 10 20 IECD Cc1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1787706983 NSTAUPMILFWLRS-AXHNFQJDSA-N 445.903 2.362 10 20 IECD COC[C@H](C)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1806142953 JYWMLVRIIKLNMR-SFHVURJKSA-N 440.544 2.293 10 20 IECD Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1808000160 XMKCGWKUZMFETD-KSFYIVLOSA-N 436.468 2.352 10 20 IECD CCOCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1809202444 PSTSKBBZOKKPRH-UHFFFAOYSA-N 426.517 2.047 10 20 IECD Cn1nncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830734675 BDDYFIRNGDPLTA-MRXNPFEDSA-N 447.923 2.427 10 20 IECD O=C([C@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832883159 YRFYQGRFQGSKCE-VUTZTEFLSA-N 444.528 2.473 10 20 IECD COC(=O)[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 728539804 QRJFBLGAQWGQPM-ODUNQGDFSA-N 440.568 2.130 10 20 IECD CCCNC(=O)CCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729525738 KYVUHHWQYICPQH-UHFFFAOYSA-N 442.539 2.255 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC)c(OC)c3)cc2F)CC1 730391716 SVDXGRVJQRFCPZ-UHFFFAOYSA-N 444.507 2.240 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc(N4CCCC4=O)cc3)c2)CC1 740609960 PXVDTEOPBWFMQP-UHFFFAOYSA-N 442.541 2.316 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1 742057030 HXMUNDXTNIEHLT-UHFFFAOYSA-N 431.558 2.277 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746016096 NCILEIGARFYYTE-NRFANRHFSA-N 435.528 2.261 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)C1 749178596 MJZLGBFQSSZIGZ-FCHUYYIVSA-N 435.572 2.312 10 20 IECD CC[C@@H](CCO)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755939749 UPZVXMRLFWTUOF-KRWDZBQOSA-N 430.528 2.150 10 20 IECD CC(C)c1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 756084979 STTNEXBVIHYHBS-OAHLLOKOSA-N 429.546 2.223 10 20 IECD CCc1ccccc1NC(=O)CN1CCN(C(=O)CN(C)c2ccc3c(c2)OCO3)CC1 756653635 MNGRBPMOTQTAHK-UHFFFAOYSA-N 438.528 2.197 10 20 IECD COc1cc(N2CCN(C(=O)NCCCn3nc(C)cc3C)CC2)cc(OC)c1OC 760087145 CENSGRPQMIKEOE-UHFFFAOYSA-N 431.537 2.448 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NCc1ccc(N(C)C)cc1 761248869 HSUXVBYEGHAODX-UHFFFAOYSA-N 427.548 2.001 10 20 IECD COc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCCC[C@@H]4O)CC3)CC2)cc1F 769164516 BNYHVWSTUVBZHF-SFTDATJTSA-N 434.556 2.434 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(Oc4ncccc4F)CC3)CC2)cc1 773975649 IFCWFZAWDHVERE-UHFFFAOYSA-N 428.508 2.421 10 20 IECD O=C(Cc1n[nH]c2c1CCCC2)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777183230 WKMNGVCAWYBQSG-UHFFFAOYSA-N 449.534 2.403 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3c3cn(C)nc3C)CC2)cc1 778326311 NGBRFNGIIWKPIE-NELJVSICSA-N 437.544 2.306 10 20 IECD CC[C@](C)(CCO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 778435939 NNIIXXWVBBYBSU-LJQANCHMSA-N 437.474 2.382 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@H](C)CO1 779335161 CYPIWBQMXRSUAV-SJORKVTESA-N 428.512 2.261 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 779339715 DJIXIPPYEPJVGU-MRXNPFEDSA-N 447.605 2.367 10 20 IECD CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 783833884 GHQBMLUVASHGLZ-QWHCGFSZSA-N 427.523 2.329 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N(C)C 784027767 LKJTWKZAXHWWLI-UHFFFAOYSA-N 443.500 2.489 10 20 IECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 784720438 JCHRXJZKZACFJU-UHFFFAOYSA-N 426.469 2.468 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)cc3F)cc2)CC1 786119975 GRVDCZSGDCXPJH-UHFFFAOYSA-N 427.448 2.251 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCC[C@@H]3C(=O)N3CCCC3)cc2)CC1 787326835 ZJYLTDSHWLXNHE-GOTSBHOMSA-N 440.588 2.400 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN1CCC(C)CC1 787664024 MOIHIXSLAPEUEQ-UHFFFAOYSA-N 426.355 2.351 10 20 IECD CC(C)Oc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787989136 PHYYWQOXSFDPKJ-LJQANCHMSA-N 427.501 2.398 10 20 IECD CC(C)CN1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789819435 MVZDXJHCBDUCGT-QWFCFKBJSA-N 448.583 2.150 10 20 IECD C[C@H]1CC(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)O1 789953243 BCYVTSUTNJQQIQ-KBPBESRZSA-N 443.466 2.230 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2C(C)C)cc1 797432947 ZHHJLBCRMQXVNQ-UHFFFAOYSA-N 427.504 2.185 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOC[C@H]1[C@@H]1CCCO1 804395413 RRPZKGMAAPJHRN-RDJZCZTQSA-N 438.527 2.275 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 804940537 APYLGHLMOSDGLX-UHFFFAOYSA-N 425.576 2.262 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)Cc3ccncc3)cc2F)CC1 805007386 JVODLTBEXURGIT-UHFFFAOYSA-N 427.524 2.028 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H]1Cc1ccccc1 806493694 BBAYMVNUDVSTOT-VWNXMTODSA-N 449.599 2.457 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)c1 808078960 ZZBZPQPMTOXWTF-UHFFFAOYSA-N 425.532 2.341 10 20 IECD CN(Cc1ccc(O)cc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851326 BTIURJXIXWHHTA-UHFFFAOYSA-N 436.556 2.199 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](O)c3cnn(C)c3)c2C)cc1 809555151 BREOWNNUAAIFSI-HXUWFJFHSA-N 425.441 2.074 10 20 IECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cc(Br)cc(C)c2O)CC1 809711630 GSSHHKHFUDTUDL-UHFFFAOYSA-N 434.352 2.405 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cn2n1 810349881 MXYXJZSDSAWVRA-KBPBESRZSA-N 440.479 2.045 10 20 IECD O=C(N[C@H](CO)C1CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812376575 XFGGOJJMDMMELP-GOSISDBHSA-N 449.485 2.382 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cn2cc(S(=O)(=O)N(CC)CC)ccc2=O)cc1 916502937 CSJYAKBTHKNUAA-UHFFFAOYSA-N 448.589 2.041 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H]1CCN(CC(F)(F)F)C1 918208676 HOHRRZZLTFTOJM-HNNXBMFYSA-N 432.462 2.470 10 20 IECD Cc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n(-c2ccccn2)n1 920939410 GJZFXLSJJREWFK-UHFFFAOYSA-N 440.529 2.132 10 20 IECD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1353860819 IRRGJMSDWIOOSP-GOSISDBHSA-N 438.933 2.089 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccon1)C2)c1cc(O)c(O)c(Cl)c1 1781121358 QZBHRNXJPFAOGV-OXQOHEQNSA-N 435.864 2.181 10 20 IECD CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cc1C 1782007075 IRSCMPGCCKRSDW-NRFANRHFSA-N 448.907 2.033 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cc(C2CC2)on1 1802786819 YLELYKHETXWURM-VFNWGFHPSA-N 449.467 2.387 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccc1O 1805197392 RFWPLNDVGVMUFF-QVKFZJNVSA-N 434.452 2.227 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C(=O)C1CC1 1814807970 AECGWGFLPIMRNM-GOSISDBHSA-N 448.483 2.174 10 20 IECD Cn1ncnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830735010 IYJDNEMRFLDRTR-MRXNPFEDSA-N 447.923 2.427 10 20 IECD COc1ccc(N2CCCN(C(=O)CCC(=O)N3CC(=O)Nc4ccccc43)CC2)cc1 108431842 MKEKEXNGJMOHMG-UHFFFAOYSA-N 436.512 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cccc(NC(C)=O)c3)CC2)cc1 729877258 RWSKBYYGHAWXDZ-PMERELPUSA-N 429.542 2.251 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H](N3CCCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730808690 OSPUDSRLRLZJQS-HXUWFJFHSA-N 444.601 2.484 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(CS(N)(=O)=O)cc2)cc1 736554874 ZLABEFJHNMDSAR-NRFANRHFSA-N 431.558 2.363 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(-n4cnnn4)ccc3F)cc2)CC1 737190859 OSQUGOCDQSCIQO-UHFFFAOYSA-N 437.479 2.293 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nn(-c4ccccc4)c(C)cc3=O)CC2)cc1 742927105 IKYGPAXSVKXMDK-UHFFFAOYSA-N 447.539 2.102 10 20 IECD CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 747464508 IIORQWIQZQIOHM-UHFFFAOYSA-N 429.542 2.129 10 20 IECD O=C(CNC(=O)NCc1ccc(F)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405825 JWSSYCLBQRESQR-UHFFFAOYSA-N 432.471 2.042 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751294230 LCPQFVSKKRHHEU-IBGZPJMESA-N 432.542 2.441 10 20 IECD CCNC(=O)Nc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754213951 XQDZEXOTDDJDAI-UHFFFAOYSA-N 443.479 2.263 10 20 IECD Cc1oc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1S(N)(=O)=O 755672369 PYWLVKBNMRDLMD-GFCCVEGCSA-N 429.445 2.236 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CCCN3C(=O)C(C)(C)C)CC2)cc(OC)c1OC 759240505 TVLVVADZIMKDOA-KRWDZBQOSA-N 433.549 2.398 10 20 IECD C[C@@](O)(C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1)C(F)(F)F 767897937 UPUPJVSNGOLWER-HXUWFJFHSA-N 447.473 2.304 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cccc21 769260058 IWYIIFRYKMUMQF-MRXNPFEDSA-N 436.512 2.248 10 20 IECD Cc1cc(Br)cc(CNCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1O 776080300 GWJUSXWYMVPVGZ-UHFFFAOYSA-N 444.307 2.439 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC[C@H]3CCCC[C@@H]3C)CC2)cc1 785528231 OTXNSFRUHRRGRS-VQTJNVASSA-N 430.593 2.266 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)nc12 785807454 OMLHGOZOSJBOLE-HBJVGIJOSA-N 429.351 2.011 10 20 IECD C[C@@H](OC(=O)c1ccc2nnnn2c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 786049465 CWMVTGUPHUOIBT-GFCCVEGCSA-N 441.403 2.084 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCCC3CCCC3)CC2)cc(OC)c1OC 788219831 CUIGZYNQGUXTPH-UHFFFAOYSA-N 433.549 2.448 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@@H]1CCCN1C1CCCCC1 789799569 JSRGNLHBXHZTIP-FQEVSTJZSA-N 446.567 2.192 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(n4ccnc4)CC3)cc2F)C[C@@H](C)O1 789826661 PYGPWOUHIPUCAB-IAGOWNOFSA-N 443.523 2.116 10 20 IECD C[C@@H](NC(=O)C(=O)N(CCCO)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 803301089 YSCVUIGAHAMUHY-LJQANCHMSA-N 425.529 2.112 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 807290839 AYPQRWONBOPFNG-QFIPXVFZSA-N 446.551 2.029 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@H]1CCC(F)(F)C1 807570921 WTQQEAJCQQVXNR-IBGZPJMESA-N 434.531 2.386 10 20 IECD C[C@@H](O)C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 809460999 DAQJDEBYQKCMDH-DENIHFKCSA-N 439.556 2.153 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cccc4c3OCC(=O)N4)CC2)cc(OC)c1OC 810255534 LTYLXZAUCOQWCB-UHFFFAOYSA-N 442.472 2.397 10 20 IECD O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918297782 SECFWJPUOZTYJQ-FQEVSTJZSA-N 437.496 2.431 10 20 IECD COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 919859599 BDJKKRNWMYHALO-UHFFFAOYSA-N 445.472 2.395 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1781687187 ALEDNQMTYZQCSA-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(CCCn1cccc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007746 NZSOUZSALMQFHB-JOCHJYFZSA-N 447.919 2.477 10 20 IECD Cc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1803934118 AAGINNUEBZSYQU-QDMKHBRRSA-N 435.546 2.246 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[nH]n1)c1cc(O)nc(O)c1 1817847199 NZXKTNYLXWMNJS-XOUADPBQSA-N 427.461 2.089 10 20 IECD CCc1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)co1 1820749547 RHNPISNKSZHDQK-JTQLQIEISA-N 429.458 2.039 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822783506 GWEXMYDAPUZKLR-XJKSGUPXSA-N 439.476 2.055 10 20 IECD CO/C=C(\C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199167 OARJCNOOKTUNFM-AJKMFMQHSA-N 445.497 2.436 10 20 IECD Cc1c(Cl)cccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847367428 OTKOVKPHLWRIAC-GJZGRUSLSA-N 437.974 2.324 10 20 IECD CCN(C(=O)[C@@H](C)OC(=O)c1sc2nc(C)cc(C)c2c1N)[C@H]1CCS(=O)(=O)C1 29033587 FJLJFQAHFXQDBQ-OLZOCXBDSA-N 439.559 2.076 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)N3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 726502539 BCXSASBJKAZGCD-XHSDSOJGSA-N 446.523 2.309 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(c4ccc(C(N)=O)cn4)CC3)cc2)CC1 731049730 MMFDXFXCDPPUSN-UHFFFAOYSA-N 436.560 2.449 10 20 IECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 734074908 UNMNDNDWXHBGFC-QGZVFWFLSA-N 446.525 2.250 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ncccc3C(N)=O)CC2)cc1F 734277324 UOPCJRMXUROVGG-UHFFFAOYSA-N 428.512 2.198 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(F)c1 737156703 CXABCAQBIQEPHE-CQSZACIVSA-N 429.448 2.265 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 740610306 WYZDMBZYVBCPEV-UHFFFAOYSA-N 431.514 2.366 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2nnnc2C(C)C)c(C)n1-c1ccc2c(c1)OCCO2 747032208 ZCCSLZYFYUQTTQ-UHFFFAOYSA-N 439.472 2.401 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CS[C@H]2CCS(=O)(=O)C2)cc1 747481549 OAOOSZQKODHQRZ-MOPGFXCFSA-N 426.604 2.181 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)c(=O)n(C)c1=O 748673453 JIBFRNYAEMOYLP-UHFFFAOYSA-N 434.543 2.306 10 20 IECD Cc1nnnn1/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749406221 NAOUVTGDHWSNLC-HMAPJEAMSA-N 436.491 2.396 10 20 IECD COc1cc(OC)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 755833129 SXPLHAGVKLNYRJ-UHFFFAOYSA-N 437.493 2.399 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)cc(OC)c1OC 759200888 TUQFNRRVVQVFCY-UHFFFAOYSA-N 449.529 2.470 10 20 IECD COc1cc(N2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc(OC)c1OC 759886988 RYZFESRWCQQNQA-ZDUSSCGKSA-N 448.545 2.022 10 20 IECD CCN1CCN(C(=O)Cc2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2)CC1 761656460 JAXDCQBWILPTKU-UHFFFAOYSA-N 426.517 2.169 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1 761968184 SNPUSMPUYQIUNI-LLVKDONJSA-N 448.419 2.455 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 764254635 PLKYHMWVYWAQPQ-LJQANCHMSA-N 426.469 2.254 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOCC(F)(F)C(F)F)cc2)C1 764833594 DWKVWSCCPVHKPG-CQSZACIVSA-N 434.434 2.105 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 766151481 MCEPAEWABGVWHQ-UHFFFAOYSA-N 449.529 2.269 10 20 IECD CCOC1CC(O)(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 770236031 KTOYBCXPVIYDPA-UHFFFAOYSA-N 431.455 2.271 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccnn3Cc3ccccn3)cc2)C1 772430857 GYZIKRYJYPZBMM-SFHVURJKSA-N 433.516 2.350 10 20 IECD O=C(NCCCn1ccc2ccccc21)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 775064273 PIEQBUBYOJXZSQ-UHFFFAOYSA-N 438.503 2.440 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)CCc3ccco3)CC2)cc(OC)c1OC 775225171 ORMGMOCJBIFROS-MRXNPFEDSA-N 445.516 2.092 10 20 IECD CC[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)ccc1O 775523640 LDFVWWAFQQMOBG-DOTOQJQBSA-N 426.355 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CC[C@@H]3CCCCN3C)CC2)cc1 778287690 CNIGKYRYSXFIDC-SGWGQVFISA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3C(=O)OC(C)(C)C)CC2)cc1 778311078 VKJABIVYPBOTMH-ZCPJJFRWSA-N 443.544 2.233 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(C)c1F 782910808 OKDGHQRNHGPOBC-UHFFFAOYSA-N 432.451 2.013 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)cc2)CC1 786119687 CKOFKUUXAXMNPY-UHFFFAOYSA-N 438.531 2.112 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(CN2CCCC2=O)cc1 787424797 IRAZSGGSWWQHJE-UHFFFAOYSA-N 432.571 2.180 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788931608 IFPGCTPZNHYOHX-UHFFFAOYSA-N 440.519 2.400 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789815897 BIPPXZUAHHSJKQ-ZHALLVOQSA-N 434.556 2.046 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1 790409709 VFLSVSUQDGQILF-UHFFFAOYSA-N 426.516 2.376 10 20 IECD COc1ccc(N2CCC(NC(=O)Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 793346716 JYVYYFYNUZBEJJ-UHFFFAOYSA-N 431.558 2.273 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1 803130657 AFACYJOEUGPGIE-LJQANCHMSA-N 438.572 2.214 10 20 IECD CC[C@H]1Oc2cc([C@@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc2NC1=O 803662801 HKEWMNMJQKFETC-BFUOFWGJSA-N 442.491 2.495 10 20 IECD CCc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805010216 XPINAXLNUSOEGA-KRWDZBQOSA-N 441.551 2.419 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](Cn3cccn3)c3ccccc3)CC2)cc1 806163940 LCPAGXOULPPUNO-QHCPKHFHSA-N 447.539 2.488 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C12CCCC2 807199894 RAJYXFLWTXXZBI-NHCUHLMSSA-N 429.561 2.336 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)Oc3ccccc3F)CC2)cc1 807636111 XKUHXZCNJDPYPB-KRWDZBQOSA-N 429.492 2.457 10 20 IECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768927 BWNZMLKHOKGULA-BXWFABGCSA-N 439.503 2.383 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 808613522 PEJDVPJIZVDFAD-GOSISDBHSA-N 432.883 2.083 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O 808616846 UDXXBZJPAIAEAY-OAQYLSRUSA-N 437.540 2.481 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](NCc2ccccc2)C(F)(F)F)c1 816752394 BFFVKNSPTBFSRL-MRXNPFEDSA-N 431.436 2.214 10 20 IECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)cc2)cc1 912979699 MLUAMSINRFONKK-UHFFFAOYSA-N 448.526 2.034 10 20 IECD CN(CC(=O)NCc1ccco1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 916150813 QWEZXKSZQNLGPL-UHFFFAOYSA-N 431.448 2.242 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-c4cnco4)c3)cc2)C1 919663233 ZOICNRHZQIVGRY-GOSISDBHSA-N 447.495 2.298 10 20 IECD COc1ccc(CN2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 919811126 JPNRYPTVVGLYFM-UHFFFAOYSA-N 433.530 2.120 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(S(=O)(=O)C(F)F)cc1 919840687 JNOSPAUGVFDVMB-UHFFFAOYSA-N 444.481 2.170 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 920927602 ZGBMMPHSCZBVBD-CQSZACIVSA-N 428.464 2.437 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)N(C)Cc1ccc(N(C)C)cc1 921200875 ZQQBRLPFSMSZOX-UHFFFAOYSA-N 447.557 2.054 10 20 IECD Cc1cc(C(=O)CN2CCC(OCC(N)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 1319326671 KOMJZBOFAQWCSX-UHFFFAOYSA-N 427.501 2.014 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(C)(C)CN3CCCC3)CC2)cc1 1321050419 URZMJPTYDBYTFV-ZHACJKMWSA-N 428.577 2.138 10 20 IECD COC(=O)CN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)CC(C)C 1322834657 IPZIUGFRALAFNY-UHFFFAOYSA-N 435.546 2.055 10 20 IECD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c(Cl)c1 1785034166 VWXWQANCPUEUSD-NRFANRHFSA-N 431.876 2.212 10 20 IECD Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1794765061 SOKRVZKWPJKWKP-YVWYUNDQSA-N 443.500 2.209 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CCSCC1 1814235508 NWEGFFVKFVZMHV-JXFKEZNVSA-N 442.541 2.351 10 20 IECD O=C(C[C@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815602628 JVHYFZYBOUDDTD-GDBMZVCRSA-N 429.477 2.481 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1cc(O)nc(O)c1 1817844006 MUYHPFSPDIQAEJ-HNNXBMFYSA-N 426.408 2.370 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)[nH]n1 1823496136 FGQIJPNVZKVLRQ-GUTXKFCHSA-N 447.586 2.308 10 20 IECD Cc1cc(CCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)ccn1 1843440826 CWUJALBISANQEQ-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COC(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1843496906 RHKDAKMEBWDTGD-UHFFFAOYSA-N 445.859 2.064 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 438811152 LPERDIMFVILQAV-LJAQVGFWSA-N 427.507 2.217 10 20 IECD Cc1cc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726976863 SHHRVZWNBHOZFL-UHFFFAOYSA-N 428.963 2.362 10 20 IECD O=C(CN1CCO[C@@H](c2ccccc2F)C1)NCc1ccc(N2CCOCC2)c(F)c1 727434746 JNLDXIRKGHFIRE-JOCHJYFZSA-N 431.483 2.491 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc1F 731408218 FZNLSEYEMMTYFG-UHFFFAOYSA-N 439.484 2.469 10 20 IECD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 743715774 AOLQBGMFKNNIQK-HSZRJFAPSA-N 425.460 2.494 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(C)nn3C3CCOCC3)CC2)cc1 746372294 NGFXSQQTACHBFW-UHFFFAOYSA-N 441.532 2.229 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCC(C(=O)N(C)C(C)C)CC3)CC2)cc1F 753857110 KJIKRPYXYWJWOW-UHFFFAOYSA-N 434.556 2.062 10 20 IECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccc(OC)c(OC)c4)C3=O)CC2)cc1F 753977629 HBLXBVRBDWPIOH-SFHVURJKSA-N 443.475 2.306 10 20 IECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 755190895 CYGDJRPETMESRI-UHFFFAOYSA-N 448.527 2.399 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(C(=O)NC4CC4)c3)CC2)cc1 758225813 VPBTTYQMSQCGLL-NRFANRHFSA-N 425.529 2.149 10 20 IECD CCN1CCN(c2ccc(NC(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)cc2)CC1 759589391 RYSTVUNCNVUISE-ONNFQVAWSA-N 425.485 2.435 10 20 IECD CNS(=O)(=O)c1ccc([C@@H](C)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 761148492 CQQHPWNRSFKQGA-GFCCVEGCSA-N 437.905 2.479 10 20 IECD O=C(CS(=O)(=O)c1cccc(Br)c1)OCC(=O)c1ccc(O)c(O)c1 782933444 XEQABGPLZXTDQO-UHFFFAOYSA-N 429.244 2.060 10 20 IECD COC[C@@H](C)n1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 784768513 YWJZJOQVFCUQQR-PBHICJAKSA-N 449.939 2.169 10 20 IECD Cc1cccc([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 793734695 VTRJIRFSLWBXTJ-WIYYLYMNSA-N 436.556 2.233 10 20 IECD COc1cc2c(cc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)OCC(=O)N2 797447996 JMTRSTYRJDTZMX-HNNXBMFYSA-N 448.497 2.102 10 20 IECD C[C@@H]1CN(CCOC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCO1 800217110 KZRPOJMWSDXYPR-CYBMUJFWSA-N 426.516 2.132 10 20 IECD CC(C)(C)OC(=O)N1CCn2c(nnc2C2CCN(C(=O)c3cccc(O)c3O)CC2)C1 802399356 BEYNCUFTJWYKEE-UHFFFAOYSA-N 443.504 2.460 10 20 IECD CC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCCO1 803450666 NUOLXWQUYUQRQL-ROUUACIJSA-N 425.476 2.447 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(Oc4ncccc4F)CC3)ccc21 803688436 ZHNXGAOZNSTKOP-UHFFFAOYSA-N 426.492 2.289 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3CCCN(CC(C)C)C3)CC2)cc1 804318701 RETDZSLJEKHPGL-LJQANCHMSA-N 430.593 2.264 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@@H](C)N1CCOCC1 804771788 NZLICGAXOZYQFB-RBUKOAKNSA-N 442.560 2.100 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC34CCOCC4)cc2F)CC1 805007212 HNVSLDLNLVWIRU-OAQYLSRUSA-N 446.567 2.049 10 20 IECD CCO[C@H]1COCC[C@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 807121342 CNKODNAJZVQDMI-RTWAWAEBSA-N 429.517 2.185 10 20 IECD O=C(NCCC1CCN(CC(F)(F)F)CC1)C(=O)NCc1ccc(N2CC=CC2)cc1 807292408 QAOSQLFPIBRZTK-UHFFFAOYSA-N 438.494 2.460 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(N(C)C)cc1 807677009 KKJDTJXRWQYRCK-MRXNPFEDSA-N 425.489 2.187 10 20 IECD CCN(CCCN(C)C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768076 BEYTXFVJEDHUJL-MRXNPFEDSA-N 426.508 2.173 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 810167420 JAILGRCOXCKNSD-CALCHBBNSA-N 449.548 2.342 10 20 IECD CCOC(=O)Nc1scnc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 813420313 KWKUSNNWBUELOE-CQSZACIVSA-N 431.518 2.343 10 20 IECD C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 916197098 NOUBNTVXQVVCDI-MRXNPFEDSA-N 432.546 2.073 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1 916502204 FOEYIAJRHLOMQA-LJQANCHMSA-N 430.936 2.476 10 20 IECD CC(=O)N[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 917954753 UGYXFUSOHHWKBG-XCLFUZPHSA-N 436.464 2.493 10 20 IECD O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 918215203 XFCAVCRSXRBYOP-UHFFFAOYSA-N 435.521 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3Cc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1116502722 AQKBUNOJERTUOS-CMDGGOBGSA-N 436.468 2.351 10 20 IECD Cn1ncc2cc(S(=O)(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cnc21 1320446894 PQZVXLMCQKSXQV-MRXNPFEDSA-N 435.937 2.270 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)CCNC(=O)OCc3ccccc3)CC2)cc1 1339723021 PDUNBKOECWBVGV-UHFFFAOYSA-N 447.557 2.464 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)F)C1=NN(c2ccccc2)C(=O)C1 1793946738 LHWMPMPZOKUTGL-UBSAEIQESA-N 440.397 2.318 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1 1804008848 ZXICSFGYEBYQAG-ABAIWWIYSA-N 442.369 2.108 10 20 IECD O=C(c1ccn2nccc2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547455 XZRDKBSBGMMNOV-UHFFFAOYSA-N 435.484 2.299 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ncccc1F 1811120820 CRYPHZJMYCHMLI-XOBRGWDASA-N 437.431 2.055 10 20 IECD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cnn1C 1826104377 AOZOWIZCSHSEHR-GOSISDBHSA-N 427.505 2.082 10 20 IECD CC(C)(C)n1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cn1 1843441266 JSBZHDGDCRKNBY-UHFFFAOYSA-N 448.527 2.248 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2CCc3nc[nH]c3C2)C1 1846551673 OJOAMXIYFWISIM-GFCCVEGCSA-N 430.892 2.096 10 20 IECD COc1cccc(CNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c1O 729569069 ILUFQWSJQMXYRB-UHFFFAOYSA-N 448.545 2.049 10 20 IECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733311257 QOSXANHFKDMNCS-ZIAGYGMSSA-N 428.510 2.154 10 20 IECD CS(=O)(=O)NCc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 735576369 GGIDONVPWGQEQV-UHFFFAOYSA-N 436.509 2.033 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(C4CC4)nc3)cc2F)C[C@@H](C)O1 737108445 WMGIGKVNCIWSGW-ZIAGYGMSSA-N 427.480 2.362 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1F 737139717 QGDHTRYHRHOOMM-UHFFFAOYSA-N 429.448 2.298 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 740919139 COEABHOXNKZGIL-UHFFFAOYSA-N 444.532 2.418 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)ccc2OC)cc1 747609253 PWXLLOATXLJEON-UHFFFAOYSA-N 442.515 2.434 10 20 IECD COC(=O)[C@@H](C)c1c(C)nn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 747727757 PMUQOXHRUXQUMN-AWEZNQCLSA-N 432.496 2.069 10 20 IECD COc1ccccc1NC(=O)CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 749849891 UCPWELSAHVCDID-UHFFFAOYSA-N 425.533 2.227 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H](C)N1CCOCC1 751060640 IEJTZNJSMJIGFM-KBPBESRZSA-N 439.559 2.094 10 20 IECD O=C(NCCOC[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067853 BZTWKNFETIBBCJ-ZDUSSCGKSA-N 426.516 2.037 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccc(CN4CCOCC4)cc3)CC2)cc1F 753858553 WACDDRKIDJSJOS-UHFFFAOYSA-N 442.535 2.427 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccc(F)c4)nn3)cc2)C1 759157643 OZKJAFQJYHQMDZ-SFHVURJKSA-N 436.491 2.097 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 760559153 BNHAWUZMTZIXOS-UHFFFAOYSA-N 438.571 2.436 10 20 IECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1cccc(Br)c1O 765736483 MHWNBBHHSWRPIU-UHFFFAOYSA-N 446.305 2.162 10 20 IECD CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)o1 768054689 YKPGVWGTIZFTNL-UHFFFAOYSA-N 434.500 2.440 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCCC34CCN(C)CC4)CC2)cc1 768919849 HGBBBOCGHMVETK-UHFFFAOYSA-N 429.609 2.477 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772375165 QEXIMOCGMLZOCT-GOSISDBHSA-N 435.540 2.190 10 20 IECD O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 774064190 CBYGNVVWYOTWJD-SFHVURJKSA-N 439.443 2.401 10 20 IECD O=C(Nc1cccc2c1OCO2)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768536 ZJXUQFYKWLXBSV-OAHLLOKOSA-N 431.876 2.494 10 20 IECD Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785297647 QTKZKUIZVDNTPW-CQSZACIVSA-N 426.448 2.476 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccnc(N2CCCC2)c1)c1ccc(N2CCOCC2)cc1 786507927 YFGIHLGQCKCEKA-SFHVURJKSA-N 437.544 2.012 10 20 IECD O=C(NCCN1CCc2ccccc2C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787622102 JTOZMRWZIBKZCX-QFIPXVFZSA-N 437.540 2.074 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2ccccc2)CCOCC1 788309625 FKCHVTRIDVRJET-UHFFFAOYSA-N 437.540 2.004 10 20 IECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788324047 QSSDGUHJENVCPE-NRFANRHFSA-N 436.556 2.233 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)cc2F)C[C@@H](C)O1 789824280 HQTAYXTXOXUUBL-IXDOHACOSA-N 443.519 2.425 10 20 IECD CN(C[C@H]1CCCOC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451711 UCDUXXMOJOVOGI-OAHLLOKOSA-N 425.476 2.258 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1)C1CCCCC1 803677951 VSCWUWCHVKRVNW-OAQYLSRUSA-N 445.560 2.110 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 803928793 QOYFJKOAXQJMAF-UHFFFAOYSA-N 440.427 2.446 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc4c(c3)OCO4)CC2)cc1 804316720 IUCQHNLHQPZYPS-UHFFFAOYSA-N 425.485 2.168 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F 806568998 GZZMRGIYEOREOA-INIZCTEOSA-N 438.516 2.495 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(N(C)C)cc1 807674779 QVRKPVWXMRIXJW-GHTZIAJQSA-N 436.556 2.280 10 20 IECD CNC(=O)NC(=O)[C@H](C)OC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 913362278 VLNMPUYVCVBFOC-JMZICWNOSA-N 441.556 2.117 10 20 IECD O=C(CSc1nnnn1Cc1cccs1)NCc1ccc(N2CCOCC2)c(F)c1 917204235 PPXQYMVYFMPOQI-UHFFFAOYSA-N 448.549 2.167 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1C 917758024 GKQJWHHXOPQCIT-UHFFFAOYSA-N 440.547 2.122 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(CCNS(C)(=O)=O)s3)CC2)cc1 917822264 KPDAYVSVQJLZGI-UHFFFAOYSA-N 437.587 2.201 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1Cl 918294051 CEBJXZMBNZXHCW-HNNXBMFYSA-N 431.876 2.291 10 20 IECD Cc1ccc([C@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2)N2CCOCC2)o1 919790059 FFECRBZAXZNDHI-NRFANRHFSA-N 428.533 2.297 10 20 IECD C[C@@H](NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(N2CCOCC2)cc1 920866232 ZNYVNDYMZIPLNM-CQSZACIVSA-N 448.497 2.032 10 20 IECD COc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc(OC)c1OC 920925254 IPNABXYISQRTDW-HNNXBMFYSA-N 443.500 2.365 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@](O)(c1ccc(C)o1)C(F)(F)F 1321367158 SGZZJFMUCQSZPF-DJJJIMSYSA-N 445.390 2.430 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)N(C)OC)c3)CC2)cc1 1324620669 LVLUEEOMXYXHBA-UHFFFAOYSA-N 433.530 2.230 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cccs1)C2)c1cc(O)nc(O)c1 1777848912 FRMOPDKTPGYQRF-VGOFRKELSA-N 445.541 2.315 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1 1784075675 QTNNZZVJEBNDDC-VQTKTOELSA-N 433.263 2.119 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccccn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994120 RODSMMVMHJZTAG-HXOBKFHXSA-N 447.495 2.235 10 20 IECD CNCCCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811804208 SEKDBGJLVLLYSI-FOIQADDNSA-N 446.935 2.465 10 20 IECD CC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821973298 KSKHTAMNBUSRFN-BONVTDFDSA-N 449.895 2.305 10 20 IECD COC1(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CCC1 1823071159 IMAZUGPUWNAQGA-OAHLLOKOSA-N 429.477 2.481 10 20 IECD COCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708459 AADYISSQSYBKHL-JTQLQIEISA-N 425.894 2.470 10 20 IECD Cn1cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1825763547 LTRGSKQGVASRQD-MRXNPFEDSA-N 448.614 2.119 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cocn1)CC2 1828199464 UGXPNDCHVQJVFV-SZHMKSFOSA-N 442.453 2.187 10 20 IECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)ccc1F 1843441415 UIGHIWLYGWMNIU-UHFFFAOYSA-N 435.459 2.139 10 20 IECD C[C@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccc(O)cc1 1843442738 ZQVFBZCXWHRQEL-KRWDZBQOSA-N 446.507 2.492 10 20 IECD COc1ccccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442750 YBENXOZMLBELBN-UHFFFAOYSA-N 432.480 2.305 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C 541063349 IVOJTQUGZQUGGW-UHFFFAOYSA-N 447.561 2.500 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3Cl)cc2)CC1 728058659 CNJMKEYOOJYJAN-UHFFFAOYSA-N 428.963 2.194 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)cc1 732666767 CJXFLETZTYUPLM-QFIPXVFZSA-N 430.980 2.373 10 20 IECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1 752151943 POEQRVNNASDNEF-IBGZPJMESA-N 442.472 2.307 10 20 IECD COc1cc(N2CCN(Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc(OC)c1OC 759878764 MUFDUOHSWBPWSD-UHFFFAOYSA-N 449.573 2.285 10 20 IECD COC(=O)c1cc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1C 759988013 XPQUYRYMLWOEIZ-UHFFFAOYSA-N 432.477 2.192 10 20 IECD COc1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCC(O)CC4)c(F)c3)C2=O)cc1O 761100898 QSXMUXULYPPNQL-HXUWFJFHSA-N 429.448 2.294 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2cccc(Br)c2O)s1 765754857 XJSANBUXDKRLRX-UHFFFAOYSA-N 433.349 2.238 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(N2CCOC2=O)cc1 765904818 XKJXKWSLUHTPAV-UHFFFAOYSA-N 434.246 2.366 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4cc(C)ccc4n3C)CC2)cc1 769640497 GLIVUCRVBCEUBN-KHPPLWFESA-N 447.539 2.412 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C[C@H](O)COc3ccccc3)C(C)C)CC2)cc1 770044702 SBBURCBNUBAEBZ-QFIPXVFZSA-N 441.572 2.494 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H](NC(N)=O)c1cccs1 777828134 IKGFNYILSHTLEV-CYBMUJFWSA-N 425.894 2.408 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 778376414 PEHGWFQCAODQTF-SSSWZJSRSA-N 445.560 2.383 10 20 IECD CCN(C[C@H]1COc2ccccc2O1)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 779219532 LYUODGLCOSWZLQ-GMAHTHKFSA-N 441.572 2.340 10 20 IECD CN(C)CCN1CCC(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 787140568 SSSWKQAAFLOSMF-UHFFFAOYSA-N 443.636 2.214 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCN(c2ccccc2)CC1 788010518 MFNMNAKPTWPGAC-NRFANRHFSA-N 447.583 2.006 10 20 IECD Cc1nc2c(s1)[C@@H](N(C)C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788333949 TWRXKCMRDQOCGV-IBGZPJMESA-N 428.558 2.440 10 20 IECD O=C(NCCCc1cccc(F)c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789835958 RNUHCYKQLPDSNF-UHFFFAOYSA-N 431.483 2.291 10 20 IECD COc1ccc(COCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789855841 YCIHJTHVDLCMIU-UHFFFAOYSA-N 443.569 2.198 10 20 IECD COCCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856638 XADRQUCYOUBFKA-UHFFFAOYSA-N 443.569 2.198 10 20 IECD CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789948552 CJFYTAIVIRITNW-HNNXBMFYSA-N 443.466 2.232 10 20 IECD CCc1nn(C)c(CC)c1CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 790220940 YSIWUIIHCYRYRL-UHFFFAOYSA-N 427.593 2.425 10 20 IECD COc1ccc(CNC(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c(O)c1 794369492 GMJXAWLOFLMLII-KRWDZBQOSA-N 433.486 2.477 10 20 IECD COc1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c(O)c1 795358337 YLBSIGLMPRASLC-UHFFFAOYSA-N 425.406 2.173 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1 799180635 CRFCUJDAMSSEOW-LBTNJELSSA-N 433.464 2.219 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(c3ncccn3)CC2)cc1)C1CCCCC1 803676847 SJQZOLKHAXWXDB-UHFFFAOYSA-N 436.560 2.211 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)CC2)cc1 806333029 DAVYYRHTAVQDTM-IRLDBZIGSA-N 429.609 2.476 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O 808616845 UDXXBZJPAIAEAY-NRFANRHFSA-N 437.540 2.481 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](c2nc(O)n[nH]2)C1 808777919 ZXFXKIPJZPQKOX-ZIAGYGMSSA-N 445.479 2.492 10 20 IECD CON(C)C(=O)C1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 813042808 UNMIGBDDOHFMJI-HZPDHXFCSA-N 436.528 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](CSC)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 872160725 IYXFVMINQFNNAT-ZCNNSNEGSA-N 445.585 2.251 10 20 IECD Cc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787295183 SQYPDIOTBCZVBK-IHPCNDPISA-N 439.512 2.027 10 20 IECD N[C@@H](Cc1cccnc1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788607422 NFDLFLQHVXOKPD-IBGZPJMESA-N 447.495 2.206 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H](O)c1ccccc1 1796931748 HGNNKBMUCBGLIR-USKVXJDGSA-N 446.507 2.151 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)ccn1)c1cc(O)nc(O)c1 1798878885 HJPUGKSLRCQQQH-BTTYYORXSA-N 436.390 2.472 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1 1814166650 RVYFWEOHGZGWOZ-NPTQTRLDSA-N 441.459 2.276 10 20 IECD CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1816712789 VNVQGIHKSPARBW-GFCCVEGCSA-N 442.501 2.014 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 1841330560 KBVHZJHIQHABTR-UHFFFAOYSA-N 446.847 2.114 10 20 IECD Cc1ncc(Br)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249158 DBYTTZWLQKBJEY-UHFFFAOYSA-N 447.289 2.090 10 20 IECD COc1ccc(N2CCCN(C(=O)C3CCN(c4ccc5nncn5n4)CC3)CC2)cc1 108427972 XVXBUFXRRIJJEB-UHFFFAOYSA-N 435.532 2.088 10 20 IECD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1 110676615 XHNLBQXWFIVLRP-JOCHJYFZSA-N 436.512 2.337 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 731283609 DJIRWSHSTYXZKS-UHFFFAOYSA-N 436.490 2.201 10 20 IECD COc1cc(CNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1OC 741735053 GJFFCFBAIDUESB-UHFFFAOYSA-N 443.544 2.297 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3c(F)cc(F)cc3F)cc2)C1 743895271 KOFFNPTXNLGILK-CYBMUJFWSA-N 434.418 2.061 10 20 IECD C[C@@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2N1C 750068054 BMNYAOAWFLEAIG-CQSZACIVSA-N 426.492 2.494 10 20 IECD CC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)=NN1c1ccccc1 750866888 ISSKBTCQGVHRFX-AUSIDOKSSA-N 447.539 2.228 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCC(C(=O)NCCC(C)C)CC3)CC2)cc1F 753858508 UWTFJMPTXFVHJB-UHFFFAOYSA-N 448.583 2.357 10 20 IECD CN1CCN(CC2(C)CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)CC1 758398174 RVIQBQQXQSHDOI-UHFFFAOYSA-N 429.609 2.082 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759300675 MKQDSEOWKRJOLT-UHFFFAOYSA-N 447.536 2.049 10 20 IECD Cn1cc(-n2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc2=O)cn1 760917151 ARGZKXLUTUGQLH-SFHVURJKSA-N 441.919 2.324 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 765102054 YZKFEKFDSWPBRB-RYUDHWBXSA-N 443.522 2.161 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(NS(C)(=O)=O)cc1 765980040 XMZDTFPJTCPVLX-MRXNPFEDSA-N 437.587 2.144 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]4[C@H](CCCN4C)C3)CC2)cc1 766845887 MHPVKAYGMSAVCP-OFNKIYASSA-N 429.609 2.333 10 20 IECD NS(=O)(=O)c1sc(Cl)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774012654 FQUBSCOYEWKUFP-UHFFFAOYSA-N 447.941 2.079 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(OC(F)F)cn3)cc2)C1 774764443 UZNTXJMYYKCMDX-OAHLLOKOSA-N 433.459 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(C[S@](C)=O)c3)CC2)cc1 778284775 XFFTYGPNXACHHP-GGNXQEJZSA-N 441.553 2.417 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@H](C)O1 787197040 JCEVNLWTKVIEIU-OALUTQOASA-N 449.555 2.004 10 20 IECD Cc1ccn(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)n1 792954934 BRIWNGOAMNTBTQ-UHFFFAOYSA-N 437.475 2.411 10 20 IECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC12CCC2 793723468 XAJFFPPCQCCHDO-MJGOQNOKSA-N 426.561 2.043 10 20 IECD CN(C)S(=O)(=O)C[C@@H](NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(F)(F)F 796458331 LLQFYXAIGYDWMX-MRXNPFEDSA-N 438.472 2.497 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC 796674119 HKJWDTRJHZOJQT-KRWDZBQOSA-N 442.468 2.334 10 20 IECD CCC[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803449006 LDDHDQMHRQEWCB-SFHVURJKSA-N 425.476 2.401 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1F 803664920 SXCYFNLMUHRRAT-KRWDZBQOSA-N 432.883 2.083 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CCCC2)CC1 803686955 KKFFRRYXHBAPDR-UHFFFAOYSA-N 442.604 2.225 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(C(C)(C)O)cc3)CC2)cc1 804318374 JAVFHHKBDIWXRK-UHFFFAOYSA-N 425.529 2.324 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@@]4(CCO[C@H]4C)C3)cc2)CC1 805026022 ZCPHZHMKFNRFPU-JXQFQVJHSA-N 429.561 2.334 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC[C@H]1C 807771061 RGIFDVHWOWEWFB-IIDMSEBBSA-N 425.476 2.256 10 20 IECD CCOC(=O)Nc1scnc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 808699403 FVTUUCRFGJCXKT-UHFFFAOYSA-N 448.501 2.226 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)OC(C)(C)C)CC2)c1 813198192 FPAMVYKTTMRIRU-UHFFFAOYSA-N 433.549 2.480 10 20 IECD CN(CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)CC(=O)N[C@H]1CCS(=O)(=O)C1 917107148 WAVQORAVXQZXKP-IBGZPJMESA-N 443.529 2.276 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC 917759134 IBIFLWUAQZYUTK-UHFFFAOYSA-N 429.476 2.474 10 20 IECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319949614 ACIAMEJMPPKNIZ-IFMALSPDSA-N 445.627 2.390 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)CN(C4CCCC4)C3=O)cc2F)C[C@H](C)O1 1333638697 IPVCOFBTIYZLIC-HOTGVXAUSA-N 446.523 2.262 10 20 IECD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)c(=O)[nH]c1C 1787042744 WMCPAHXCIVYGDF-UHFFFAOYSA-N 449.467 2.254 10 20 IECD CC(C)(C)NCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313787 GBKHXSDBGIJIMV-UHFFFAOYSA-N 448.614 2.369 10 20 IECD CC(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1793056093 DTDGUGNLJCNNMI-UDKICSLYSA-N 439.512 2.136 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)Cl)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997894 GNZHWQDZHNKOIZ-NHYWBVRUSA-N 426.807 2.039 10 20 IECD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844069 ONMAUTNIYNNXBE-CJNGLKHVSA-N 439.476 2.055 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832308228 JDXDJVRRBJIIMH-HNAYVOBHSA-N 441.532 2.492 10 20 IECD CCn1cc([C@H]2CS(=O)(=O)CCN2C(=O)NCc2c(C)c3ccccc3n2C)cn1 472221280 HHJIDEGIBSXFGF-HXUWFJFHSA-N 429.546 2.384 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnc2nc(O)nc(O)c2c1 726567831 UCMUEMOOZZZVOW-UHFFFAOYSA-N 431.399 2.436 10 20 IECD Cc1noc(C)c1S(=O)(=O)Nc1nc(-c2ccc(S(=O)(=O)N(C)C)cc2)cs1 727248070 BQBAOMGJVQVOBL-UHFFFAOYSA-N 442.544 2.466 10 20 IECD O=C(Nc1c(-c2ccccn2)nc2ccccn12)C1CCN(c2ccc3nnnn3n2)CC1 751306337 TXFBUAAEECXINA-UHFFFAOYSA-N 440.471 2.084 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)C2 752302925 VDWVSYPLWOOLKN-HNNXBMFYSA-N 431.492 2.391 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)NC[C@@H]3COc4ccccc4O3)CC2)cc1F 753860578 ITTGNRBJSKUWOW-FUHWJXTLSA-N 429.492 2.301 10 20 IECD COc1cc(N2CCN(C(=O)c3ccnc(N4CCCCC4)n3)CC2)cc(OC)c1OC 759220955 LGMSRRDJKZAOOW-UHFFFAOYSA-N 441.532 2.455 10 20 IECD COc1cc2c(cc1NC(=O)C(=O)NCc1cccc(Br)c1O)NC(=O)CC2 765903869 ONVOAJQJVXQICF-UHFFFAOYSA-N 448.273 2.303 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)CN3CCCCCC3)cc2F)C[C@@H](C)O1 768516466 CYIHHAOKNYGLIG-HDICACEKSA-N 449.571 2.430 10 20 IECD C[C@@H](NC(=O)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1)c1ccc(N(C)C)cc1 773614445 AGBVTDCZXPFWQG-MRXNPFEDSA-N 440.573 2.410 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCC3)cc2F)C[C@H](C)O1 774865354 KNEOADPOZWPSGR-IRXDYDNUSA-N 434.556 2.046 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 776823605 ROAONFBFJNYLHI-OALUTQOASA-N 432.565 2.190 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1F 780407762 PBXVOPQQPBIATG-UHFFFAOYSA-N 449.504 2.472 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781456565 FMMCNKWBNIGWGM-INIZCTEOSA-N 425.485 2.434 10 20 IECD O=C(CN1CCOC[C@@H]1[C@H]1CCCC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 784356959 WRFWARXOVKBZOW-TZIWHRDSSA-N 432.476 2.471 10 20 IECD CC[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(=O)OC 785400401 YUJVWIAAVITZRY-MRXNPFEDSA-N 438.414 2.210 10 20 IECD C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439426 OZMRIQBQWRVTOY-QAPCUYQASA-N 448.564 2.246 10 20 IECD COc1cc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc(OC)c1OC 785487793 XNZAYGHFAOXTKI-UHFFFAOYSA-N 427.501 2.027 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 789823089 YUFGSIGRODMLOO-GGUMNFRJSA-N 447.551 2.475 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1F 798169897 OYJDUSBKRNXCSE-UHFFFAOYSA-N 438.481 2.175 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3nc(O)c4ccccc4n3)CC2)cc1 804318020 WEKZFNXJYTVYDN-UHFFFAOYSA-N 449.511 2.088 10 20 IECD COCc1ccccc1CS(=O)(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 804941019 LRBPFXPMWMTKEA-UHFFFAOYSA-N 447.601 2.473 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cccc(C)c4C3)cc2F)CC1 805008428 KGGFOUYPVYLJFA-UHFFFAOYSA-N 438.547 2.477 10 20 IECD COc1ccc(CN2CC[C@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)c(OC)c1 809726358 NMRWCKZSZNETNV-INIZCTEOSA-N 431.445 2.217 10 20 IECD COc1c([N+](=O)[O-])cc(N2C[C@H](C)S(=O)(=O)[C@@H](C)C2)c([N+](=O)[O-])c1Br 811865548 FPNDVAINJJVRTB-YUMQZZPRSA-N 438.256 2.286 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cnn(C)c3I)CC2)cc1 815073807 YCPQHLFOTXNNJC-UHFFFAOYSA-N 440.285 2.386 10 20 IECD CCN1C[C@H](C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914912241 VDRCMASIYFPGLY-UONOGXRCSA-N 434.448 2.201 10 20 IECD COC(=O)CNC(=O)c1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 915336115 ZEVVONCQUDMICZ-UHFFFAOYSA-N 440.500 2.090 10 20 IECD CN(Cc1ccccc1O)C(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 916649902 WOTKTIVKUZGPHG-GOSISDBHSA-N 433.530 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)Nc3ccccc3SC)nc12 917018858 BFFFCMWXDXZFTD-UHFFFAOYSA-N 429.502 2.404 10 20 IECD CC(C)N(CC(=O)N1CCN(CC(=O)NC(C)(C)C)CC1)Cc1ccc(N(C)C)cc1 917075021 OTYCYYCCYHUJDN-UHFFFAOYSA-N 431.625 2.022 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCOC)cc2)cc1OC 917757951 CQUQKFLJBKPIOS-UHFFFAOYSA-N 428.532 2.447 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-n2nnnc2SC)c1 918306979 JRMMUXNAPBNYSU-UHFFFAOYSA-N 439.545 2.437 10 20 IECD COc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1NC(C)=O 920924793 FVFFSCBSWYGPOQ-HNNXBMFYSA-N 440.500 2.306 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2)c1ccc(N2CCOCC2)cc1 920925061 HBVXJGGEYCWKAG-AWEZNQCLSA-N 440.525 2.383 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3n[nH]cc3I)CC2)cc1 1320324566 WGRPYXHQHXEEDW-UHFFFAOYSA-N 426.258 2.375 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccnc(F)c1 1784736371 IVWCATXEGIPJAP-JDFRZJQESA-N 449.866 2.192 10 20 IECD O=C(Nc1cccnc1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426971 KJTJAXMPPXAYDX-UHFFFAOYSA-N 447.451 2.274 10 20 IECD C[C@@](O)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)C(F)(F)F 1800712125 BBHSMURHSGCDHZ-WMEBDMIVSA-N 436.814 2.316 10 20 IECD COc1nccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715879 UZWJPRNAQZIGAZ-CLLJXQQHSA-N 432.864 2.115 10 20 IECD Cc1cccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720475 UOFZMXPUTWRCGA-LBPRGKRZSA-N 425.470 2.192 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3cncc23)[nH]n1)c1cc(O)nc(O)c1 1817846284 OWIGTUCPIAZMAB-INIZCTEOSA-N 447.455 2.483 10 20 IECD CO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822456939 ITTYDJVALVSWJX-PSZCTONISA-N 430.461 2.267 10 20 IECD CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827426400 SNZYUTWWFVMGLC-SFHVURJKSA-N 427.505 2.325 10 20 IECD O=C(Cn1ccnn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830737735 UKXYJUIOIYESQB-KRWDZBQOSA-N 447.923 2.276 10 20 IECD C[C@@H](Oc1ccccc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442620 WMJDKTXSENKVCG-GOSISDBHSA-N 446.507 2.450 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(CN3C[C@H](C)O[C@H](C)C3)CC2)n(C)c2ccccc12 572435694 YNWALYBLHFXHRS-HDICACEKSA-N 440.588 2.451 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 726704672 XHNWADSYTHOKPM-UHFFFAOYSA-N 438.575 2.133 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc(CS(C)(=O)=O)cc2)cc1 734807370 MQFHFQPOURFCKH-UHFFFAOYSA-N 448.570 2.343 10 20 IECD COc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(F)c1 740609409 JSKGFWMPAYHFEH-UHFFFAOYSA-N 425.457 2.476 10 20 IECD CS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 742799721 MYWFCVMNTCIZED-OAHLLOKOSA-N 431.505 2.045 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 746493592 ZRTNHPSHHJSYMH-UHFFFAOYSA-N 444.557 2.375 10 20 IECD NC(=O)NC1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 748552152 NOZLYSDAHKFGIP-SDNWHVSQSA-N 438.600 2.389 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 751238011 VQQQQVNUHJOFPH-UHFFFAOYSA-N 436.505 2.300 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1(CO)CCOCC1 760935523 BRBAWLZDHYXFNO-KAMYIIQDSA-N 426.585 2.387 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1 764631153 WZZQSVKDTOBCPG-UHFFFAOYSA-N 438.576 2.410 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCSC[C@H]3c3nccs3)CC2)cc1 770710907 NLKPJHRZNQJJND-ICSRJNTNSA-N 434.631 2.425 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@](C)(O)c3cc(C)oc3C)CC2)cc1 778296890 DSCGBWOCFQUBAX-DHSLYTQISA-N 441.528 2.134 10 20 IECD COC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)O1 784071505 QFKXTBHJBJXZRQ-YOEHRIQHSA-N 431.455 2.487 10 20 IECD COc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 784765906 CNCQQGHQVHERIZ-MRXNPFEDSA-N 432.908 2.477 10 20 IECD C[C@H]1CN(c2ccccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 785294868 OVRQRUFIXJXPLK-OAGGEKHMSA-N 427.501 2.397 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C12CCCC2 789842132 AADJKXNUUPIDJI-NHCUHLMSSA-N 447.551 2.257 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1 793733232 LUPMABRNJKCTTN-VQIMIIECSA-N 440.519 2.064 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)Nc1ccc(OC)c(S(=O)(=O)N(C)C)c1 796327537 SZTJTWJGQYCPMS-UHFFFAOYSA-N 433.530 2.345 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(O)c1 797390744 PNDLJTKKGVWLFM-UHFFFAOYSA-N 426.517 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3c(F)cncc3F)CC2)cc1 804824297 LNLTWNHLPFKRKM-ZPIQOJFGSA-N 430.455 2.451 10 20 IECD C[C@@H](NC(=O)NC[C@H](N1CCOCC1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 804988522 CRGBDQDZVZGNIT-QAPCUYQASA-N 430.471 2.147 10 20 IECD O=C(CN1CCC[C@H](c2nc(O)n[nH]2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808777514 PFZVLPDLKDSUER-ZDUSSCGKSA-N 431.452 2.104 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ncn(C(C)(C)C)n3)cc2F)C[C@@H](C)O1 812694129 SBZXIMKFXXWRSV-GASCZTMLSA-N 447.511 2.259 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(C(=O)c4ccccc4)CC3)cc2)C1 918118149 WXHVINSKOOZBLS-NRFANRHFSA-N 449.555 2.056 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 1323860067 PODYGNKYJWHHPB-BZSNNMDCSA-N 432.517 2.117 10 20 IECD C[C@H]1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1788241848 DXEOJCNPLFETLX-JGDLYVIOSA-N 444.528 2.233 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccn(C(F)F)n2)[nH]n1)c1cc(O)nc(O)c1 1817845817 ABIZABODIMHXOY-ZDUSSCGKSA-N 447.402 2.427 10 20 IECD C[C@H](NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O)c1ccc(N2CCOCC2)cc1 60106139 HYUIIBNYGABRNE-INIZCTEOSA-N 429.542 2.336 10 20 IECD Cc1nn(C)c2ncc(S(=O)(=O)Nc3ccnn3Cc3ccc(N(C)C)cc3)cc12 727358516 FAXCSAJALFKLCB-UHFFFAOYSA-N 425.518 2.388 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 734490524 JEOBNVQXTIMZNQ-UHFFFAOYSA-N 448.545 2.402 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739768366 QNVMYFFZCGAOEL-UHFFFAOYSA-N 448.520 2.078 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O 741096772 GJDGBCDKGLRBMA-UHFFFAOYSA-N 444.491 2.324 10 20 IECD COc1cc(C(=O)NCCCSc2nccs2)cc(NS(C)(=O)=O)c1OC 742669332 IJBLELVNNKXDSF-UHFFFAOYSA-N 431.561 2.444 10 20 IECD CC(C)CCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746364109 NUADRUCYSDNKOZ-UHFFFAOYSA-N 431.512 2.284 10 20 IECD O=C(CCN1CCN(c2ccccn2)CC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407096 SIZRQSKXVDEXNG-UHFFFAOYSA-N 441.551 2.010 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3nnc(C(C)(C)C)s3)CC2)cc1 758720705 WGKZQEFHPYWMTE-UHFFFAOYSA-N 432.594 2.466 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1nc(O)c2sccc2n1 767954575 GXGFUMJFTNXARF-UHFFFAOYSA-N 445.520 2.121 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 773741801 YMRHUTXUJGZERS-DOOKAGJSSA-N 439.512 2.059 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(N4CCCC4)nc3)CC2)cc1 778233574 HBOKALNAIRTJET-ZHACJKMWSA-N 449.555 2.212 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3cnn(-c4ccccc4)c3)CC2)cc1 779218596 MYBXWTXXTYREKA-XMMPIXPASA-N 435.572 2.496 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 779475830 LUUUVEBRUBAVME-GORDUTHDSA-N 428.919 2.359 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(F)c(NS(C)(=O)=O)c3)c2)CC1 781045687 NZBNCUFYRJCCNB-UHFFFAOYSA-N 434.493 2.118 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781458459 RLLBKXIXBXSSTG-HNNXBMFYSA-N 441.484 2.134 10 20 IECD Cc1csc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 788601386 JEKKVHZQIKQLQK-UHFFFAOYSA-N 438.500 2.497 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 788932440 NPYVREXHNSWPJL-UXHICEINSA-N 426.561 2.200 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccnn1CC(F)F 789905181 JLGDEYVNNSRFIW-UHFFFAOYSA-N 445.449 2.334 10 20 IECD CCN(C[C@H]1CCOC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789954760 LOIZRTGWWRVUKF-OAHLLOKOSA-N 443.466 2.043 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1 797431401 NVBNXDGNEKHYGI-UHFFFAOYSA-N 434.883 2.234 10 20 IECD COc1ccccc1CCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297467 WVXHKISKMZJKRS-SFHVURJKSA-N 425.529 2.410 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCS(=O)(=O)c1ccccc1 803366161 NSPIVLKMOVTXTQ-UHFFFAOYSA-N 445.585 2.470 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)cc1F 803661317 WUXJDBCMYPFTSC-UHFFFAOYSA-N 444.482 2.022 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685903 ONYRMNSLGHAZBP-INIZCTEOSA-N 430.549 2.153 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@@H](C)c3cccc(C)c3)CC2)cc1 803749576 PWJZUUSLTXQPQC-HXUWFJFHSA-N 438.572 2.162 10 20 IECD COC(=O)N1CCC([C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 807828716 BYNMYSRKHKUQQB-KRWDZBQOSA-N 432.565 2.473 10 20 IECD CN1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@H]1c1ccccc1 808057319 VYQWRVZLMSMGLI-FUPPJEDESA-N 437.540 2.461 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2ccnn2)cc1 809613254 PLYJTRXJRITCSX-LAUBAEHRSA-N 449.511 2.358 10 20 IECD C[C@@H](c1ccccc1)[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(N)=O 813590570 NYJZHBZRRDXWIH-BTYIYWSLSA-N 428.508 2.244 10 20 IECD O=C(Nc1cn(Cc2ccccc2)nn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 815360996 FGGDQUYUMUWTPY-LJQANCHMSA-N 435.484 2.178 10 20 IECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1O 915834849 SBBHBJOFKDZGRW-UHFFFAOYSA-N 434.543 2.220 10 20 IECD CCCNC(=O)C1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 916197132 UUNMJQKGCZXCIP-UHFFFAOYSA-N 445.608 2.155 10 20 IECD CN(CCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CC(F)(F)F 918117004 FCEAAVFKPNZPLD-INIZCTEOSA-N 429.487 2.072 10 20 IECD CN1CCN(Cc2ccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2)CC1 919754338 PSDNVSNNZAIVSI-HSZRJFAPSA-N 449.599 2.066 10 20 IECD COc1ccc(-c2noc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)c(OC)c1 920637001 ULCYURIUTQCCKP-UHFFFAOYSA-N 449.441 2.188 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920865845 OUPKEFZJODLROW-CQSZACIVSA-N 442.534 2.105 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(N)=O)nc2)NC(=O)OC(C)(C)C)cc1 1330013065 OYXYRUBZKQMJLJ-GOSISDBHSA-N 427.505 2.242 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)nc1 1792416728 IDZQOCROFKQKOH-BPQKRJORSA-N 444.875 2.212 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(F)nc1 1810692066 BOAXKRLMPROLMU-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1 1814166652 RVYFWEOHGZGWOZ-XKUHRKSTSA-N 441.459 2.276 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[nH]n1)c1cc(O)nc(O)c1 1817847197 NZXKTNYLXWMNJS-VDERGJSUSA-N 427.461 2.089 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1 1822680215 VOYMFYNCGVLHIU-YCNNUGCDSA-N 433.461 2.243 10 20 IECD CC/C=C(\C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1827458754 HZZULAORZNLRRW-INJWIWPUSA-N 438.600 2.272 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 1845473537 CFHLRMFFQFJLJY-UHFFFAOYSA-N 447.831 2.496 10 20 IECD O=C(c1ccc(Cl)cc1F)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847051784 ZKEVKXJGKGFBSC-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1 727946567 JVFKHVNCBXIKMV-UHFFFAOYSA-N 425.468 2.163 10 20 IECD O=C(COc1nc(Cc2ccc(F)cc2)no1)NCc1ccc(N2CCOCC2)c(F)c1 732927496 OVMUZJUGMWDFHP-UHFFFAOYSA-N 444.438 2.470 10 20 IECD CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 746989142 DXKLKGQGOIUHOK-GOSISDBHSA-N 446.525 2.083 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C)CS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 747080056 LVTKCZIHCKJKGW-ZDUSSCGKSA-N 435.498 2.272 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 750549704 CHZSKAKZMGIFOQ-BZUAXINKSA-N 432.496 2.136 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc(C(=O)OC)c(C)o3)cc2F)CC1 751122372 SVRFWCAMGIYMRG-UHFFFAOYSA-N 439.509 2.134 10 20 IECD C[C@H](CO[C@@H]1CCOC1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 754045114 HYBQDUOFHKWWNH-TZMCWYRMSA-N 426.516 2.178 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC)c(OC)c3OC)CC2)cc1F 754215961 RAYFHCAXOFTUON-UHFFFAOYSA-N 447.463 2.147 10 20 IECD COc1ccc(C)cc1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759411186 COOKXBOMMJAERA-UHFFFAOYSA-N 443.500 2.317 10 20 IECD C[C@@H](CC(=O)N1CCOc2cc(N(C)C)ccc21)NS(=O)(=O)c1cccnc1Cl 760678861 NHIWYLWOFHIQBM-ZDUSSCGKSA-N 438.937 2.284 10 20 IECD CNC(=O)[C@H]1CCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 765659596 NLSGTHCWRWKRKQ-DOTOQJQBSA-N 428.455 2.256 10 20 IECD CC(C)[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCCS1(=O)=O 768127267 WREDRBRIRXXZKO-IBGZPJMESA-N 426.494 2.461 10 20 IECD Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 768443985 KKVDHRXVBFZYDY-KKSFZXQISA-N 432.542 2.317 10 20 IECD C[C@@]1(CCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCC(=O)N1 769088859 VHTSKFKOHHAVNG-DEOSSOPVSA-N 434.448 2.393 10 20 IECD C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770065801 GXBKZBVRVZIDNN-OLZOCXBDSA-N 427.523 2.282 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1nnnn1CC1CC1 770080290 KMDIIJGOYJDBDQ-NTEUORMPSA-N 448.599 2.442 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)o1 771058612 NQTIXBORVIWSRX-OAHLLOKOSA-N 441.937 2.250 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(-n5ccnn5)cc4)n3)CC2)cc1 771069567 WWZRFIUBIPQZKE-UHFFFAOYSA-N 445.483 2.217 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@]1(CCO)CCOC1 773057246 COKKLYGBTGTIAH-BJRSVTDJSA-N 426.585 2.387 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCOC[C@H]3c3noc(-c4cnn(C)c4)n3)ccc21 780826258 DIMHTZHXOBKIRF-IBGZPJMESA-N 437.504 2.136 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(OC)c1OC 786255560 NJWBWNXRHQNHTQ-UHFFFAOYSA-N 427.501 2.311 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848079 YPNAJIQVNKESNX-STZCLMFTSA-N 437.631 2.052 10 20 IECD Cc1ccn(C[C@](C)(O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(=O)c1 790896377 FXHLCELLOLOBAK-GCJKJVERSA-N 433.936 2.048 10 20 IECD COc1ccc(CNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)c(O)c1 795358697 SJJDBORISLJPDC-UHFFFAOYSA-N 428.532 2.176 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(N)=O)n3)cc2Cl)C1 800636030 DMTKEWYZQNFOJA-CYBMUJFWSA-N 429.908 2.325 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])c(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 804613236 DOQZBMQDSMBSOC-UHFFFAOYSA-N 432.433 2.129 10 20 IECD CS[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807759824 MJCGOUGZHXSMQH-FPOVZHCZSA-N 430.618 2.235 10 20 IECD CCN(CCOCCO)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807953575 VDCZRFXUFNRUIS-MRXNPFEDSA-N 425.957 2.050 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1 808346999 XDEYTFNYFFLZBQ-DHIUTWEWSA-N 444.620 2.375 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 808623075 XUHKHRIUMWXNSU-SFHVURJKSA-N 432.883 2.083 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@@](CO)(Cc4ccc(F)cc4)C3)CC2)cc1 808795772 YBDJTHPTIGXQFG-RUZDIDTESA-N 441.547 2.410 10 20 IECD COC(=O)c1cn(-c2cccc(NC(=O)N3CCN(c4ccc(OC)cc4)CC3)c2)nn1 812977727 PCNORTQMFNIXJZ-UHFFFAOYSA-N 436.472 2.417 10 20 IECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2ccc(S(=O)(=O)NC)cc2)cc1 906489137 NMKCPZGHZFYJBB-UHFFFAOYSA-N 425.576 2.262 10 20 IECD NC(=O)COc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 913009633 PPYSXVQDVFVDEI-UHFFFAOYSA-N 445.387 2.487 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C(=O)OC)Oc3ccccc32)cc1 918428975 GFXSKIAYJOPHFZ-HXUWFJFHSA-N 425.485 2.116 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc([N+](=O)[O-])o3)cc2F)C[C@@H](C)O1 918848239 CGBWEKIHIBOFES-BETUJISGSA-N 435.408 2.414 10 20 IECD Cc1cc(C)n(CC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 919022713 INGWKAQGXOMFTI-IAGOWNOFSA-N 432.496 2.112 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3nc4ccccc4s3)CC2)c1 919806144 NDYATWJYTJXCLU-UHFFFAOYSA-N 446.554 2.331 10 20 IECD CC(C)=CCCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509827 GOWUIVQZTDLGDW-WCYCAPIHSA-N 430.501 2.393 10 20 IECD C[C@@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CC=CCC1 1802082540 QZLFPOXGRXZLNG-ABHLLMGQSA-N 442.512 2.153 10 20 IECD Cc1nc(N)sc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817392374 WUZBTRSNIUDWHG-GFCCVEGCSA-N 443.489 2.183 10 20 IECD CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294782 QSHWOASVQKQFSZ-BMIGLBTASA-N 449.895 2.305 10 20 IECD O=C(c1cc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876503 HRISNGFQEALCDL-FZMUQLTDSA-N 440.500 2.473 10 20 IECD O=C(c1cc[nH]n1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876509 HRISNGFQEALCDL-SUQGKYDKSA-N 440.500 2.473 10 20 IECD Cc1cccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1Cl 1846810766 FFDWRUAQHHZGRB-UHFFFAOYSA-N 437.974 2.326 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)nc12 726187541 ZWEQELOQGNVENO-OAHLLOKOSA-N 442.451 2.147 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2cccc(Br)c2O)c1 730017980 VYGSTQGQRGBULU-NSHDSACASA-N 442.335 2.180 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732451545 VVMYQYDBHXKHLF-WMZOPIPTSA-N 447.580 2.443 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 739067291 APYUKBWGCVNNTK-UHFFFAOYSA-N 439.512 2.226 10 20 IECD CCN(CC)c1ccc(CNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)cc1F 753904656 FJQSALQTFFJHAP-UHFFFAOYSA-N 426.558 2.428 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 754050700 QRXMENCNWVDNDI-SFTDATJTSA-N 448.608 2.119 10 20 IECD COc1cc(N2CCN(CC(=O)N3CCc4ccccc4C3)CC2)cc(OC)c1OC 759876911 CYBGHKGYMCPDOS-UHFFFAOYSA-N 425.529 2.419 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 764251419 XXMQBJVRCAOBEV-INIZCTEOSA-N 425.485 2.055 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 772109159 XGPQNBQQBQRYLC-UHFFFAOYSA-N 444.580 2.011 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3ccco3)N3CCCC3)CC2)cc1 774865066 GJQKEJKQOICVOT-NRFANRHFSA-N 440.544 2.327 10 20 IECD CS(=O)(=O)CCCCCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 776414327 GFTQDZCWTCVYOS-UHFFFAOYSA-N 444.465 2.315 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)c3ccc(-n4cncn4)cc3)CC2)cc1 785394852 DQRKNAGJFGAGHY-QGZVFWFLSA-N 448.527 2.238 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC3CCC4(CC3)CC4)CC2)cc1 785528541 PVBAEPWYKGLSTA-UHFFFAOYSA-N 428.577 2.163 10 20 IECD O=C(NCc1ccc(N2CCCC2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787183039 VFHIFKPDJZTRKC-HXUWFJFHSA-N 438.528 2.211 10 20 IECD CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788909699 GXJBHSGWCXEKJW-LJQANCHMSA-N 430.549 2.371 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 788930424 AKTMOWOHALVUCB-UHFFFAOYSA-N 439.516 2.406 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)cc2F)C[C@@H](C)O1 789824278 HQTAYXTXOXUUBL-BRWVUGGUSA-N 443.519 2.425 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856463 VCUAHYRVZXVNJZ-UHFFFAOYSA-N 429.590 2.031 10 20 IECD COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3ccc(N4CCOCC4)cc3)C2)c1 792080956 GYQHNAFAZVACQF-JOCHJYFZSA-N 425.485 2.350 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)cc1C 799122014 XRXIGXRCVYNXGK-UHFFFAOYSA-N 442.515 2.353 10 20 IECD COCc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 803300185 QPBWVFBPYNTCFP-MRXNPFEDSA-N 429.492 2.302 10 20 IECD CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 806879010 RBCYJZBVZFWHFL-UHFFFAOYSA-N 436.509 2.444 10 20 IECD CC(C)NC(=O)OC1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 807805237 NNJWAKAUARYVSQ-UHFFFAOYSA-N 439.515 2.214 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC1CCN(c2cccs2)CC1 808769311 WCTOOBILNIMATB-UHFFFAOYSA-N 442.585 2.328 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3COC4=O)cc2F)C[C@H](C)O1 808919125 NHAPYILKSBXBHG-KBPBESRZSA-N 441.459 2.365 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccc4c(c3)OCO4)CC2)cc1 915933929 RUKFNWTXOPBIGK-UHFFFAOYSA-N 440.544 2.478 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(CC(F)(F)F)CC3)cc2F)C[C@@H](C)O1 916974678 IPSREJQHWQJCBY-HZPDHXFCSA-N 446.489 2.235 10 20 IECD CN1CCN(c2ccc(CN(CC(F)F)C3CCN(S(C)(=O)=O)CC3)cc2F)CC1 1116945456 SBBDHRDOFMJCLL-UHFFFAOYSA-N 448.555 2.069 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(=O)n(C)c4ccccc34)CC2)cc1 1248675021 LLFDMIPGAVNRDW-UHFFFAOYSA-N 434.540 2.489 10 20 IECD Cc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cs1 1805962344 XLEANOMHSXGUHA-KUHUBIRLSA-N 439.497 2.286 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465166 RAQKHBKXNJLOGK-GZHDQSLTSA-N 449.486 2.238 10 20 IECD CC[C@H](NC)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811804243 SXVMCYLEQNZZNX-UCLAIMLFSA-N 446.935 2.464 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806021 HAZULPNLNMMHBQ-RGPZOAQRSA-N 445.903 2.237 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823479293 FWKJVOSYXZGGLB-VJFPMYOSSA-N 430.461 2.267 10 20 IECD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1cccn1 1827429150 QETNKBKCDLGRGT-CRAIPNDOSA-N 427.505 2.184 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@@H](CN3CCOCC3)c3ccccc3)CC2)cc1 302757174 MOOZFZJKYNXGAE-DEOSSOPVSA-N 438.572 2.007 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cccc(CN3CCN(C)CC3)c2)n(C)c2ccccc12 472788036 LAUQPONAMRFEOL-UHFFFAOYSA-N 433.556 2.489 10 20 IECD O=C1C[C@H](N(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C2CC2)C(=O)N1 726942368 DYPLKSBMGHADQE-FYQHACEVSA-N 449.579 2.136 10 20 IECD COC(=O)Nc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 727613419 XXTQATXKXTZSHN-UHFFFAOYSA-N 444.463 2.438 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741099520 CHXQRLUPOUWOGG-UHFFFAOYSA-N 433.917 2.375 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1 744380778 GQFHUTTVRYFNSR-UHFFFAOYSA-N 426.336 2.110 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 751385277 JMAMBLRSENMXQP-ZRCGQRJVSA-N 432.609 2.067 10 20 IECD CN(C)C[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 752484677 WJWSPAQCLCRYLK-PMXLPMHFSA-N 427.617 2.158 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753883856 GPARUZSPZSMEDD-UHFFFAOYSA-N 436.509 2.405 10 20 IECD CC(=O)N1CC[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 755295195 XSKLFAFQWTYDAU-AWEZNQCLSA-N 437.543 2.195 10 20 IECD CNC(=O)c1ccc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c([N+](=O)[O-])c1 758937350 XPFAYESASUPRKD-UHFFFAOYSA-N 430.461 2.307 10 20 IECD CC(=O)Nc1nnc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 759507063 YFFPTTCJSAWLIB-UHFFFAOYSA-N 437.478 2.162 10 20 IECD C[C@H](NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 764363781 QLLSEKFCPGVOIC-JTAQYXEDSA-N 429.609 2.252 10 20 IECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1 765283191 RRZUJCOCZWVQSU-LJQANCHMSA-N 445.585 2.395 10 20 IECD CCO[C@@H](CCN(C)C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768230304 IQBQVJBHOKFKMI-HNNXBMFYSA-N 441.575 2.341 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)c1 769539478 NCYSCTICIQEQQT-UHFFFAOYSA-N 443.319 2.344 10 20 IECD CS(=O)(=O)Nc1ccc(N2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)cc1 770394088 FBFMHLYVEPXYLN-UHFFFAOYSA-N 448.564 2.356 10 20 IECD COc1ncc(/C=C\C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 773796404 PZOKWVVMXBPXOR-XQRVVYSFSA-N 449.490 2.071 10 20 IECD C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)CC(=O)N2C 775352512 QBSLOFNAFNRDAX-INIZCTEOSA-N 440.519 2.148 10 20 IECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCN1CC(C)(C)O 782005059 WQAVZQGOCLKLDB-MRXNPFEDSA-N 435.524 2.178 10 20 IECD O=C(COC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc(O)c(O)c1 783543470 RSRITBYNRVJQGV-KRWDZBQOSA-N 433.482 2.066 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Cc2ccccc2Br)c1 785230815 AZQOFLMNKDVUDP-UHFFFAOYSA-N 442.287 2.495 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccccc1OC(F)F 786113627 VKZRZLXATRSHTG-UHFFFAOYSA-N 437.418 2.196 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 787093368 JVPABCPCBURMRJ-UHFFFAOYSA-N 438.528 2.145 10 20 IECD C[C@@H](CN1CCOCC1)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 787755917 JUWXPJSUYGNMPJ-SJORKVTESA-N 436.984 2.029 10 20 IECD C[C@@H]1CCCCN1CCCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787903475 LUYPNVXBUICGBL-HXUWFJFHSA-N 430.593 2.252 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(OC(C)C)nc3)CC2)cc1 787979334 FVTNPKUSEMVGSP-UHFFFAOYSA-N 426.517 2.279 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 788933631 RBIHFGKKPZBRJH-FQEVSTJZSA-N 440.931 2.478 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C12CCCC2 789802484 ZBQBRTUQSVUMFS-VQTJNVASSA-N 433.524 2.133 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCCO)CC3)cc2F)C[C@H](C)O1 789821494 TURYRONAOXXHKY-IRXDYDNUSA-N 435.540 2.067 10 20 IECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)o1 789854250 GEPKBVRZCLNQPC-UHFFFAOYSA-N 444.601 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc([C@H]4CCCOC4)[nH]n3)CC2)cc1 792537445 FJSNBUPYNQWBKD-IJDCCNJMSA-N 439.516 2.156 10 20 IECD COc1ccc(Cn2cc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)cc1 792974152 PNNCBSPYUALZFR-UHFFFAOYSA-N 425.464 2.400 10 20 IECD CN(Cc1ccccc1Cl)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793717077 FUOPESRKZKIFPT-SFHVURJKSA-N 442.947 2.317 10 20 IECD COc1ccc(CNC(=O)c2ccnc(C(=O)NCc3ccc(OC)cc3O)c2)c(O)c1 794378701 CBQKZPREDKFPLF-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2Cl)cc1 797431871 ZYZKWVPEXNEUHO-UHFFFAOYSA-N 434.883 2.234 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Br)c2F)cc1 799123735 GAOOQNLPYRDNPM-UHFFFAOYSA-N 438.300 2.265 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cc1 803687666 OTFKOCMASNXLKU-UHFFFAOYSA-N 448.567 2.415 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC(C)(C)N2CCC(OC)CC2)cc1 805156840 DBLAJTIIXVLRMM-UHFFFAOYSA-N 432.609 2.497 10 20 IECD O=C(Cn1cc(Cl)cn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806550635 MZPMHVXOIHSWNY-UHFFFAOYSA-N 429.887 2.109 10 20 IECD CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807195242 AJTBQOUQFZQAKL-RNJTYBCJSA-N 437.487 2.303 10 20 IECD CC(C)[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769026 QWJAIDSFFWDSRO-YJBOKZPZSA-N 425.476 2.256 10 20 IECD Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C2CC2)n1 812975404 ABRZKJDQMHJRLR-UHFFFAOYSA-N 436.560 2.084 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(OC)c1 918442241 CKIZGKQRDBSWTG-UHFFFAOYSA-N 427.501 2.167 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 918455478 CAMVUYZBWHGSQB-UHFFFAOYSA-N 425.485 2.434 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)cc2)C1 919754307 PIBMSMZFJJWTHS-DYESRHJHSA-N 438.503 2.197 10 20 IECD Cc1cc(/C=C/C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)no1 1816726788 ZSQJHWHARBUBMD-PYEVWLCESA-N 441.469 2.185 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 27578652 LDUUUTACMXKLQA-UHFFFAOYSA-N 445.541 2.107 10 20 IECD COc1ccc(N2CCN(C(=O)COc3c(OC)cccc3C(=O)N(C)C)CC2)cc1 108243003 BOELWQTYIZUNPY-UHFFFAOYSA-N 427.501 2.133 10 20 IECD Cc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1S(N)(=O)=O 730842275 FHFUIFFCXUWWIF-UHFFFAOYSA-N 428.558 2.427 10 20 IECD COc1cccc(CNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c1O 745646729 LPVUJWIAQDLOLV-SFHVURJKSA-N 443.500 2.074 10 20 IECD CNS(=O)(=O)c1csc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 748698066 IQQSFNRAMZVTRN-CHWSQXEVSA-N 441.550 2.339 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c(C(=O)OC)s1 751058113 SHEWIGWMYXLWAT-UHFFFAOYSA-N 438.527 2.182 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 751240521 OXEHRRRGNAOQCS-UHFFFAOYSA-N 435.521 2.471 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]3C)nc12 752068955 NBNNGMVYVRGDPS-KBPBESRZSA-N 433.509 2.347 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4ccsc4)CC3)CC2)cc1 753993034 CDKAAONVXOFHFR-QFIPXVFZSA-N 430.618 2.057 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1C 763693136 YVDRHGIINHVJPU-UHFFFAOYSA-N 427.530 2.272 10 20 IECD CC(=O)NC1CCC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 765929929 XGTKZQUFEMNEQI-UHFFFAOYSA-N 426.540 2.479 10 20 IECD COCCCn1c(S)nc2cc(C(=O)NCCc3ccc(O)c(O)c3)ccc2c1=O 768900947 QRDZTGADEVPVMD-UHFFFAOYSA-N 429.498 2.105 10 20 IECD CC(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 769885654 JETPAHHMGHXALT-UHFFFAOYSA-N 436.555 2.356 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@H](S(C)(=O)=O)C3)cc2F)CC1 770538798 XYZDUQISIBPSJX-SFHVURJKSA-N 440.585 2.076 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(N(C)C)cc1 773846400 LIYBOOWZUUVEIY-MRXNPFEDSA-N 437.544 2.270 10 20 IECD CCc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1C(=O)O 780408152 XYYJMUNZTUQNED-UHFFFAOYSA-N 431.514 2.417 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(OC2COC2)cc1)c1ccc(N2CCOCC2)cc1 782106003 GKTOPZXLTMAJON-MRXNPFEDSA-N 425.485 2.117 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN2CCn3c(nn(CC(=O)N(C)C)c3=O)C2)cc1 786579249 QTAAASKYDMPBHH-UHFFFAOYSA-N 448.571 2.175 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCN(C4CC4)CC3)cc2F)C[C@@H](C)O1 789818695 KCCGYPKMSUFUJS-CALCHBBNSA-N 446.567 2.046 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3C[C@@H]4CCC[C@H](C3)N4C)cc2F)C[C@H](C)O1 789823326 DEOGXNRYCMVPAJ-XBPNIJIESA-N 446.567 2.187 10 20 IECD O=C(c1c(F)ccc(O)c1O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1 790064844 FEJVPIKHWHMVOZ-UHFFFAOYSA-N 444.850 2.399 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCCC1 790191936 XXQLOHAQSXFCEI-SJORKVTESA-N 438.519 2.221 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sccc2Br)cc1 797431381 NQPUKRIGKYETFS-UHFFFAOYSA-N 426.339 2.188 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3C)cc1 797431999 HBSOSGAQIZMVKT-UHFFFAOYSA-N 446.510 2.107 10 20 IECD COC(=O)C(C)(C)C(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 803225679 QHXCNNRKZFXCFW-UHFFFAOYSA-N 439.376 2.295 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CN(C(=O)OC(C)(C)C)C1 804753690 IYEAPENZDNTBBE-UHFFFAOYSA-N 432.565 2.473 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3C[C@@H](C)O[C@H](C)C3)cc2)CC1 805023891 MVVLRKLARRZFNY-WOJBJXKFSA-N 430.593 2.155 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 807672102 WMGDYHDPWRRFIS-INIZCTEOSA-N 426.492 2.054 10 20 IECD C[C@H]1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 807972686 UCYSMIKLQXDSPN-PMACEKPBSA-N 442.604 2.156 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCN(c3ncccn3)CC1)c2[N+](=O)[O-] 821703466 PDGPHXYVAPFRBP-UHFFFAOYSA-N 443.419 2.123 10 20 IECD CCCc1nc(CS(=O)(=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 915363137 NWAWMZHKPXPWCA-UHFFFAOYSA-N 437.587 2.368 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3cccnc3)cc2F)C[C@H](C)O1 918211722 MSUHECQSINJPFU-HOTGVXAUSA-N 429.496 2.064 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4sccc4C3)cc2)C1 919784516 KDUAYLWNJYNNMN-IBGZPJMESA-N 441.601 2.307 10 20 IECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c([N+](=O)[O-])cc1OC 919878737 VZLWYHFTZYMSPT-UHFFFAOYSA-N 435.458 2.099 10 20 IECD C[C@@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1317762384 VBAKSWKXANRYSA-CYBMUJFWSA-N 436.464 2.495 10 20 IECD O=C(/C=C/c1ccco1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794143315 GHFSJKWHTGGSOU-GFYLOJAKSA-N 432.860 2.261 10 20 IECD O=C1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)C2)CN1 1804978418 TWXCZQYZEINDOH-AWEZNQCLSA-N 449.935 2.122 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c(C)n1C 1811235643 BCAKGAJFSOEGCN-VGOFRKELSA-N 449.511 2.477 10 20 IECD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846343520 LRSVQNNFEGEAKS-GJZGRUSLSA-N 448.903 2.324 10 20 IECD O=C(c1cc(C2CC2)on1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035102 SEEOPIUDTPIHNV-FNORWQNLSA-N 425.441 2.199 10 20 IECD Cc1csc(CCC(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1 1847057012 YMUJPRNJNGTDSY-UHFFFAOYSA-N 437.612 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@H](CN3CCOCC3)c3ccccc3)CC2)cc1 302757175 MOOZFZJKYNXGAE-XMMPIXPASA-N 438.572 2.007 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2nc(O)c3ccccc3n2)CC1 303745172 JRSZKJYTBFHVBU-UHFFFAOYSA-N 448.571 2.178 10 20 IECD COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2ccc(C)c(O)c2O)cc(C(=O)OC)c1 727005293 NBRDPRHLAQNZRZ-LLVKDONJSA-N 431.397 2.163 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(Br)cc2F)SC1=S 727177622 MGYXHTKJHJXNGX-WDZFZDKYSA-N 439.353 2.339 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3nc(-c4ccccc4)n[nH]3)CC2)cc1 729814308 ADWQHNIMFZZKIY-UHFFFAOYSA-N 449.559 2.492 10 20 IECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)N(C)Cc3ccccc3O)CC2)cc1 732203628 ZHOURAXPHVRHJI-GOSISDBHSA-N 431.558 2.054 10 20 IECD COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 735039753 DWGSLKZZJOMBTM-QGZVFWFLSA-N 432.542 2.258 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1F 740609444 LRAVMTYNMRKBSJ-UHFFFAOYSA-N 434.493 2.287 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3C(=O)OC)cc2F)CC1 751074889 KNOGDPSFOBQIPR-UHFFFAOYSA-N 449.548 2.374 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cnc4ccsc4c3)CC2)cc1 752251679 RVRVGZBOZUIXQN-UHFFFAOYSA-N 432.571 2.405 10 20 IECD COc1ccc(N2CCN(C(=O)c3cnn(CC(=O)NC4CCCCC4)c3)CC2)cc1F 753738452 KPQQBTVKKQQRMR-UHFFFAOYSA-N 443.523 2.442 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@H]1CCOC1 764372381 KFKVJVXJGGVXHH-OLZOCXBDSA-N 435.458 2.256 10 20 IECD C[C@@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc(N2CCOCC2)cc1 775258728 AGBAEUUYGWQKEU-OAHLLOKOSA-N 441.923 2.442 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(C(=O)C(F)(F)F)CC3)cc2)C1 776123936 OSCFMJQXXVYXOZ-INIZCTEOSA-N 440.466 2.441 10 20 IECD CN(C)C(=O)NCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 777445034 IAANOPLCBIGEMQ-ACCUITESSA-N 426.589 2.117 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 778612019 PXDHEWKQJBECAP-UHFFFAOYSA-N 426.466 2.083 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4cccc(OC)c4)CC3)CC2)cc1 779216690 RPUQJCNSKLFLDE-QHCPKHFHSA-N 440.588 2.009 10 20 IECD O=C(NCCCN1CCCCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 785518774 YEUASSBCMNOXGR-KRWDZBQOSA-N 438.519 2.365 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(CN2CCCC2)c1 787290797 METHRYAQODKULZ-UHFFFAOYSA-N 436.556 2.052 10 20 IECD Cc1cnc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C2CC2)s1 789834293 LLNFRWAHZYMOJG-IBGZPJMESA-N 446.548 2.435 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCc2ccccc2OC1 789856227 QSZIRAWQDQEJIM-IBGZPJMESA-N 425.554 2.366 10 20 IECD COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)C2)c1 791725198 SYPVIOZTKBCNIW-HSZRJFAPSA-N 436.512 2.173 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2ccc(OC)cc2O)s1 792788783 DIKUSCYLJCYUQH-UHFFFAOYSA-N 427.548 2.492 10 20 IECD COc1c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc(Cl)cc1C(N)=O 792974154 PSHWGSBUHHDRBV-UHFFFAOYSA-N 430.892 2.085 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743046 QXVKJWGHZRUIIL-XXBNENTESA-N 438.572 2.428 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803309184 QWBCOOAGABHHHX-TZIWHRDSSA-N 428.577 2.177 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3csc(N4CCCC4)n3)ccc21 803689435 RLRNMHNTACGHOO-UHFFFAOYSA-N 427.574 2.101 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@H](C)c3nccs3)cc2F)CC1 805007533 VERLODZGXOKJST-INIZCTEOSA-N 447.580 2.302 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC(OCC4CC4)CC3)cc2F)CC1 805007725 YVTTZOLVGDLATL-UHFFFAOYSA-N 446.567 2.001 10 20 IECD CCC(=O)N1CC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 807840799 KFUHANQQTZKQQY-GOSISDBHSA-N 426.517 2.002 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)C1 808037023 HYUZKLBXAZAAHV-HKUYNNGSSA-N 432.565 2.474 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4nccs4)n3)cc2F)C[C@@H](C)O1 810014861 RASZTQVJEHVUAB-OKILXGFUSA-N 430.509 2.471 10 20 IECD COCC[C@@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 813038011 MJSVIRCDWXAOSX-QGZVFWFLSA-N 431.455 2.489 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3ccnc4ccccc34)CC2)c1 816563041 IALSMUCJGWRANL-UHFFFAOYSA-N 426.498 2.274 10 20 IECD CS(=O)(=O)NC1(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCCCC1 916253735 JAPHDKGDYFNZEC-SFHVURJKSA-N 439.578 2.335 10 20 IECD O=C(Cn1cnc2ccc(Cl)cc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 917188721 YVVBVEXFHHTOKN-UHFFFAOYSA-N 430.867 2.342 10 20 IECD COC(=O)CCOc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 917863997 BVLQWOCPTWRSRN-UHFFFAOYSA-N 448.541 2.286 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc2)C1 918122900 NSRPOTKURASQQG-YLJYHZDGSA-N 426.521 2.086 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2ccccc2F)n1 918337034 BWUKZMXYYNCCMB-UHFFFAOYSA-N 428.489 2.176 10 20 IECD Cc1oc(CO)cc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918924824 BMRQSHWTAXRGGZ-KBPBESRZSA-N 434.464 2.306 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4sccc4C3)cc2)C1 919784517 KDUAYLWNJYNNMN-LJQANCHMSA-N 441.601 2.307 10 20 IECD C[C@@H](NC(=O)N1CCC(C(=O)Nc2nncs2)CC1)c1ccc(N2CCOCC2)cc1 920870918 IIEKNHOSKDUQLO-OAHLLOKOSA-N 444.561 2.496 10 20 IECD Cn1cc([C@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2)cn1 1116547957 PLZDPQVOQPZACF-XMMPIXPASA-N 437.519 2.391 10 20 IECD CCCOc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1780836797 PMSJUVGSZSFXAJ-QHCPKHFHSA-N 441.484 2.039 10 20 IECD COCC1(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)CC1 1786354230 WLLLNPXLHYAWAO-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cn1ccnc1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787495821 LXHJGUFZTPXIKS-UHFFFAOYSA-N 443.554 2.028 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(Cl)n1 1798766474 GVDBWEAPNXREMX-LJWNITHASA-N 444.875 2.212 10 20 IECD CCc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722324 XRDOTRIMEZACBJ-LBPRGKRZSA-N 439.497 2.446 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc(O)nc(O)c1 1817842765 NHMYFYXSDKBYOO-GFCCVEGCSA-N 442.388 2.337 10 20 IECD Cc1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1817889755 OYMMPPFCNVNHHX-SNVBAGLBSA-N 431.499 2.254 10 20 IECD CC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1836668856 PFEIJHYHXYFDNV-QGZVFWFLSA-N 440.924 2.134 10 20 IECD O=C(NCC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccs1 1842065134 NUCVCNSCHWJDFE-UHFFFAOYSA-N 449.916 2.060 10 20 IECD COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)s1 1848332108 AEMVOMUCTPYGRZ-IRXDYDNUSA-N 438.509 2.365 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)cc1 23815905 MEWRVJAXYKABGS-UHFFFAOYSA-N 439.516 2.074 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)n(C)c2ccccc12 573636657 QASSLQOKSABBSP-KDURUIRLSA-N 439.604 2.120 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 732953500 NRXXWFJNHNRWAA-FQEVSTJZSA-N 446.529 2.473 10 20 IECD CC(C)(C)C(=O)NC[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 732984137 WHDXHXXYVFFKCL-IBGZPJMESA-N 448.583 2.153 10 20 IECD COCC(=O)NC1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745905716 QJVDDYWBGPSJQA-INIZCTEOSA-N 440.491 2.193 10 20 IECD CS(=O)(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 751136199 FSWWSJXKPNCESK-INIZCTEOSA-N 425.528 2.166 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1F 753857754 PQODJEBZBLRISX-UHFFFAOYSA-N 426.536 2.301 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccccc3C(=O)NC3CC3)CC2)cc1F 753860550 HEHRQJVJORCIHV-UHFFFAOYSA-N 426.492 2.487 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(-c4ccccn4)n3C)CC2)cc1 758225228 XWVABQLMOBGGOM-SFHVURJKSA-N 440.573 2.161 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3O[C@H]3CCOC3)CC2)cc1F 760120055 IYGNDQBMNTXJIK-KRWDZBQOSA-N 443.475 2.289 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2sccc2Br)SC1=S 764886389 QPPXEHIDJOPVBJ-TWGQIWQCSA-N 427.392 2.261 10 20 IECD O=C(CCn1cnc2ccc(Br)cc2c1=O)NCCc1ccc(O)c(O)c1 768900702 NIGGZJAHAUFCCV-UHFFFAOYSA-N 432.274 2.319 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(S(=O)(=O)C(C)C)c3)nc12 770431981 JKMWVOBRSZBVFP-UHFFFAOYSA-N 447.469 2.151 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]1OC 776226400 FWZGACAJYXTQFD-YSVLISHTSA-N 426.516 2.177 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CCN(CCc2ccccn2)CC1 788929481 JVUQRUPSXMBQQK-UHFFFAOYSA-N 449.599 2.464 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(n4ccnc4)CC3)cc2F)C[C@@H](C)O1 789826660 PYGPWOUHIPUCAB-CALCHBBNSA-N 443.523 2.116 10 20 IECD CNC(=O)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 796588496 VOONKLJWSNAQGS-BJLQDIEVSA-N 448.583 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cn4c(n3)CCCC4)cc2F)C[C@@H](C)O1 799587463 ZEPCCQWHKYNTQO-HZPDHXFCSA-N 444.507 2.445 10 20 IECD Cc1nn(-c2ccccn2)c(C)c1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 801721772 RFRSXIASINFFLL-UHFFFAOYSA-N 425.558 2.409 10 20 IECD COCCSCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 914720774 DWRZWKULQKZODO-DHDCSXOGSA-N 440.568 2.112 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 916565426 DNNMIIMKTGUIJI-ACRUOGEOSA-N 427.545 2.435 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)NC(=O)CO4)cc2F)C[C@H](C)O1 917917795 HHILLGHNOSPISM-KBPBESRZSA-N 449.504 2.249 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(-n4cccn4)cc3)CC2)cc1 919174799 HAKGPDNDYDWPTP-UHFFFAOYSA-N 434.496 2.315 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CS(=O)(=O)C(C)C)c2C)cc1 919600690 KDTCUBDBHSIFIK-UHFFFAOYSA-N 435.498 2.430 10 20 IECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1C 1116523525 CCVOHHKMPCGZRR-GASCZTMLSA-N 432.496 2.208 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1 1322459581 RSEUVFVUKIIIOY-MAUKXSAKSA-N 434.395 2.160 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1C 1789561884 CTQPJCHXTFYYFJ-WDSOQIARSA-N 425.485 2.017 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1cc(O)nc(O)c1 1800528367 HXKLGIRTVFNHPM-CLLJXQQHSA-N 430.392 2.106 10 20 IECD CC1CCN(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)CC1 1805813446 ONFLIPCYXNRQOO-UHFFFAOYSA-N 430.549 2.070 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469891 RAQKHBKXNJLOGK-ONZODILHSA-N 449.486 2.238 10 20 IECD CCn1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)cc1C 1820770390 JMNJVRNEICVZEV-LBPRGKRZSA-N 442.501 2.014 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cncnc2)CC1 1827132078 FXEZSKBWKKICLE-LJQANCHMSA-N 439.516 2.149 10 20 IECD O=C(CCc1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424164 RLAXDGMFYNFKBY-GOSISDBHSA-N 427.505 2.082 10 20 IECD CN(C)c1cncc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1 1845500697 CTKSACIXXHPJDG-UHFFFAOYSA-N 430.892 2.343 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1Cl 726728349 RAXMNQOUUVPAJK-UHFFFAOYSA-N 444.919 2.432 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2)C1 730175714 UJCVQTYNVQOGCU-ZWKOTPCHSA-N 438.503 2.197 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)NC)c2)cc1F 731356802 TVTYTTQZJXMRJN-UHFFFAOYSA-N 429.539 2.059 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(-c4ccc(F)cc4)n3)CC2)cc1 737480997 JFLOHHJJJXVKTG-UHFFFAOYSA-N 438.507 2.357 10 20 IECD COC(=O)[C@H](O)C1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 747417582 UQSUCJJFQAEORC-MAUKXSAKSA-N 441.475 2.212 10 20 IECD C[C@@H]1CN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C[C@@H]1C 752301250 PSHJYMVMAYZWQC-MYDYOQDRSA-N 447.582 2.321 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3cccc(NC(C)=O)c3)CC2)cc1 754123736 MWXCESJRQILMKS-FDDCHVKYSA-N 426.561 2.487 10 20 IECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 765476537 WPPJKGZDLZWPDX-CQSZACIVSA-N 443.566 2.468 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccccc1CN1CCOCC1 765932172 XUCNTCYCSPTWBD-UHFFFAOYSA-N 448.317 2.242 10 20 IECD O=[N+]([O-])c1cc2c(cc1S(=O)(=O)NCc1cccc(Br)c1O)OCCO2 766201970 YFVJMHBGJCETJU-UHFFFAOYSA-N 445.247 2.313 10 20 IECD COc1nc(O)cc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 770515475 CBNZVNFXKVPCQU-NSHDSACASA-N 447.403 2.150 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(C(=O)NCCN3CCCC3)cc2)c1O 775049367 XIQMMQKGRBUMRB-UHFFFAOYSA-N 428.489 2.424 10 20 IECD C[C@@H](NCC(=O)N1CCC(C(=O)N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 775256933 AOTMXCUDUILYIJ-LJQANCHMSA-N 428.577 2.035 10 20 IECD CC(=O)Nc1ccc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 781425036 BKVVXWAEOSSUBT-UHFFFAOYSA-N 443.475 2.402 10 20 IECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786659125 IRAZQLXMXJYXMH-AVRDEDQJSA-N 443.592 2.191 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O 788908782 ALLRVEVDGZDYQN-HSZRJFAPSA-N 448.567 2.253 10 20 IECD Cn1ncc2c1CCC[C@@H]2NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789595657 LHHGEQOEFQIQEX-KSSFIOAISA-N 447.486 2.300 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 789813273 RLBTUJWLPFWHQV-SIKLNZKXSA-N 441.503 2.173 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCN(C)C)CC3)cc2F)C[C@@H](C)O1 789817211 GXKLVXRIMLPDAH-QZTJIDSGSA-N 448.583 2.246 10 20 IECD COc1ccc(CNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)c(O)c1 794381376 PMCBNJFBWUBYGM-UHFFFAOYSA-N 430.848 2.467 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H]3NC(=O)OC[C@H]3C2)c([N+](=O)[O-])c1Br 798405917 DSXQPKBATTWKFV-SFYZADRCSA-N 431.199 2.209 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccccc2F)CC1)c1ccc(N2CCOCC2)cc1 803309201 RKEADSXEXHXMLE-GOSISDBHSA-N 440.519 2.188 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N(CCO)Cc1ccccc1 803449213 RKBMMTMGHUGLGH-UHFFFAOYSA-N 447.482 2.394 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC[C@@H]2c2cnn(C)c2)cc1F 804852503 JEWFWXKRKRVVAA-LJQANCHMSA-N 433.553 2.338 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(N2CCOCC2)cc1 807386703 FQWHBBVFAUIJJY-UHFFFAOYSA-N 434.290 2.246 10 20 IECD Cc1cccc(O[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807637061 VONHNDKDZLKNDW-LJQANCHMSA-N 425.529 2.374 10 20 IECD CCC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 807840665 HRLLDWNEEQDESL-WBVHZDCISA-N 434.968 2.320 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCCC3)cc2)c1 810247945 XSXBJHDRBUOESG-UHFFFAOYSA-N 429.542 2.474 10 20 IECD CCn1cnnc1-c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918308607 NMKCEORKOUGZBV-UHFFFAOYSA-N 448.527 2.399 10 20 IECD Cc1nccn1-c1ncccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 919779238 WSPKWJWEXXTEMY-HXUWFJFHSA-N 447.543 2.277 10 20 IECD C[C@@H](NC(=O)NC[C@]1(N2CCOCC2)CCSC1)c1ccc(N2CCOCC2)cc1 920920904 QPPQMQCXLCQRBD-XMSQKQJNSA-N 434.606 2.091 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccc(N(C)C)cc2)c1 921069166 RAMOHAZLAKFRNZ-DHZHZOJOSA-N 434.514 2.435 10 20 IECD Cc1cc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)ccc2[nH]1 1782537424 VEEZYJBBWBEEIB-HSZRJFAPSA-N 436.468 2.040 10 20 IECD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)nn1C 1788427753 MSDPTEAIJWBREF-UHFFFAOYSA-N 437.456 2.296 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1804212164 DNNOQBTTWJMAKZ-IVSAIRAKSA-N 437.924 2.308 10 20 IECD Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1804659776 POZBPAWXWOUDHN-JPYJTQIMSA-N 447.495 2.154 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cccn2cn1 1818777690 MBVAAQPGGUBIKV-KRWDZBQOSA-N 447.455 2.483 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cn[nH]c2cn1 1819233554 MPDMOXLLAAJGMY-INIZCTEOSA-N 448.443 2.107 10 20 IECD CCc1[nH]nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1F 1827427047 NHTVJETUAAPYPD-INIZCTEOSA-N 445.495 2.465 10 20 IECD Cc1cc(NC(=O)COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 10922725 IONFJEYYISILOS-UHFFFAOYSA-N 435.348 2.462 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@](O)(c1nccn1C)C(F)(F)F 105570499 OZLOKUIDCMBBOQ-IBGZPJMESA-N 426.439 2.055 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc(F)c3F)CC2)cc1 725818856 CYPPVAPQBLPYLL-UHFFFAOYSA-N 425.501 2.464 10 20 IECD CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)s1 727355549 OFAHCQWEXWTAFK-UHFFFAOYSA-N 438.940 2.236 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 728980158 WUVGQYUAXOCRQN-RHSMWYFYSA-N 434.514 2.349 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)cc3F)cc2)C1 729854165 WOXOFKNRZJZKDV-CYBMUJFWSA-N 427.448 2.284 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(NC(=O)C4CC4)nc3)CC2)cc1 731407083 PWLBGBYDYZIUDB-UHFFFAOYSA-N 437.500 2.162 10 20 IECD COc1cc(OC)cc([C@@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 735759014 ONDNEFCYLXGMAZ-QFIPXVFZSA-N 447.507 2.337 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 741675242 CZKQKFMSUOLREC-QGZVFWFLSA-N 431.558 2.454 10 20 IECD COC(=O)COc1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743294771 ZCJSNARPPWFBHI-UHFFFAOYSA-N 442.516 2.191 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)CNC(=O)c2ccncc2)NC(=O)OC(C)(C)C)cc1 743725545 UTPXWGMUICQCJG-IBGZPJMESA-N 441.532 2.260 10 20 IECD O=C(NC[C@H]1CCC[C@@H](O)C1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748320965 QHOYYRYUDPNHTJ-XJKSGUPXSA-N 449.485 2.382 10 20 IECD O=C1OCCN1c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227783 KZQDRENCRJCLSS-UHFFFAOYSA-N 449.504 2.222 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc2nc[nH]c2n1 755132658 UNDDEMZYNCQBEX-UHFFFAOYSA-N 432.463 2.144 10 20 IECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 756160925 SRKMDWXFJMPQEH-UHFFFAOYSA-N 445.491 2.307 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3n[nH]c4nc5ccccc5n34)CC2)cc1 758186879 SOPJLLKSEHAYFV-QGZVFWFLSA-N 438.557 2.494 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(C)c(F)c3)CC2)cc(OC)c1OC 759410918 ZLJQDPHMFKZTTO-UHFFFAOYSA-N 431.464 2.447 10 20 IECD C[C@@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)NS(=O)(=O)c1cccnc1Cl 760474778 RUOOGQKIRMKYRA-LBPRGKRZSA-N 428.917 2.313 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCN2C(=O)OC[C@@H]2C1 764137171 XMSVNXMSXMZTPP-CJAAZZPWSA-N 437.568 2.393 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 768216190 PUUZFJZUEJQHDG-UHFFFAOYSA-N 444.897 2.455 10 20 IECD CCOC(=O)N1CC[C@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 770088426 QAKCGCCQVQKOCD-LBPRGKRZSA-N 437.408 2.331 10 20 IECD CS(=O)(=O)NCc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771060665 XRWHNCOHHYZVKQ-OAHLLOKOSA-N 441.937 2.082 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cn4cccc(C)c4n3)CC2)cc1 778261610 OQJIEGWCYMRQCF-KTKRTIGZSA-N 433.512 2.173 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](CN4CCCCC4)C3)CC2)cc1 778294582 LQYHAXITFZCLPH-GLCJEOIMSA-N 440.588 2.234 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCCC(N)=O)cc1 783317240 OVYLBTBSGZEXDH-UHFFFAOYSA-N 426.517 2.383 10 20 IECD O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)OCC(=O)c1ccc(O)c(O)c1 783559843 GTTYJYSVHOACKC-AWEZNQCLSA-N 432.816 2.382 10 20 IECD C[C@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 787948790 BDRIVEAPTNGZGL-CQSZACIVSA-N 439.434 2.499 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C2CC2)cc1 788787132 ZAEZZDSHWUBPFY-MRXNPFEDSA-N 426.483 2.244 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCN(C)C3CCCC3)cc2F)C[C@@H](C)O1 789828758 YIYOJJXMYWFXEV-IAGOWNOFSA-N 434.556 2.046 10 20 IECD CN(Cc1cscn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950390 PPADBWBMQXQEOB-UHFFFAOYSA-N 442.463 2.273 10 20 IECD COCc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 795804369 YJSRCNXWLBSSLS-SFHVURJKSA-N 447.557 2.022 10 20 IECD CCOC(=O)c1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 795805110 XCMLUIDQHFXIKV-UHFFFAOYSA-N 434.514 2.187 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NCc1ccc(N(C)C)c(F)c1 796404565 ARLLRDQQSSPTCM-UHFFFAOYSA-N 436.553 2.449 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1 797538540 LZOIWAFHGFBYBH-CQSZACIVSA-N 447.919 2.269 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)NCc3ccc(OC)cc3O)cc2)CC1 797623934 SVDOUADINOQXRH-UHFFFAOYSA-N 428.489 2.018 10 20 IECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803685760 KBSFFYXQSUPFHC-IBGZPJMESA-N 436.556 2.337 10 20 IECD CN(C)CCN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686088 VLYHZWOZNDQKRE-UHFFFAOYSA-N 426.536 2.415 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 805010422 DWXOTNYMKJCJFC-AWEZNQCLSA-N 444.966 2.403 10 20 IECD CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)C(=O)NCCCSc3nccs3)C[C@@H]2C1 806282331 UZSVDALZIJSLRN-OKILXGFUSA-N 440.591 2.067 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1 807841707 IRWYMRLLOZBRIV-FQEVSTJZSA-N 428.577 2.399 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O 808542443 KPPGEVRHIVVAAH-GOSISDBHSA-N 439.512 2.451 10 20 IECD CON(C)C(=O)C1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 813042807 UNMIGBDDOHFMJI-HOTGVXAUSA-N 436.528 2.381 10 20 IECD C[C@@]1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCS(=O)(=O)C1 914406295 YSSZDSODBGGGTF-OJNOIJSXSA-N 444.625 2.423 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cn3cc(C(N)=O)c4ccccc43)CC2)cc1 917391276 MIPQBLJQHCJCNR-UHFFFAOYSA-N 449.555 2.077 10 20 IECD O=C(Nc1ccc(N2CCOC2=O)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918296095 IFUDBLOXGZOUBI-IBGZPJMESA-N 439.468 2.495 10 20 IECD COc1ccccc1C(=O)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918703474 ZSYJNGFVWZCWBT-IYBDPMFKSA-N 429.492 2.494 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(OCCN(C)C)c1)c1ccc(N2CCOCC2)cc1 920925577 KCQGGTRDIVPPAB-GOSISDBHSA-N 440.544 2.280 10 20 IECD C/C=C(/C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1781720643 JVTVRVVJQJPDSS-FXMSQDKQSA-N 430.501 2.297 10 20 IECD Cc1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)c1 1790242165 PRMBKGPBWRIQAF-AXHNFQJDSA-N 445.903 2.362 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3O)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242253 YXMUSCZCNJPUNW-ODYMNIRHSA-N 446.887 2.364 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806359488 UHXJDZNGTKJFMY-UHFFFAOYSA-N 433.505 2.069 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C=CCN2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821293437 LOQOCWKPQKDPNE-ZFWWWQNUSA-N 431.880 2.308 10 20 IECD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1823733577 XHXMMACGCIYNJD-QAPCUYQASA-N 431.533 2.277 10 20 IECD CC(F)(F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826759498 XASBLXZLTPPIFX-CYBMUJFWSA-N 433.546 2.122 10 20 IECD COc1ccc(-c2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)n[nH]2)cc1 1843451713 DRZPJHOWWAJHEM-UHFFFAOYSA-N 449.467 2.022 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cnn(-c3ccc(Cl)cc3)c2)SC1=S 727177091 WDWWVEXLBUJYSC-ZSOIEALJSA-N 442.975 2.276 10 20 IECD CCc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n[nH]1 732836415 WSGMFUNRKBKNSB-UHFFFAOYSA-N 445.457 2.317 10 20 IECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 734074907 UNMNDNDWXHBGFC-KRWDZBQOSA-N 446.525 2.250 10 20 IECD CCC(O)(CC)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743712659 QJMQIJVLNHFHQE-UHFFFAOYSA-N 437.474 2.382 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N(CC)[C@H]1CCS(=O)(=O)C1 743870898 GKWLZYZBMVCWFD-BBRMVZONSA-N 447.395 2.401 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1C(=O)OC 743883278 IVACKLOTHJXBGC-UHFFFAOYSA-N 439.468 2.115 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/c3cc(OC)c(O)c(OC)c3)nc12 745509990 CPKKUIKYILGEPO-AATRIKPKSA-N 443.412 2.091 10 20 IECD C[C@H](CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCN(C)CC1 745799940 MXNRWRCOBMIYMP-QGZVFWFLSA-N 439.551 2.440 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 747571339 NNYLPYZCNQKWSK-IAGOWNOFSA-N 428.537 2.215 10 20 IECD COc1cc(C[C@H](CO)CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc(OC)c1 747582577 WZOWTLAIOLPJLW-FQEVSTJZSA-N 443.544 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc4c(cnn4CC(C)C)c3)nc12 748403675 JVCHXJUDTISYDH-UHFFFAOYSA-N 438.444 2.369 10 20 IECD CNS(=O)(=O)[C@@H]1CCN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)C1 749589451 IGBKBFDDUQJYPJ-MOPGFXCFSA-N 441.513 2.357 10 20 IECD CC(C)(C)N1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1=O 752816639 MLLAUYAGBFXGIP-CYBMUJFWSA-N 437.543 2.384 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@](C)(O)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756331655 YBMOZTSSBAVJJJ-NRFANRHFSA-N 434.514 2.019 10 20 IECD CCn1cc(C(=O)C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 758857270 DOSUWZNEZCJHPR-ZDUSSCGKSA-N 445.431 2.432 10 20 IECD CCn1nc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1C1CC1 759026809 KGAWCLMFVQUFIB-UHFFFAOYSA-N 425.533 2.244 10 20 IECD COC(=O)c1sc(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c(C(=O)OC)c1C 759588096 ICMZRQOUNSZWCX-FNORWQNLSA-N 449.437 2.236 10 20 IECD C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@]1=O 760661388 QZNJMUFOBCNIAT-GWQKEKGPSA-N 428.557 2.238 10 20 IECD CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 765257643 ZJVCYCNABIHSLB-VQIMIIECSA-N 430.574 2.147 10 20 IECD CCN1CCOC[C@@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 769079536 VWQBXXGMAQECJG-HXUWFJFHSA-N 428.485 2.327 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N3CCOCC3)CCCCC2)cc1F 774843085 RQFBDEGBNUHIGH-UHFFFAOYSA-N 448.583 2.439 10 20 IECD CC(C)(C)OC(=O)c1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 777875440 OLJYVFZQMNULLP-KAMYIIQDSA-N 442.584 2.392 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 778412047 WTDHHLBHFKECQT-YDZSZYSISA-N 426.521 2.019 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(C(N)=O)c(F)c1 785192051 JJTOBSLOIZWNGI-UHFFFAOYSA-N 438.253 2.380 10 20 IECD COc1cccc(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789802462 YOEZMVKNALPAIF-UHFFFAOYSA-N 443.519 2.381 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC(N2CCCCC2)CC1 789844355 FWXGSAGJZOXYRK-UHFFFAOYSA-N 430.618 2.333 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccnn1C 789859774 HQQPXGIYUXICNT-LJQANCHMSA-N 429.590 2.146 10 20 IECD CN(C)c1ccc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)c(C(F)(F)F)c1 792830760 AIHXPYOWJZWFEJ-UHFFFAOYSA-N 432.468 2.407 10 20 IECD Cc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 793717353 FTUFBJLEFJLTGL-NVXWUHKLSA-N 428.558 2.252 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCCC3=O)cc2Cl)C1 803122253 PEWVUUUEGINVHT-JKSUJKDBSA-N 434.968 2.320 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 803306469 RASQQIIDNVPWTQ-DLBZAZTESA-N 429.492 2.423 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451859 ZMCLYILIUMNJAS-UHFFFAOYSA-N 436.459 2.337 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1F 803662566 XZLNRFWBOSCFCW-UHFFFAOYSA-N 436.491 2.280 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN(C)C1CCCC1 804821376 WZGBGYQYVTXBGU-UHFFFAOYSA-N 426.355 2.494 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 806279665 VUNUWWAWACNPKH-MRXNPFEDSA-N 446.598 2.410 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCC[C@@H](C)CC3)CC2)cc(OC)c1OC 806965524 JNAPMXKKAQNDIU-SJORKVTESA-N 433.549 2.446 10 20 IECD CC(C)N1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807771635 WLTBOXXTESJYLO-KRWDZBQOSA-N 438.519 2.316 10 20 IECD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1F 810489034 GPLCZNRNABOMIG-UHFFFAOYSA-N 435.521 2.078 10 20 IECD CN(C)C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 816591132 VYODFYGJMLEFRM-AWEZNQCLSA-N 425.938 2.492 10 20 IECD CC(C)Cn1nnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917202162 AQOXNRQWQTYWRL-GASCZTMLSA-N 436.557 2.490 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917386160 QQUVEAPJLAOCFE-UHFFFAOYSA-N 433.599 2.262 10 20 IECD CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918846134 QIUIUSOBYIZGHX-UHFFFAOYSA-N 429.448 2.094 10 20 IECD O=C(NCCNC(=O)c1ccccc1F)NCc1ccc(N2CCC(O)CC2)c(F)c1 919653897 DNWNSVRJKGHFRY-UHFFFAOYSA-N 432.471 2.155 10 20 IECD C[C@H](NC(=O)c1nc2ncc(Br)cn2n1)c1ccc(N2CCOCC2)cc1 920882658 VHNYZLMTXIXNTC-LBPRGKRZSA-N 431.294 2.214 10 20 IECD C[C@H](NC(=O)CCNS(=O)(=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 920890386 ZTSNVSPVQVDCJZ-INIZCTEOSA-N 435.521 2.208 10 20 IECD CS(=O)(=O)c1nc(C(=O)NCc2ccc(N3CCSCC3)cc2)c2ccccn12 921164809 IUVUBGZGAQNVJG-UHFFFAOYSA-N 430.555 2.221 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1ccncc1F)CCO2 1782005486 JFYXUQSUOJUTGY-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cnco3)cc2)CCC1 1786527925 LHLDBPUZDKDFFR-UHFFFAOYSA-N 430.511 2.283 10 20 IECD Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1Cl 1791955475 HNCLPKCHEHUQSA-JQFCIGGWSA-N 445.903 2.362 10 20 IECD O=C(C[C@@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796930878 HKUKOHHZVCZGRN-RNQOJCNYSA-N 438.528 2.377 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nccn2c1 1797626408 UVERAOFURYVVLP-KJZRSFJVSA-N 448.479 2.416 10 20 IECD Cc1cccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720474 UOFZMXPUTWRCGA-GFCCVEGCSA-N 425.470 2.192 10 20 IECD O=C1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1830737939 ZLYADTOZIURBBH-IAGOWNOFSA-N 449.935 2.263 10 20 IECD O=C(CSc1nc(C2CC2)nc2c1c(=O)[nH]c(=O)n2C1CC1)c1ccc(O)c(O)c1 23561142 MZOQKZZNVRCEDY-UHFFFAOYSA-N 426.454 2.078 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc(NC(C)=O)cc3)CC2)cc1 728951024 UYEVDMFVAWKXKL-UHFFFAOYSA-N 439.560 2.318 10 20 IECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735520173 XJHFAUFNVDZAJT-CLOONOSVSA-N 449.507 2.293 10 20 IECD CC(=O)N1CCc2cc(S(=O)(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc21 740609890 OKHIXOXMBZMVEP-UHFFFAOYSA-N 442.541 2.098 10 20 IECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333950 AZFJDBFZPMYUTR-WMLDXEAASA-N 447.504 2.119 10 20 IECD CC(C)c1nnnn1CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747027245 RIPOKKGRZIBPJB-CYBMUJFWSA-N 447.451 2.142 10 20 IECD CN(C)C(=O)COc1ccccc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 749736108 ZBGPKYVNUQTJAJ-UHFFFAOYSA-N 427.501 2.035 10 20 IECD COC(=O)c1c(C)cccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227252 GDPWEDZSFJSQES-UHFFFAOYSA-N 436.505 2.360 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1-n1nnnc1C1CC1 754195435 ZKUZLHXFROGJFH-UHFFFAOYSA-N 449.515 2.178 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cncc(Br)c1 757905276 AFONTANWGCNKRF-UHFFFAOYSA-N 439.335 2.401 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNCC3(N4CCSCC4)CCCC3)CC2)cc1 758210314 PJDBGIITBUXCOE-QFIPXVFZSA-N 448.677 2.129 10 20 IECD Cc1ccc(N(C(=O)COC(=O)c2cccc(O)c2O)[C@@H]2C=CS(=O)(=O)C2)cc1C 758571289 CPFUNWXOOXPISD-MRXNPFEDSA-N 431.466 2.215 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)C[C@H](C)C3)cc2F)C[C@@H](C)O1 764228639 MURYEPXCKBZEBT-OAGGEKHMSA-N 427.542 2.015 10 20 IECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 769436645 DCQSLGKDRZBOML-UHFFFAOYSA-N 439.509 2.467 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3COC4(CCCC4)O3)CC2)cc1 773737869 LIGPPXDNDHVIRY-OAQYLSRUSA-N 432.565 2.192 10 20 IECD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774362662 CFPXEMNGQTZNIV-UHFFFAOYSA-N 425.485 2.376 10 20 IECD COc1ncnc(N(C)C)c1NC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 775138115 MGXCEXGWQIQMQF-UHFFFAOYSA-N 426.521 2.139 10 20 IECD CC(C)(C)C(=O)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)(C)C1 776036141 AIXKKUTWSDKNFN-UHFFFAOYSA-N 448.583 2.247 10 20 IECD COC(=O)[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 778320334 YAYCVJNEJGJEEC-WHIOSMTNSA-N 443.544 2.138 10 20 IECD O=C(NCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1 778919713 KMHCKBNXDRZOFJ-UHFFFAOYSA-N 426.441 2.093 10 20 IECD COC(=O)c1scc(C)c1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 785488131 IAURXZYODWZKMN-UHFFFAOYSA-N 428.507 2.297 10 20 IECD CC1CCN(CCCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 785519948 LFNWKSXTFIODRB-OALUTQOASA-N 448.583 2.294 10 20 IECD Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 786126052 AMVJMJRIJYDCCU-NRFANRHFSA-N 436.516 2.033 10 20 IECD O=C(NCCOCC(F)F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 788095273 JFWZYMCTGDVHIP-UHFFFAOYSA-N 438.454 2.023 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3CN3CCCC3)cc2F)C[C@@H](C)O1 789822940 BRPKFELTDGDQRJ-QWFCFKBJSA-N 446.567 2.142 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 795613932 ASXRQHVPYXYUHV-UHFFFAOYSA-N 434.474 2.106 10 20 IECD Cc1sc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)nc1-c1ccc2c(c1)CCC(=O)N2 799186583 BAIYKISLSBGNEL-UHFFFAOYSA-N 445.526 2.241 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(C2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803310056 DBNFOAICCSCXIQ-IBGZPJMESA-N 428.577 2.177 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@H](N1CCOCC1)C(F)(F)F 804969519 QUHZRLJMMKOWSG-KRWDZBQOSA-N 432.512 2.302 10 20 IECD CC(C)Nc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2O)cc1[N+](=O)[O-] 810156692 PPCWVTIUAQIFNY-UHFFFAOYSA-N 436.490 2.058 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cncn3Cc3ccccc3)CC2)cc1 811327271 PHSYIDXAYSNXQE-UHFFFAOYSA-N 448.523 2.375 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](O)c1ccc(Cl)cc1F 813416402 PMYHCLKJESVWNT-GOSISDBHSA-N 426.897 2.064 10 20 IECD COc1ccc(C(=O)NCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 920890236 QHFFNRHCWRHQJP-OAHLLOKOSA-N 442.472 2.047 10 20 IECD Cn1ccc(=O)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1790049073 KGWKWPHNOTZQKS-UHFFFAOYSA-N 434.452 2.253 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245569 OLKUMLZINWZNLY-WGGXSYPISA-N 440.949 2.240 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCCC1(F)F 1793718313 ALECXWUKGBWFJZ-CRWXNKLISA-N 445.557 2.310 10 20 IECD O=C(CNC(=O)c1ccco1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715338 LOWWVELWRKJVHS-BTTYYORXSA-N 447.875 2.026 10 20 IECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1805454707 OXGHZDPNTYKRJV-IERDGZPVSA-N 433.468 2.225 10 20 IECD CC(C)c1ccc(CC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1846102019 FRFRFMDAAWTBNH-UHFFFAOYSA-N 445.610 2.416 10 20 IECD Cn1cc(C(=O)N2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c(-c2cccnc2)n1 607915783 VMZFEDSUGRDEQY-UHFFFAOYSA-N 437.525 2.470 10 20 IECD COc1ccc(N2CCC(NC(=O)N[C@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 726701909 ASXUACFIYWGWOU-OAHLLOKOSA-N 432.546 2.372 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OCC(C)C 727178031 QULVIFHRVMODDT-MHWRWJLKSA-N 444.600 2.480 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(=O)n3ccccc3nc2n1C 728300859 ATVYDGNJYCHQTM-UHFFFAOYSA-N 431.496 2.295 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H](N2CCCCC2=O)C1 732888384 MWHLZKRBRDRYHA-GOSISDBHSA-N 432.540 2.473 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 735196366 YWZVWWQQWFMCJQ-KJEZJMDVSA-N 434.514 2.112 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1cc(F)ccc1N1CCOCC1 740909909 SRAYMLOLGWZUCU-UHFFFAOYSA-N 428.508 2.498 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800409 JSYSVLHHPITPCT-CQSZACIVSA-N 431.443 2.260 10 20 IECD CCS(=O)(=O)N(C)CCCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743552864 TXGLSPXCPJNCQV-OAHLLOKOSA-N 448.536 2.228 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCc4c[nH]nc4C3)cc2F)C[C@@H](C)O1 745621880 IMDGNOYTUQJKOY-UXLLHSPISA-N 444.507 2.127 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCCN(CC(F)(F)F)C3=O)CC2)cc1 746339811 REDVHJZRGFEPKZ-QGZVFWFLSA-N 428.455 2.470 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 749633748 QEUZVNSAFFUMSR-UHFFFAOYSA-N 449.515 2.046 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)c3nnc4ccccn34)cc2F)C[C@@H](C)O1 754583344 LCVJKEHDZAFVGC-BBWFWOEESA-N 440.523 2.449 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(C4CCOCC4)c3C)CC2)cc1 766994820 JVKSBEDGKGPHIK-UHFFFAOYSA-N 442.516 2.057 10 20 IECD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770575536 GJMJTTPZASUVKP-CJNGLKHVSA-N 433.521 2.337 10 20 IECD COC(=O)[C@@H]1CCC[C@H](c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 771059003 XCYDCPFVRCTPBK-DLBZAZTESA-N 442.516 2.416 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 773742002 OLQHTCZYZFRUKA-GDBMZVCRSA-N 435.521 2.051 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3 774357188 PQXCCEOBGBKBHO-UHFFFAOYSA-N 437.380 2.326 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H](c1ccco1)N1CCCCC1 774823328 GHNVBJPGYMDUFV-NRFANRHFSA-N 440.544 2.076 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1O 775077059 USBINYOOEKJOBE-UHFFFAOYSA-N 425.438 2.278 10 20 IECD O=C(NCc1cn2ccccc2n1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 775129082 NHMXKUKMBCHMHO-UHFFFAOYSA-N 443.454 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(N4CCCC4=O)cn3)CC2)cc1 778391482 NLPPDDBYCDIKDN-KHPPLWFESA-N 449.511 2.061 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CC3(O)CCCCCC3)CC2)cc1 779283381 JYYLAYUIBWXPNT-QXMHVHEDSA-N 429.561 2.444 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780409227 UQXNUQLUEXIWNL-UHFFFAOYSA-N 435.477 2.082 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@](OC)(C(F)(F)F)C3)CC2)cc1 781978796 SMCOXTRHRXQGKO-UYAOXDASSA-N 431.499 2.221 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1 785424890 WHKFLQIDOXPCFX-UHFFFAOYSA-N 428.920 2.007 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@@H]3c3ccccc3)CC2)cc1 785528680 QTFRWSGMNIFPIS-HSZRJFAPSA-N 436.556 2.297 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2)CC1 786657395 XGDHSBRWLIOWAF-UHFFFAOYSA-N 428.577 2.006 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCC(=O)N3Cc3ccc(C)cc3)cc2)CC1 786660093 VEUAZWYVJZJERO-DEOSSOPVSA-N 448.567 2.471 10 20 IECD Cc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789797971 FATBSWRTIBUWRF-UHFFFAOYSA-N 429.492 2.124 10 20 IECD CC(C)(C)[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789843436 LFSHMHCFJXQTLX-OXJNMPFZSA-N 435.540 2.113 10 20 IECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)[C@H]1OC 789844425 SANZEKPSWHJQIJ-IWMITWMQSA-N 449.567 2.359 10 20 IECD CC(C)(C)C(=O)NC1CCC(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1 789900397 LUNNRKCRFKQLCM-UHFFFAOYSA-N 449.617 2.259 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(-n2cccn2)c1 792335061 HXNAPNZOOXWSCB-UHFFFAOYSA-N 449.511 2.315 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1 792955641 HWWDIIMKYRTUJE-GASCZTMLSA-N 445.495 2.271 10 20 IECD C[C@@H](CN1CCCC1=O)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 803116595 HFDUDKIWRITEKX-KRWDZBQOSA-N 426.517 2.002 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(CCN(C)C)cc1)c1ccc(N2CCOCC2)cc1 803302826 UWQKLRRCLZQGBD-IBGZPJMESA-N 438.572 2.121 10 20 IECD CN(C)CCCCNS(=O)(=O)c1cccc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 803642141 FIZDAGLTENKQAG-PKNBQFBNSA-N 433.530 2.370 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCOc2cccc(C(F)(F)F)n2)cc1F 803660708 APRACXOFJXGHCC-UHFFFAOYSA-N 428.386 2.117 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@](O)(C(F)(F)F)CC3)CC2)cc1 806620484 XUZMQGAPKBJGPB-HXUWFJFHSA-N 444.498 2.306 10 20 IECD CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807289958 OEDIXFJTYOXEHD-IBGZPJMESA-N 442.560 2.442 10 20 IECD CN1CCC(n2ccc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)n2)CC1 807513926 YTJCPNLAAQJCFE-UHFFFAOYSA-N 426.304 2.417 10 20 IECD CC(C)[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769024 QWJAIDSFFWDSRO-MAUKXSAKSA-N 425.476 2.256 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F 810351385 LMJMUBDCDKRQQO-UHFFFAOYSA-N 448.470 2.483 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)cc1C 811702931 HVAUKSRCIBCTHW-UHFFFAOYSA-N 428.532 2.335 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C(N)=O)[C@@H](C)c3ccccc3)cc2F)CC1 813632485 HBHATYRAAAAZOC-JTSKRJEESA-N 441.551 2.424 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2ncccc2C(=O)N(C)C)c(C)n1-c1ccc(F)cc1 916797441 IYMILKMTYVCSPF-UHFFFAOYSA-N 444.488 2.449 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc2)C1 918122886 NSRPOTKURASQQG-FXAWDEMLSA-N 426.521 2.086 10 20 IECD COC(=O)c1cccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 919336506 CSNJOADURLTZQJ-UHFFFAOYSA-N 444.399 2.439 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3nnn(-c4ccccc4)c3C)CC2)cc1 919609139 ASMDSCZQWFALKW-UHFFFAOYSA-N 449.511 2.019 10 20 IECD COC(=O)Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920924457 BRXLGHGUUCAEIT-INIZCTEOSA-N 425.485 2.055 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1n[nH]c(C2CC2)c1Br 1321367206 VCSCKSJXFQOHRX-NSHDSACASA-N 438.278 2.365 10 20 IECD COc1ccsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777851097 PCHWWAJARLRLAC-QVKFZJNVSA-N 447.513 2.004 10 20 IECD N[C@@H](Cc1cccnc1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788428068 YCESOESANKCOJQ-IBGZPJMESA-N 447.495 2.206 10 20 IECD O=C(C[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804099519 OJKYXRCDQRYLID-SGXKBVARSA-N 440.500 2.167 10 20 IECD CC[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824086492 SIBCDYBJSYGWGX-VGSQKHLPSA-N 432.517 2.207 10 20 IECD C[C@H](CN)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826801728 FGSUJWNFRQFPGK-OUEBKFTGSA-N 431.533 2.031 10 20 IECD O=C(CN1CCC(CN2CCOCC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 727832478 DGLNGHKWTAFGEP-UHFFFAOYSA-N 447.535 2.445 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(F)(F)F)NC3=O)cc2F)CC1 730235621 IYEGEOFHFMVCKW-PBHICJAKSA-N 430.446 2.041 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(-n4ccnc4C)nc3)CC2)cc1 742940717 WORKNHZAGLFQOE-UHFFFAOYSA-N 449.559 2.206 10 20 IECD COCCOC[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751069530 OHNLPMZQFMVJPY-AWEZNQCLSA-N 440.543 2.380 10 20 IECD CN(C)CCN(Cc1ccco1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 755936050 VWNWUMBMUCGLBH-IBGZPJMESA-N 427.549 2.255 10 20 IECD CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 761386630 WGCNCKAZLIYAML-QFIPXVFZSA-N 436.556 2.096 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)COCC(=O)N[C@H](C)c2cc(OC)ccc2O)c1 761967054 FKJUQWMUKWKVTB-OKILXGFUSA-N 432.473 2.186 10 20 IECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1cccc(N2CCCC2)c1 764088349 USNCOAVJGNEVFZ-AWEZNQCLSA-N 446.529 2.121 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCOCC12CCC2 770088388 ZLCOYEAISZVSQB-UHFFFAOYSA-N 447.469 2.496 10 20 IECD C[C@H](CCN1CCN(C)CC1)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 770345645 QVLQUEFUAMIFFO-GUDVDZBRSA-N 435.588 2.265 10 20 IECD Cc1csc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 774150848 XCLSAALKYWKGNN-UHFFFAOYSA-N 442.463 2.240 10 20 IECD C[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCSCC1 774991896 NLMHBWCGTUQVLH-CQSZACIVSA-N 438.505 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@H]3C(=O)Nc4ccccc43)CC2)cc1 778222185 VNJCUQPLALRJOF-XPTLAUCJSA-N 448.523 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CCN(C)C)C(C)(C)C)CC2)cc1 778284510 NWGYOQUEVBAPAU-RJRNSMGGSA-N 430.593 2.383 10 20 IECD COCc1ccccc1S(=O)(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 778604745 CUEHXEGNDWGKQT-UHFFFAOYSA-N 433.574 2.332 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1 785297466 PIPRTDGCUJTRHU-AWEZNQCLSA-N 434.452 2.431 10 20 IECD CC[C@H](CNC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 785391849 YQAMQPQPXFNRFY-HXUWFJFHSA-N 438.572 2.243 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)nn(C(C)C)c3C)cc2)CC1 786122744 XZCHJLPDKWYFBJ-UHFFFAOYSA-N 433.578 2.228 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(N(C)C)cc1 787736518 KPEHZZBMKCJOFP-CVDCTZTESA-N 437.588 2.035 10 20 IECD CC(C)n1cc2c(n1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788312832 NAXURTOMDDRQCC-HXUWFJFHSA-N 425.533 2.111 10 20 IECD CC(C)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819069 LDPAFJJRLYUAHB-ZIFCJYIRSA-N 435.540 2.329 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1OC 797353731 PFRWINIJWPGILX-UHFFFAOYSA-N 437.246 2.205 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1 799180634 CRFCUJDAMSSEOW-IYOUNJFTSA-N 433.464 2.219 10 20 IECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 799251289 QDGHZPZSUSVXIU-UHFFFAOYSA-N 442.472 2.427 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2)cc1 802019142 ZBCRTVVQMYZNKB-ZLNRFVROSA-N 437.588 2.232 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C(=O)NC)Oc2ccccc21 802610231 WOGGWLQCTQSTGX-FQEVSTJZSA-N 425.485 2.061 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCC[C@@H](N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 803309525 ZFIIKGQMFNLLFE-SIKLNZKXSA-N 428.577 2.177 10 20 IECD COCCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688433 QIXPDZVGCXZHBE-UHFFFAOYSA-N 425.529 2.335 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N3CCc4ccccc43)CC2)cc1 803910388 AUKABWCQNRHLGF-GOSISDBHSA-N 436.556 2.348 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1F 804852119 ZUWVCCSMDHWLGZ-UHFFFAOYSA-N 430.528 2.105 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](c4ccco4)C3)cc2F)CC1 805006840 HXSFHXHNIHZUTH-GOSISDBHSA-N 428.508 2.193 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 806288723 UVKOEOOAPARDJI-FYYLOGMGSA-N 437.540 2.376 10 20 IECD Cc1nnc([C@@H](C)NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807768137 CWWDKPPWKOLUJU-YPMHNXCESA-N 439.488 2.410 10 20 IECD CN1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@H]1c1ccccc1 808057321 VYQWRVZLMSMGLI-QNWVGRARSA-N 437.540 2.461 10 20 IECD Cc1cnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 808482454 OBUYIAZITSCVGD-KRWDZBQOSA-N 441.601 2.477 10 20 IECD Cn1cc(-c2csc(NS(=O)(=O)c3ccccc3S(=O)(=O)C(F)F)n2)cn1 808537349 MHRAKQVELWCDSN-UHFFFAOYSA-N 434.471 2.341 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ncc(Cl)cc3C)CC2)cc1 812955725 ZYHHBDHVKNMPCG-UHFFFAOYSA-N 445.951 2.319 10 20 IECD CC(=O)N1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916631099 CGCQOJIQAQKYFO-UHFFFAOYSA-N 428.455 2.306 10 20 IECD COc1ccc(C(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC 917364681 MSIORJYFCXGZPF-SFHVURJKSA-N 428.485 2.347 10 20 IECD O=C(Nc1ccccc1Cn1cncn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295807 HJCHVXTVXUEKSG-LJQANCHMSA-N 435.484 2.178 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)c1nc2ncc(Br)cn2n1 919816272 WWCGXSOEOLKCCB-UHFFFAOYSA-N 433.335 2.370 10 20 IECD CCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C)c1ccc(OC)c(OC)c1 921061541 GRRXNVUWVFPRPH-AWEZNQCLSA-N 433.530 2.155 10 20 IECD CS(=O)(=O)Nc1ccccc1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1116100370 XGRDSCFNGGHTFY-UHFFFAOYSA-N 431.558 2.126 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 1333672061 HZQQPENJMVPTGY-UHFFFAOYSA-N 431.514 2.338 10 20 IECD CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1342447053 AKWQORFCNGAAMW-HOTGVXAUSA-N 449.548 2.206 10 20 IECD Cc1ccc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1 1787295195 ULCSILATWZOVCN-SNRMKQJTSA-N 425.485 2.017 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C1=COCCC1 1791327565 HFYRKTZNYCSFCE-QITLCBANSA-N 436.892 2.039 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ccccc2n1 1797347219 ZNXKYLAIVUZYJZ-FJXIAYRNSA-N 448.479 2.416 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnc(O)[nH]2)cc1 1798182019 CIOYZYUAMBBTPF-RMFSNUHRSA-N 449.511 2.040 10 20 IECD CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1841407583 LIQBJLUYMLXUSF-LJQANCHMSA-N 445.610 2.490 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCOCC3)cc2)c1 108808725 SYHITLSAEBQNSX-UHFFFAOYSA-N 431.558 2.125 10 20 IECD Cc1c(CNC(=O)N2C[C@@H](COCC(=O)N(C)C)OC(C)(C)C2)n(C)c2ccccc12 554147899 KMBPHVXEQYPDDI-KRWDZBQOSA-N 430.549 2.281 10 20 IECD O=C(NCCN1C(=O)Cc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 725874755 HTEGTNBBGARQMH-UHFFFAOYSA-N 426.492 2.175 10 20 IECD O=C(NCCCc1nnc2n1CCCCC2)NCc1ccc(N2CCOCC2)c(F)c1 727602089 YTLVYOFFMRIARX-UHFFFAOYSA-N 430.528 2.412 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@H](C(N)=O)c3ccc(Br)cc3)cc2)C1 729677000 WVXXNSVNBHTRMY-LPHOPBHVSA-N 445.361 2.467 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 738991341 OZOUMHAPKHUBJB-INIZCTEOSA-N 438.532 2.460 10 20 IECD CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)cc1)C1CCCCC1 746399388 XLKRGVWKIWBGLI-NRFANRHFSA-N 442.604 2.252 10 20 IECD CN1CCCc2cc(CNC(=O)[C@H]3CCCN3C(=O)/C=C\c3ccc(C(N)=O)cc3)ccc21 746814607 UHIMRRZGEKYTAA-GTWYHSLGSA-N 446.551 2.489 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2=O 749405141 CKFYPUGFXAMIDW-OAHLLOKOSA-N 439.487 2.396 10 20 IECD CC(=O)NCC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751063888 SIPZRIHVLLQQBE-UHFFFAOYSA-N 437.543 2.243 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)N[C@@](C)(C4CCCCC4)C3=O)CC2)cc1 758198267 NFRDZWFGFUYPLB-YKSBVNFPSA-N 444.576 2.069 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 759358099 ABOCYFBLFZHEDZ-ZIAGYGMSSA-N 446.479 2.117 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1 773750179 CXASYVSPPRRIEM-KRWDZBQOSA-N 427.501 2.099 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 773763563 RVGIFSDTHWDYBU-VQIMIIECSA-N 432.542 2.387 10 20 IECD COc1ccccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 775050870 FUHWQYBGINWZJP-IRXDYDNUSA-N 443.519 2.423 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Br)cc(C(=O)O)c1 775286428 IUXHPMBVIOHJMA-UHFFFAOYSA-N 430.232 2.440 10 20 IECD COC(=O)COc1ccc(CN(C)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 775722296 XFTMQSIWIMRXCX-UHFFFAOYSA-N 441.528 2.028 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3csc([C@@H](C)OC)n3)CC2)cc1 778314756 UTBNPOASNINUAG-ROJDOSBLSA-N 444.557 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@](C)(O)c3ccc(F)cc3)CC2)cc1 778402652 PYPGCLTZKFSBIV-IPYQYMIDSA-N 441.503 2.063 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4cc(F)ccc4F)CC3)CC2)cc1 779222898 YCZVFRCWROQOKL-NRFANRHFSA-N 446.542 2.279 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3cccnc3-n3ccnc3)cc2)CC1 787441367 IHRFFUUEFMSLDX-UHFFFAOYSA-N 432.528 2.436 10 20 IECD C[C@@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 787908053 GNYISLNYEQYNJH-GOSISDBHSA-N 448.583 2.031 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3CCN(c4ccccc4)C3)CC2)cc1 788823192 NUJZLOHHQOOXCQ-HXUWFJFHSA-N 436.556 2.377 10 20 IECD CCS(=O)(=O)c1ccc([C@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 792948916 MUYRMHRWUWPDNF-SFHVURJKSA-N 445.585 2.488 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)N(C)C)cc1 793716376 AZFKCNHWACKQDS-AUSIDOKSSA-N 438.572 2.428 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCc4sccc43)cc2)C1 793734133 QFEQFCQNGTXPEC-LPHOPBHVSA-N 440.569 2.260 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)cc2)C1 793734658 VDFZSFGOZLDJSK-UAFMIMERSA-N 426.561 2.090 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cccc1[N+](=O)[O-] 803300810 KMPQWDSSKMZGOH-MRXNPFEDSA-N 426.473 2.233 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCCc2c[nH]nc21 803448141 JCBLICOZDILTTE-KRWDZBQOSA-N 433.459 2.290 10 20 IECD CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287419 JQQQOEHVGXKGHJ-IBGZPJMESA-N 426.561 2.080 10 20 IECD C[C@H](NC(=O)C(=O)N(C)CCN1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 807672851 JMGJTIRHMWATGU-FQEVSTJZSA-N 437.588 2.210 10 20 IECD CCCc1nnc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1N 808052844 YAXFLGTWNYLBCU-KBPBESRZSA-N 436.557 2.106 10 20 IECD CCCCn1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1 809186195 HQQUJUBZFASJIE-UHFFFAOYSA-N 427.549 2.103 10 20 IECD COCCOc1ncccc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918207216 BLRHBCLQJKXFJJ-UHFFFAOYSA-N 428.533 2.315 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3n[nH]c4c3CCC4)cc2F)C[C@H](C)O1 919330524 HZEFHWDMFZBACK-KBPBESRZSA-N 430.480 2.124 10 20 IECD O=C(CC(F)(F)C(=O)O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788428007 QVDUSDQUVNEQPV-UHFFFAOYSA-N 435.383 2.351 10 20 IECD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1 1795678819 FPJKAKABNLMZTA-BJWYYQGGSA-N 431.583 2.036 10 20 IECD COc1cccc(OC)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601505 REWCMDRSBPELOU-QDMKHBRRSA-N 427.457 2.076 10 20 IECD O=C1CC(C(=O)N2CC[C@H](CNC(=O)C3(F)CC3)[C@H]2c2cccnc2)=NN1c1ccccc1 1812457381 VTLDQDUHGSHNRC-DYESRHJHSA-N 449.486 2.382 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ncc(Cl)cn1 1816278038 XJHAHZOOIZHSFJ-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnc[nH]1 1816419269 POLUSTKFBGZVFK-SFHVURJKSA-N 446.471 2.232 10 20 IECD CC[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)NC(=O)OC(C)(C)C 1843250583 NPNYZNLYSLAKEU-OAHLLOKOSA-N 448.520 2.003 10 20 IECD Cc1cccc(CCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n1 1847033842 JOXZBAGOKGOBME-JXMROGBWSA-N 437.496 2.356 10 20 IECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 726244237 BRDDMYFXPXLPLP-CMKODMSKSA-N 432.565 2.157 10 20 IECD CN(CC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1)C(=O)OC(C)(C)C 728981892 JZDXHXPDQOMWEH-UHFFFAOYSA-N 441.550 2.483 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3CN3CCCC3)CC2)cc1 729587095 OBCZVCFUMCINPF-JOCHJYFZSA-N 429.609 2.477 10 20 IECD CC(=O)[C@H]1CC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)=NN1c1ccccc1 733532627 BHMGGUXSAMTJET-JOCHJYFZSA-N 436.512 2.478 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc1C 734416231 OYWQAGGSMZDTFA-UHFFFAOYSA-N 437.543 2.466 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@H](C)O1 741099532 CUSTUZGVDJYZFU-ROUUACIJSA-N 435.528 2.326 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 757647578 SAAOSOPWPLBEMF-UHFFFAOYSA-N 436.870 2.438 10 20 IECD O=C(COC(=O)[C@H]1CCc2n[nH]cc2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 757807292 JWVGGOPRQQHNIZ-ZDUSSCGKSA-N 429.432 2.472 10 20 IECD COC(=O)c1ccccc1CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759225628 RSGCDFVNUHYEJY-UHFFFAOYSA-N 428.485 2.390 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1C 764932836 SVSXLSOOWGRGTC-UHFFFAOYSA-N 449.554 2.393 10 20 IECD CCOC(=O)c1ccc(N2CC(NC(=O)NCc3cccc(Br)c3O)C2)nc1 765534935 FRDHTMZQQXECAS-UHFFFAOYSA-N 449.305 2.414 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3ccc(F)cc3)CC2)cc1 770103591 PGAXZWVGGIMETD-JOCHJYFZSA-N 430.524 2.379 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(CCNS(C)(=O)=O)cc3)c2)CC1 770149508 ZAYZYHZKCKKDNX-UHFFFAOYSA-N 430.574 2.173 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](c3cccs3)C3CC3)cc2)C1 785787089 IAMWLJCAHPBMQY-PXNSSMCTSA-N 440.569 2.334 10 20 IECD C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785898080 RWRDYFAOTOLYGG-MRXNPFEDSA-N 429.492 2.122 10 20 IECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(F)c1 786119738 FYCKCQSFHSGTFU-UHFFFAOYSA-N 439.484 2.120 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CCN4C)cc2)CC1 787324721 CSKHYWPWXFTQOD-UHFFFAOYSA-N 435.528 2.064 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H](C)[S@]1=O 791178663 VVAHXYBFFVXLMM-UTCQKKMUSA-N 428.557 2.236 10 20 IECD C[C@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCCC1 793707147 DTRWKKWWHITIDO-IAGOWNOFSA-N 438.519 2.364 10 20 IECD CC[C@@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716666 DSRSZTJJLLHTMH-FGZHOGPDSA-N 448.567 2.368 10 20 IECD O=C(COC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)NCc1ccc(N2CCOCC2)c(F)c1 796317112 HLAGKXRGCBUFDY-RCQPWZCASA-N 440.515 2.216 10 20 IECD COc1ccc(NC(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)cc1-n1nnnc1C 797741952 AHZDZPFKYHQLMR-UHFFFAOYSA-N 446.851 2.457 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)cc1F 803539737 ZZNMWJBKAZYSNF-MRXNPFEDSA-N 436.528 2.414 10 20 IECD COCCN1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676177 AHZVPWGDRMUUAH-JOCHJYFZSA-N 430.593 2.299 10 20 IECD C[C@H](OC(=O)c1ccoc1CC(N)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803941041 IXNFOISGLNFBHE-LBPRGKRZSA-N 446.415 2.267 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@H](SC)C3)cc2F)CC1 805007003 CKUSFECFXHALSF-MSOLQXFVSA-N 436.597 2.374 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OC)c1 805153749 SABFZERLONNJRD-OAHLLOKOSA-N 429.517 2.315 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1 807006976 XBYIBGPBJYNPLG-UHFFFAOYSA-N 437.493 2.159 10 20 IECD CN(CCO)S(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 813682682 HTHHCMZESDCQJF-UHFFFAOYSA-N 433.313 2.242 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 916196963 STIDLRYCUDDXPH-SFTDATJTSA-N 447.624 2.006 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(C(=O)N(C)C)cc1OC 918305136 CYWLBLWYIBSRRJ-UHFFFAOYSA-N 442.516 2.069 10 20 IECD COCCNC(=O)CN1CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 920434938 DUDLOLIJCKFZCS-UHFFFAOYSA-N 432.952 2.268 10 20 IECD C[C@@H](NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1ccc(N2CCOCC2)cc1 920880207 CMPSZVZVZPYNGY-MRXNPFEDSA-N 433.530 2.392 10 20 IECD C[C@H](NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 1324886308 GABBIHKERMOBPN-SFHVURJKSA-N 432.565 2.253 10 20 IECD CNCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795594638 OXTGGLWRKYKQAB-RUMRUAAYSA-N 438.572 2.297 10 20 IECD Cc1noc(C)c1CCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842076343 FMXZGOGUZOVKMT-VMPITWQZSA-N 441.484 2.258 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1cnc2c(oc3ccccc32)c1=O 104990810 YDDFNKXITARDIN-UHFFFAOYSA-N 448.479 2.411 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CN(C)C4)cc2F)CC1 730391175 KVRNGJWPZDJPAT-UHFFFAOYSA-N 439.535 2.168 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NCCS(=O)(=O)NC[C@H]3CCCCO3)c2C)cc1 732163638 GIVHCJJEQGOMNL-HXUWFJFHSA-N 449.573 2.321 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 732913739 BGTYXGSUBOPPGQ-MRXNPFEDSA-N 448.911 2.339 10 20 IECD Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 743897727 SNAKKYKZYIIRQC-UHFFFAOYSA-N 438.484 2.043 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)cc1 746372396 PQBSNYAQKCLDBC-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(C(F)(F)F)ccc3=O)cc2F)C[C@@H](C)O1 754722045 AWGJUPYFMBNECO-BETUJISGSA-N 442.413 2.331 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc4c(c3)C(=O)NCC4)cc2F)CC1 758466389 AJMYSBJTBQVKNH-UHFFFAOYSA-N 439.535 2.253 10 20 IECD COCCNC(=O)c1c(NC(=O)COC(=O)c2cccc(O)c2O)sc2c1CCCC2 758558454 GRODUQOZBQOSLI-UHFFFAOYSA-N 448.497 2.210 10 20 IECD COc1cc(N2CCN(Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)CC2)cc(OC)c1OC 758965691 TXQFRVBSZZBXRZ-UHFFFAOYSA-N 444.444 2.308 10 20 IECD COCCO[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 760965382 JVNGPRPRQOFARX-WSTZPKSXSA-N 437.556 2.183 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H](c4nccn4C)C3)CC2)cc1 769770300 IQULZJCBIHJQTL-YXBWYFRISA-N 437.544 2.040 10 20 IECD CCCNC(=O)[C@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c2ccccc2O1 773845371 HZKVHOIINWEIGB-HRAATJIYSA-N 438.528 2.250 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCN3CCOCC3)cc2Cl)C1 774468039 HLYKZKFAGNPHJX-QGZVFWFLSA-N 436.984 2.031 10 20 IECD C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cn(C)cn1 777823238 RPPZSJDGBPFSOJ-MRXNPFEDSA-N 428.514 2.194 10 20 IECD O=S(=O)(c1ccccc1Cn1cncn1)N(Cc1ccccc1O)C[C@@H]1CCCO1 781399799 HNVGXMGXYODOPN-IBGZPJMESA-N 428.514 2.402 10 20 IECD Cc1nc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 786496769 KWOISCILRQUDSG-UHFFFAOYSA-N 438.500 2.497 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N2CCOCC2)c1 787611147 GFCXRHRQEBNBAA-HSZRJFAPSA-N 438.572 2.175 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCO[C@H]3CCCC[C@H]3C)cc2F)CC1 787990689 SNEJQMXCUQEIEG-GCJKJVERSA-N 448.583 2.295 10 20 IECD Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789821878 USQHLNIHTJLGGI-GJZGRUSLSA-N 446.523 2.409 10 20 IECD CN(c1ccc(CNS(=O)(=O)CCCS(=O)(=O)N(C)C)cc1)C1CCCCC1 790009587 FWPZUCRKRSUIPN-UHFFFAOYSA-N 431.624 2.156 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 792805595 KYGGKRLSBXEFAW-MRXNPFEDSA-N 430.515 2.430 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3COC(=O)NC(C)C)CC2)cc1 796703666 CPCVEYJBDQUERD-YADHBBJMSA-N 448.608 2.167 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 799251165 NNJRDEQSODUDOG-NRFANRHFSA-N 438.528 2.268 10 20 IECD Cc1nc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nc2ccccc12 804286951 QTLBCJHTRIPWEW-UHFFFAOYSA-N 433.512 2.050 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 804389306 BRCRNGHVVHYRSF-JKSUJKDBSA-N 446.573 2.058 10 20 IECD CCOC(=O)Nc1scnc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 813531371 HIAOVRNRFQDGTR-UHFFFAOYSA-N 431.518 2.310 10 20 IECD CCN1C[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1=O 914912646 XMDSZZYRQAYFES-QGZVFWFLSA-N 426.469 2.475 10 20 IECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 917912717 SHTUGUMYDLISLG-UHFFFAOYSA-N 449.598 2.363 10 20 IECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 919816271 WPOSCFAHUACPJI-LJQANCHMSA-N 425.620 2.450 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](c3ccccc3)n3cccn3)CC2)cc1 920910847 TYUJZRYQRRZDAY-QHCPKHFHSA-N 434.496 2.373 10 20 IECD COC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786442555 OYSSJXOSZJTTOQ-ZDUSSCGKSA-N 435.571 2.263 10 20 IECD CSc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1O 1799262193 ZLDCVNXWMCLXMU-BTTYYORXSA-N 429.498 2.486 10 20 IECD COc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cn1 1806333238 JJVNGJYQOKUXJG-UHFFFAOYSA-N 426.473 2.055 10 20 IECD CCc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807883380 LRYYYYDAWUCHRG-VGSWGCGISA-N 447.495 2.479 10 20 IECD CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813698039 IBNOKKTYIDNQIA-HKZGKQEBSA-N 446.598 2.160 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n(C)n1 1817846075 HWSOOGQEFPPDBY-OAHLLOKOSA-N 439.476 2.132 10 20 IECD Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1822696846 QOGJHOUIBYZUCQ-HNNXBMFYSA-N 426.433 2.061 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)CC1CCC1)CC2 1828248959 CDKYPPSMAPMQIO-LLVKDONJSA-N 438.600 2.106 10 20 IECD CCN1CCN(c2ccc(CNc3cccc(S(N)(=O)=O)c3[N+](=O)[O-])cc2F)CC1 302154585 VKMDWBOJTIATSX-UHFFFAOYSA-N 437.497 2.135 10 20 IECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)n2)c[nH]1 727247646 HFYLDPSENZMAFX-UHFFFAOYSA-N 434.455 2.171 10 20 IECD O=C(COC(=O)[C@@H]1CCOc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 728355821 FNCILFOZSHMCEM-GOSISDBHSA-N 428.460 2.388 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3nc(-c4cccs4)no3)CC2)cc1 729469842 IJOYARSVBMKEDR-UHFFFAOYSA-N 440.573 2.298 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)c1 734073718 WLHPMTROEXSMSR-UHFFFAOYSA-N 439.390 2.176 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccc(NC(=O)C4CC4)cc3)nc12 745492037 YFNHCDVTOGGKDW-UHFFFAOYSA-N 438.440 2.246 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CC[C@@H]3Cc4ccccc4NC3=O)nc12 746922513 FFCCSEIFJFIRTN-CQSZACIVSA-N 438.440 2.246 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc([S@@](C)=O)cc3)CC2)cc1 749565031 RWDWWPMPDXHDPK-WJOKGBTCSA-N 444.601 2.396 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Oc4cc(C)ccn4)CC3)CC2)cc1 754268010 CUDBNDHJFMZMQK-JOCHJYFZSA-N 440.588 2.425 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccccc3N(C)C)CC2)cc(OC)c1OC 759414238 VTFWVZLQHBNYBK-UHFFFAOYSA-N 442.516 2.066 10 20 IECD C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)S(=O)(=O)C1CCOCC1 765344558 PSGDPKYQSJYOPR-PXNSSMCTSA-N 438.590 2.243 10 20 IECD NC(=O)[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)cc1 766749875 GDMUXIMNFLYPKE-GOSISDBHSA-N 447.378 2.466 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)cc3F)cc2F)C[C@@H](C)O1 769743239 VVQJCFOAKXVKPQ-BETUJISGSA-N 439.484 2.156 10 20 IECD COc1cccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1F 770774556 QHFHZRSXELONCG-UHFFFAOYSA-N 447.463 2.147 10 20 IECD COc1cccc(CNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c1O 771015550 MFAZGBZSWIKRRC-NSHDSACASA-N 432.420 2.403 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccnc(O)c3Br)cc2)CC1 772638546 BSTNIYFYELOAOR-UHFFFAOYSA-N 447.333 2.077 10 20 IECD CN1CCN(c2ccc(CN3CCN(Cc4nc(N)c5ccccc5n4)CC3)cc2)CC1 775644922 UBYOLUDWHPUBFY-UHFFFAOYSA-N 431.588 2.282 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn([C@H](C)C4CC4)c3)cc2F)CC1 778606645 MYJKDFMVFBUPEK-MRXNPFEDSA-N 442.539 2.390 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F)c1ccc(N2CCOCC2)cc1 782105677 DQWIACZNXCDQGV-LBPRGKRZSA-N 425.411 2.091 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 784025744 KJCNQIVYPQSREH-UHFFFAOYSA-N 444.919 2.359 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2 785192784 CYOLZTCPIJADQF-UHFFFAOYSA-N 448.273 2.473 10 20 IECD COc1ccc(OC)c([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 785498532 KFTCLUFYTPJNNH-KRWDZBQOSA-N 441.528 2.376 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cccc(Cn2ccnc2)c1 787297823 LYUBFNRSTWEPMK-UHFFFAOYSA-N 449.580 2.417 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)c1 787614439 VADUNLZWMLMMTD-XXBNENTESA-N 438.572 2.428 10 20 IECD Cc1nc2c(s1)[C@H](N(C)C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788333950 TWRXKCMRDQOCGV-LJQANCHMSA-N 428.558 2.440 10 20 IECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833265 FZAMFEFZHAQNMT-LJQANCHMSA-N 448.583 2.174 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)CC2)cc1 790917172 FISDKCFINNSVHQ-QGZVFWFLSA-N 441.532 2.000 10 20 IECD CC[C@@]1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 791428721 ZZRRANQVOVLBMY-LJQANCHMSA-N 435.458 2.400 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CN3C[C@@H](C)C[C@H](C)C3)CC2)cc1 793915599 ZNILHEVHDPSMNY-GBESFXJTSA-N 430.593 2.263 10 20 IECD CN(C)CC1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCC1 799039142 ZDGNUYKRVQGHJG-UHFFFAOYSA-N 448.501 2.315 10 20 IECD O=C(CN1CCC[C@H](CN2CCOCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 801569209 IRNJPTRHRCHARX-GOSISDBHSA-N 447.535 2.445 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@]2(C1)OCc1ccccc12)c1ccc(N2CCOCC2)cc1 803299862 BMCQEIKUSVWEIM-AVRWGWEMSA-N 435.524 2.358 10 20 IECD COc1cc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 803311329 UTKDTDWPFLTTHI-GOSISDBHSA-N 425.529 2.376 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc(O)c4ccccc4n3)cc2)C1 917832229 OUMRHPDWLAELPD-QGZVFWFLSA-N 433.512 2.286 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)nc(O)c4ccccc43)cc2F)C[C@H](C)O1 918141627 WTEGDBGLGQHRAY-GJZGRUSLSA-N 440.475 2.171 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1Cl 918310525 KZURFKQRMPOUPH-UHFFFAOYSA-N 444.919 2.133 10 20 IECD CSC[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 919767390 XIMUULQUECIGSF-VAMGGRTRSA-N 445.585 2.046 10 20 IECD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)s1 1785509270 YHUSSAGHSKCKJJ-SNXGKTBFSA-N 444.509 2.330 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cnccn3)C2)CC1 1808121178 UVJXONLORXPYKX-HWKANZROSA-N 438.484 2.152 10 20 IECD Cc1nn(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816242912 HXWULUPNSIUAPP-CYBMUJFWSA-N 443.439 2.017 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H](O)c1ccccc1 1817079653 TXCXTMYTPYMTBS-OXJNMPFZSA-N 437.456 2.255 10 20 IECD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)n1cccc1 1838031774 LOCPAWPNDPFHCL-INIZCTEOSA-N 442.516 2.168 10 20 IECD COc1cccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843442355 DEZIRICILMFTHI-UHFFFAOYSA-N 432.480 2.305 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@]3(N4CCOCC4)CCSC3)CC2)cc1 726613211 ORGVGPHMLVBCMR-JOCHJYFZSA-N 434.606 2.171 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(CC(F)(F)F)CC3)cc2F)CC1 730133245 NIERZRHYQYQQFC-UHFFFAOYSA-N 431.478 2.357 10 20 IECD COc1ccc(O)c(CNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1 734068304 CLYKEQDUXBOWQU-GOSISDBHSA-N 426.517 2.098 10 20 IECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NCc2cc(OC)ccc2O)n1 734072929 VJFUGCYGSAOSBA-UHFFFAOYSA-N 438.440 2.018 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4c(F)cccc4F)=NO3)cc2)C1 736005090 BMBNYZIRCGAFPJ-FOIQADDNSA-N 442.466 2.476 10 20 IECD CCN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCS(=O)(=O)C1 745903606 HTNBTRPKBODMHQ-GDBMZVCRSA-N 431.505 2.475 10 20 IECD Cc1cc(C(=O)CN2[C@@H](C)C(=O)N(C)S2(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 752889436 ZBYYKZPKXBCAQD-ZDUSSCGKSA-N 441.456 2.286 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1F 753742261 QOZJGIXENBKDIL-AWEZNQCLSA-N 425.464 2.178 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(N4CCCC4)s3)CC2)cc1 758202237 HGEJVYKPVODVIK-KRWDZBQOSA-N 435.619 2.422 10 20 IECD CCNC(=O)c1cccc(C)c1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758231467 MWOXVAFRFVPONG-HXUWFJFHSA-N 427.545 2.315 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@](C)(O)c3ccc(F)cc3)CC2)cc1 758739643 WRODOLZORANSNG-QHCPKHFHSA-N 430.524 2.163 10 20 IECD CN(C)C(=O)COc1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761006937 XYBTZCJRJRVQSS-UHFFFAOYSA-N 431.876 2.477 10 20 IECD CC[C@@H](c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CCN1CCOCC1)N(C)C 764451981 NMFJFVXMMQDABU-INIZCTEOSA-N 449.577 2.009 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)Cc2cc(Br)cc(OC)c2O)C1 769301748 DMMZQBUQGRLGRF-CYBMUJFWSA-N 443.338 2.397 10 20 IECD CCOC(=O)c1cc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1C 778295956 UATGDJJLRMQQMW-KTKRTIGZSA-N 440.500 2.054 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H](Cc3ccccc3)C(=O)O)cc2F)CC1 780568019 CEEITBRISKGOJO-HXUWFJFHSA-N 428.508 2.463 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCc3nnc4n3CCCCC4)cc2)CC1 785919227 GUHXIBDANMUNFZ-UHFFFAOYSA-N 438.576 2.216 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc(S(N)(=O)=O)c4cccnc34)cc2)CC1 786067383 JLXOJAQDXBLSDS-UHFFFAOYSA-N 439.541 2.163 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CN(CCc3ccccc3)C(C)=O)cc2)CC1 786254360 COZHDMQAEUWIMJ-UHFFFAOYSA-N 436.556 2.063 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3nnn(-c4ccccc4)c3C)cc2)CC1 786655785 IRTXDVWWXRUZAI-UHFFFAOYSA-N 432.528 2.103 10 20 IECD C[C@H](CN1CCCCC1)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 787752495 VFXVPTKCADLHQO-KZNAEPCWSA-N 434.556 2.046 10 20 IECD CCOCCOCCN(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 787986190 AISQVBUNNNECCH-UHFFFAOYSA-N 426.425 2.495 10 20 IECD CSc1cc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccn1 789828944 ZMEPMMHBLRQCFW-GASCZTMLSA-N 446.548 2.489 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1C[C@H]2CC[C@H]1C2 789835051 NSZQZWJNXOXGHN-SGXKBVARSA-N 447.551 2.067 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@@H]1CCOc2ccccc21 789843029 HJDUQKUYQFGILK-KRWDZBQOSA-N 441.503 2.086 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298155 QDWNTHQZNRRXNS-XXBNENTESA-N 437.540 2.171 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccc(N(C)C)cc1 803399514 BXQFYHRYBZBNAC-JTSKRJEESA-N 442.535 2.259 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 803400323 DAFBDLGFCSRXND-QFIPXVFZSA-N 442.535 2.040 10 20 IECD CCn1nccc1CN(CCO)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677188 IHLCBVMBDVFIIY-UHFFFAOYSA-N 441.576 2.309 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(Cc3cccs3)C(C)C)CC2)cc1 803749988 JISHERPQMGAIDM-UHFFFAOYSA-N 444.601 2.432 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 804315477 MBZYWBYDZPYOTO-MBSDFSHPSA-N 440.588 2.256 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@H]3COc4ccccc4O3)CC2)cc1 804317706 MZXFDABQEDIXID-FQEVSTJZSA-N 439.512 2.079 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 804968512 GRXUJMGJOWLHAB-UXLLHSPISA-N 427.542 2.063 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCN(c4ncccc4F)C3)cc2)CC1 805023625 YCPMENAQDLONAS-IBGZPJMESA-N 439.535 2.468 10 20 IECD CCCNC(=O)OC[C@@H]1CCCCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 805775432 FMBQRTSMSRKQAN-FQEVSTJZSA-N 432.565 2.335 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)CC2)cc1 806515777 FGZHNYWEMPGOOI-QGZVFWFLSA-N 448.564 2.153 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(CCCOCC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807672669 FRSPUKOBSMOHDX-INIZCTEOSA-N 444.498 2.043 10 20 IECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769399 UDQZZSDSQXUTGQ-QAPCUYQASA-N 425.476 2.401 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3COc4c(F)cc(F)cc4C3)CC2)cc1 812017168 YYYWVTYOLDAWES-SFHVURJKSA-N 446.498 2.398 10 20 IECD C[C@@H](c1ccccc1)[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(N)=O 813590573 NYJZHBZRRDXWIH-YCRPNKLZSA-N 428.508 2.244 10 20 IECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCC[C@H]4CO)cc3)cc2)CC1 864044924 NQSIOUWAGBEAQM-QFIPXVFZSA-N 444.601 2.196 10 20 IECD CCNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 916678136 LFZDYCFINMEWHS-UHFFFAOYSA-N 430.480 2.499 10 20 IECD COC(=O)CN(C)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 920445087 RVWVPSMSKAXWMK-KPKJPENVSA-N 443.344 2.282 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 1116570499 AACAURGCZGACSM-MPGHIAIKSA-N 443.500 2.011 10 20 IECD CNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 1116597970 SWFQWFGWYJMLCN-NRFANRHFSA-N 445.585 2.411 10 20 IECD CC(C)n1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n1 1780381847 MNWXBTXBXDLAOK-OAQYLSRUSA-N 448.907 2.286 10 20 IECD Cc1cccnc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003905 OOHLJRYQQGVCDC-NRFANRHFSA-N 431.876 2.212 10 20 IECD CC(C)(F)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783222520 WVGZDQXYENMTOB-PZPVZQRNSA-N 436.480 2.079 10 20 IECD CC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@H]2C1 1790124342 PGAUHZKFHWMIPK-SNJCGAMXSA-N 439.556 2.458 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccncc1)C1=NN(c2ccccc2)C(=O)C1 1799886140 JRERYXBSBWEPAB-FNLKRUPLSA-N 431.496 2.055 10 20 IECD O=C(COc1ccc(O)cc1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1805249901 IYTAOHFIRCWFTO-UHFFFAOYSA-N 441.484 2.122 10 20 IECD Cc1ncc(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)[nH]1 1806283055 MXSUUTBMJJKJSW-GQCTYLIASA-N 440.500 2.393 10 20 IECD CN(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806901924 RVRFCGWUIXXJTR-QRWLVFNGSA-N 446.935 2.418 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnccc1F 1807824738 IGOZNIVKMXOGFD-JLTOFOAXSA-N 437.431 2.055 10 20 IECD CCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827426788 GUZKRARDMSXJRC-SFHVURJKSA-N 427.505 2.256 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1cc(C)ccc1NS(C)(=O)=O 461039447 ZXLQOQXDAIZHBM-UHFFFAOYSA-N 433.511 2.323 10 20 IECD C[C@]1(C2CC2)NC(=O)N(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 726566052 XMYKMQDFLNYAGW-OAQYLSRUSA-N 436.459 2.094 10 20 IECD CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 737146568 RBHXMUIODBYGGK-UHFFFAOYSA-N 438.528 2.306 10 20 IECD CCN(CC)c1ccc(CNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)cc1F 741214221 MHVZEPAGPLAQMH-UHFFFAOYSA-N 436.528 2.367 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 743809016 KWOVKUIFPMUMFP-UHFFFAOYSA-N 440.319 2.001 10 20 IECD C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744402391 HIXMVHBPWVHGSX-UONOGXRCSA-N 428.510 2.154 10 20 IECD C[C@@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC(=O)NCC(F)(F)F 744474844 YQBZIJBTYMFLCB-SNVBAGLBSA-N 448.353 2.395 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(S(=O)(=O)NC)ccc2C)cc1 749633532 RFOYJQISRWNMOB-UHFFFAOYSA-N 432.546 2.004 10 20 IECD CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 751238681 BLNWLETUMUUQJH-UHFFFAOYSA-N 437.587 2.071 10 20 IECD O=[N+]([O-])c1cc(NS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1O 753520326 GFZUXPGGHCPHBJ-UHFFFAOYSA-N 441.487 2.276 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(N)(=O)=O)ccc1OC 761753770 VRMYWMGUASHKPX-UHFFFAOYSA-N 443.319 2.473 10 20 IECD COC(=O)c1[nH]c(C)c(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1C 769078443 UGUKPWJKWKRHIZ-UHFFFAOYSA-N 428.533 2.369 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc([S@@](C)=O)c3)CC2)cc1 778267743 FNXJYUQOUSVPEL-GLJHGQBWSA-N 427.526 2.276 10 20 IECD COc1cc(N2CCN(C(=O)NCc3nnc(SC)s3)CC2)cc(OC)c1OC 782651948 CEXNCCBOWGJNLA-UHFFFAOYSA-N 439.563 2.318 10 20 IECD COC(=O)COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1O 785400869 FHYUBHODEHJMHX-UHFFFAOYSA-N 444.805 2.084 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1 785424052 LCZBUMHJKKAMEE-UHFFFAOYSA-N 442.947 2.397 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C2CC2)cc1 787142475 ALOXHVODMCIIEB-UHFFFAOYSA-N 435.572 2.419 10 20 IECD CCSc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 789801815 VHIMHBVWLSPNKU-UHFFFAOYSA-N 432.521 2.102 10 20 IECD CCN1CCN(C[C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 790209116 LGCIAQKJZWDMKK-HXUWFJFHSA-N 444.620 2.443 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O)c1ccc(N2CCOCC2)cc1 803305778 OXXJBGJGRHNPGT-BUUXRYEFSA-N 443.588 2.489 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]12 803448320 OGLSWXMXQDUGNU-IPMKNSEASA-N 437.487 2.447 10 20 IECD COc1ccc(CNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 812509279 KUWPFWPLYCSPPK-UHFFFAOYSA-N 429.539 2.067 10 20 IECD O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1cccc(S(=O)(=O)NC2CC2)c1 861897329 JHXZJNNMFKSNKA-UHFFFAOYSA-N 436.540 2.447 10 20 IECD COc1ccc(COCC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 917300157 VHRKZWPERRXZPM-UHFFFAOYSA-N 428.485 2.112 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 917384089 RZAFTFSFACIUGK-UHFFFAOYSA-N 449.598 2.095 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCN3C(=O)c4ccccc4C3=O)cc2)C1 917833876 UXTJYCHXJAAWBD-GOSISDBHSA-N 448.523 2.081 10 20 IECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 918443118 UFALPYOCECYXIC-UHFFFAOYSA-N 438.528 2.417 10 20 IECD CCOCCO[C@H](C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919701132 KVBOIMOOHSZTEF-QGZVFWFLSA-N 431.512 2.000 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1ccccc1)N1CCSCC1 1320437282 WRIIRYCDWNACHE-RXVVDRJESA-N 444.553 2.478 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]3OCCC[C@@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1340897166 FBWLZOYZPMLYMM-VGSWGCGISA-N 431.558 2.425 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)C(F)F 1816837055 CFGAJCLTOGTATO-OAHLLOKOSA-N 430.415 2.460 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847001 GTSVJTNSWZKDJE-FZMZJTMJSA-N 447.448 2.083 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2nccn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821294547 IONQZRGWIMLTIM-AWEZNQCLSA-N 445.867 2.072 10 20 IECD CN1CCC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1830182321 XGDZDOMCFCBVTC-MJGOQNOKSA-N 430.549 2.068 10 20 IECD CNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 23486271 PGRRLBHGGJPJCG-UHFFFAOYSA-N 428.445 2.151 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@](C)(O)c3cccs3)CC2)cc1 303866218 UNOBGQUWJVVMNI-JOCHJYFZSA-N 432.590 2.476 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)NCc3c(C)c4ccccc4n3C)C2)cc1 472284057 ZWZNOQAJUUVWHW-UHFFFAOYSA-N 442.541 2.368 10 20 IECD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 726234711 KSRYVGUSUCFIEO-SFHVURJKSA-N 434.556 2.481 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4scnc4c3)cc2)C1 726291452 GIXNIVRJFBEKMN-OAHLLOKOSA-N 437.525 2.253 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1 726544724 XIBNZQJWZRVWOI-UHFFFAOYSA-N 432.528 2.353 10 20 IECD COc1ccc(O)c(CNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c1 734064075 WMDPTNWHBQTLPU-UHFFFAOYSA-N 448.545 2.049 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1 734701595 HSOZQEFDUPQJJJ-UHFFFAOYSA-N 437.544 2.018 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(C(N)=O)s3)cc2F)C[C@H](C)O1 748958830 OPPVVAQSODNVHV-STQMWFEESA-N 449.504 2.073 10 20 IECD CC(C)[C@H](NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nc(-c2nc[nH]n2)no1 752659235 GFIXMRIRUJYMEY-YOEHRIQHSA-N 440.508 2.449 10 20 IECD CCOc1ccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759410381 RQZGZLKDVWXGMI-UHFFFAOYSA-N 443.500 2.398 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](NC(=O)NC2CC2)C1 760897231 OSHAETLRCRESNP-WMLDXEAASA-N 446.507 2.325 10 20 IECD CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN1CCOC 766772344 QBBSIVNVPDSBEK-RBBKRZOGSA-N 445.608 2.031 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](CC(=O)OC(C)C)C3)CC2)cc1 766914598 DHTBJZSVLJUOQT-IRLDBZIGSA-N 433.593 2.232 10 20 IECD CC(=O)N1CCc2c(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 768805857 OFGCIOCLWAAWQG-UHFFFAOYSA-N 426.492 2.300 10 20 IECD COC(=O)c1ccc2c(c1)CN(C(=O)/C=C\C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2 778265288 JWJJLBBTNMXTIW-KTKRTIGZSA-N 449.507 2.229 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 778288322 XOEZBBCRBYUYLS-RQWLHQTBSA-N 440.588 2.377 10 20 IECD CCOc1cnc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 778535996 AWAMUFDTHWVNOE-UHFFFAOYSA-N 431.404 2.446 10 20 IECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789818363 JNTUEZLYUUFDQW-CMKODMSKSA-N 448.583 2.436 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21 792822827 XNJXWQAXSDKPPX-LJQANCHMSA-N 430.526 2.215 10 20 IECD CCC(CC)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)SC 793723774 NBSLUOFFQJQXRZ-QGZVFWFLSA-N 434.606 2.043 10 20 IECD O=C(NCc1ccn2ccnc2c1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449435 ZLDWEAGKTHLKGU-UHFFFAOYSA-N 443.454 2.337 10 20 IECD Cc1nc(CN2CCC(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)oc1C 803662600 DGYHTYRSCBUKNZ-UHFFFAOYSA-N 445.539 2.141 10 20 IECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H](C)C1 806443876 VNNSAKBLHGECHF-HOTGVXAUSA-N 444.498 2.139 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1 806846337 KSFVWAYRCLGQIL-UHFFFAOYSA-N 426.448 2.142 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 806948229 YXMAZKFDTAEUAD-FZKCQIBNSA-N 425.476 2.445 10 20 IECD COc1ccc2[nH]cc(CC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2c1 918337840 PJAWURLMXZCYHZ-UHFFFAOYSA-N 427.526 2.270 10 20 IECD COc1ccc(N2C[C@H](C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2=O)cc1 919969501 NXDZTLHZSIDPIA-QGZVFWFLSA-N 441.503 2.465 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 1323860070 PODYGNKYJWHHPB-SQNIBIBYSA-N 432.517 2.117 10 20 IECD Cc1cnoc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1779980251 IBMVUYUKZAAOIV-IIBYNOLFSA-N 449.891 2.489 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242238 XPVOHOMECCBWOY-YEWWUXTCSA-N 431.876 2.053 10 20 IECD CC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803007168 VARXVLIPWLAZEV-SKDZVZGDSA-N 433.892 2.237 10 20 IECD COc1nccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1F 1810230002 UZYAUVQOLVCIKH-UHFFFAOYSA-N 444.463 2.194 10 20 IECD CCOC(CC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)OCC 1810550449 KNJIIDDLNFCARL-UHFFFAOYSA-N 435.521 2.127 10 20 IECD C/C=C/C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1812537951 YFGNISYAFYIFAC-DUDWFQMESA-N 431.496 2.456 10 20 IECD Cn1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)n1 1816321293 SIBSQPWUURSDGQ-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD CO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822456942 ITTYDJVALVSWJX-SYFYSMEQSA-N 430.461 2.267 10 20 IECD O=C(c1cnc2ccccc2n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037932 XEICASUAXPBWAN-VQHVLOKHSA-N 446.463 2.277 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(CCN4CCOCC4)C3)ccc21 604372548 OTHFPFAQEYUSNE-NRFANRHFSA-N 428.577 2.041 10 20 IECD Cc1nnnn1-c1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 727938349 AUUHRUBYDSTYSK-UHFFFAOYSA-N 429.431 2.407 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 734686490 PJAMIUKEAIZJOO-JOCHJYFZSA-N 429.609 2.225 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 736196087 MZUQGCFDDGJRPC-SFHVURJKSA-N 445.585 2.187 10 20 IECD COCCNS(=O)(=O)c1c[nH]c(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 741144505 VFJWIJJVRMSZCH-UHFFFAOYSA-N 434.562 2.202 10 20 IECD C[C@H](CN1CCN(C)CC1)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745809210 RHCRIKSAWCBFCE-SJORKVTESA-N 425.524 2.192 10 20 IECD CS(=O)(=O)CC[C@@H]1NC(=O)N(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 757916395 SOJVYQGXVHEJAV-KRWDZBQOSA-N 443.485 2.396 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCNC(=O)C3CCC3)cc2F)C[C@H](C)O1 759999521 ONPBIEIGOGMZTJ-ROUUACIJSA-N 448.583 2.294 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765132307 BWSLCWKYHOUQNX-LLVKDONJSA-N 447.485 2.478 10 20 IECD O=C(CSc1nnnn1CC(F)(F)F)NCc1cccc(Br)c1O 765750717 KMBTXQRTRDTNLH-UHFFFAOYSA-N 426.218 2.112 10 20 IECD COc1ccc(S(=O)(=O)Nc2cc(C)c(O)c(C)c2C)cc1[C@@]1(C)NC(=O)NC1=O 775291222 GGRKTZPEJZGXKX-HXUWFJFHSA-N 433.486 2.181 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OC)c(NS(C)(=O)=O)c1 784029260 ZQPJKWLTVMEBOW-UHFFFAOYSA-N 435.502 2.150 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)Cc3ccccc3C)CC2)cc1 785527681 CGJVCADRPRAPKX-UHFFFAOYSA-N 438.572 2.291 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1 788013690 IYPKXKCHOGMONB-FQEVSTJZSA-N 437.588 2.004 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C 789778963 WKYNPYCJHGGZJK-NSHDSACASA-N 430.411 2.462 10 20 IECD Cn1cccc1[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841117 RWDMMTLKBKMCOY-NRFANRHFSA-N 428.508 2.105 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1nc(Br)ccc1F 792066677 PYEHJSXQOJLZND-UHFFFAOYSA-N 442.310 2.148 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(CN(C)C(C)C)CC3)CC2)cc1 804317631 KJTKXGGSCZAXHF-UHFFFAOYSA-N 430.593 2.359 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 804968510 GRXUJMGJOWLHAB-HLLBOEOZSA-N 427.542 2.063 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCSc3nccs3)CC2)cc1 806276072 GGCDWXRUFPWLFH-UHFFFAOYSA-N 434.587 2.489 10 20 IECD C[C@@H](O)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H](C)C1 806443878 VNNSAKBLHGECHF-HZPDHXFCSA-N 444.498 2.139 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 807287707 MJUBLSOVAHGRES-UHFFFAOYSA-N 437.515 2.414 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 807290224 FTHNEFMDMFLOTK-FQEVSTJZSA-N 438.915 2.254 10 20 IECD COc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1[C@]1(C)NC(=O)NC1=O 808113518 BSRDUKOIEPUUFN-KRWDZBQOSA-N 443.840 2.049 10 20 IECD C[C@H](c1ccc(F)cc1)N1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 818641774 WJPNAIZUFYYMNB-ACJLOTCBSA-N 449.504 2.385 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)cc1 915732050 DXCXMPGCHAQGIV-UHFFFAOYSA-N 433.512 2.392 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)oc(C)c2C(=O)OC)cc1OC 917758214 LMMPZUXNJAWTRJ-UHFFFAOYSA-N 446.503 2.254 10 20 IECD CCNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918117861 RISMEAFECNFTNU-FQEVSTJZSA-N 437.544 2.137 10 20 IECD Cn1nc(C(C)(C)C)cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919499083 ADGRCYMBJPZNJI-UHFFFAOYSA-N 432.496 2.167 10 20 IECD C[C@H](NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 920880938 JQRBMYZTZUKYIA-INIZCTEOSA-N 426.473 2.429 10 20 IECD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccn1 1782008332 ZSINLZATJIWMMA-RCDICMHDSA-N 445.903 2.393 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847003 GTSVJTNSWZKDJE-SMDDNHRTSA-N 447.448 2.083 10 20 IECD CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1819886905 HHBJTVJISWPMON-HNNXBMFYSA-N 426.433 2.386 10 20 IECD CC(C)Cn1c(SCC(=O)NCc2ccc(N(C)C)cc2)nnc1N1CCOCC1 27845704 SROWMODBUMYDCF-UHFFFAOYSA-N 432.594 2.245 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)cc2F)CC1 734213468 BMMVDZBKGKXKDS-RTBURBONSA-N 433.572 2.414 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)cc1 734844072 TUHVYZZOJALKCU-RPWUZVMVSA-N 443.613 2.301 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 737165203 APLMYKYGPUTZFF-UHFFFAOYSA-N 437.544 2.214 10 20 IECD CN(C)CCN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 741078921 ULGCUJSCCCIGML-UHFFFAOYSA-N 445.530 2.177 10 20 IECD Cc1cc(C(=O)CN(C)C[C@@H]2CCCN(C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741253951 ZBUDQLGKGRFNJJ-GOSISDBHSA-N 432.590 2.198 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccn(-c4ccc(OC)cc4)n3)CC2)cc1 742917399 WFBFQQPBOPBZHV-UHFFFAOYSA-N 435.528 2.442 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(F)cc3Cl)CC2)cc1 743442539 KYFCSMDSRXKVCT-UHFFFAOYSA-N 434.899 2.365 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](C)CN3CCN(C)CC3)cc2F)C[C@@H](C)O1 745646750 AFTTVWZGSNPTAV-QRVBRYPASA-N 435.588 2.122 10 20 IECD O=C(COC(=O)c1nccn2ccnc12)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 748464120 NDMSLTNQWBMCGJ-UHFFFAOYSA-N 426.388 2.300 10 20 IECD Cc1cccnc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 750518404 VREYIVNCJJDBLZ-UHFFFAOYSA-N 427.482 2.485 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(C)c([N+](=O)[O-])c1 753823626 XBUCWTCNQCDBPB-UHFFFAOYSA-N 432.408 2.150 10 20 IECD CCOC(=O)N1CCC(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 759221536 BBNOBKUWMZAQTP-UHFFFAOYSA-N 435.521 2.230 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc(OC)c1OC 759402686 AYCFJCKOEPGJDY-UHFFFAOYSA-N 449.454 2.069 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC(C)C)cc3)C2=O)cc1 759933862 RKMPDXUZZRWJOE-QHCPKHFHSA-N 440.500 2.417 10 20 IECD CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 765257635 ZJVCYCNABIHSLB-LPHOPBHVSA-N 430.574 2.147 10 20 IECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NCc1cccc(Br)c1O 765754192 SDASJPLPTSOMMN-HXUWFJFHSA-N 444.285 2.164 10 20 IECD C[C@H]1[C@@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 771395036 JQTMQNWNZJTNAK-UONOGXRCSA-N 448.501 2.266 10 20 IECD CC(=O)N1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C(C)(C)C1 775505598 UWPKCMYQDMUAEH-UHFFFAOYSA-N 435.436 2.453 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N(CCO)C1CCC1 784700801 YJZXAPGDCNHTHI-UHFFFAOYSA-N 435.458 2.088 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1 786751605 GWWWEGNRDRDZDY-UHFFFAOYSA-N 431.558 2.211 10 20 IECD CCOCCCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H](C)C1 788911481 OAQVZUZEMLYCMM-UGKGYDQZSA-N 430.593 2.156 10 20 IECD Cc1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789826290 PIWAUYBAJKEDIG-BETUJISGSA-N 434.537 2.445 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 789867919 JNWYXSULVLMNDK-XUVXKRRUSA-N 429.586 2.320 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3COCCN3C3CCCC3)CC2)cc(OC)c1OC 793816202 SRXJVXFWOVXFME-IBGZPJMESA-N 433.549 2.004 10 20 IECD O=C(N[C@H](CO)CC1CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 794122813 KPUQRVKECNSHHX-HNNXBMFYSA-N 449.485 2.382 10 20 IECD CCOc1ccc(CNc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2OC)c(O)c1 796408195 SVBAABNRANCUJD-UHFFFAOYSA-N 435.546 2.348 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1C 799121967 UDCBAGTXLGPMFI-UHFFFAOYSA-N 431.923 2.310 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 803303734 UIKCQNHEEUCWJP-INIZCTEOSA-N 425.485 2.088 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689407 QLNLYXILIMBLRG-UHFFFAOYSA-N 439.512 2.089 10 20 IECD CNC(=O)CNC(=O)c1cccc(NC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 806526365 WTZCRSLVEIKUIR-UHFFFAOYSA-N 425.272 2.497 10 20 IECD O=C1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2N1 918443257 VAQSHFHISPFNLB-UHFFFAOYSA-N 436.512 2.035 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1Cl 918461814 MUFYHXMSMKJVIN-UHFFFAOYSA-N 444.919 2.386 10 20 IECD O=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968689 TZFKFDFUBBZNSY-UHFFFAOYSA-N 432.524 2.435 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ncccn12)c1cc(O)c(O)c(Cl)c1 1797557686 POPYBCJQRFPOLU-BTTYYORXSA-N 441.875 2.360 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1(O)CCC1 1804282893 GFKQSJVMEHROSX-KXSQSXTESA-N 430.501 2.006 10 20 IECD CN1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1813605585 CNHROUWWAKXXHS-LIRRHRJNSA-N 444.919 2.027 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)C3CC4(CCC4)C3)CC2)CC1)c1cc(O)nc(O)c1 1834988436 SJWLQZCCYBRFDH-UHFFFAOYSA-N 442.560 2.258 10 20 IECD CCCOc1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1844977008 AILYKCNLVBVEHN-UHFFFAOYSA-N 447.582 2.153 10 20 IECD C[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccc(O)cc1 1845184407 YQDUQYDKZUTNPY-QGZVFWFLSA-N 446.507 2.492 10 20 IECD Cc1noc(C)c1CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034004 UHYQBQWNEICMFZ-VMPITWQZSA-N 441.484 2.258 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1COc2ccccc2O1 1848075538 BYHOJNGBRULRKH-DOXZYTNZSA-N 444.871 2.407 10 20 IECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)Nc1ccc(NC(C)=O)cc1 7355661 BORQDFZEIJFNHS-UHFFFAOYSA-N 425.533 2.288 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCn3nnc4ccccc4c3=O)cc2F)C[C@@H](C)O1 108287477 LCDMMCMPPUZCNS-IYBDPMFKSA-N 439.491 2.251 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H]2CN2CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 111192706 SHZABXJAYWNUAX-HXUWFJFHSA-N 444.601 2.484 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc(Br)ccc2F)SC1=S 727178613 YGIRWJSYAQAUFS-YRNVUSSQSA-N 439.353 2.339 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(C)=O)cc3)cc2F)CC1 730391718 SWRPGSLJEVEZBI-UHFFFAOYSA-N 426.492 2.425 10 20 IECD O=C(NCCOC[C@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 731681409 AFDVORJFJMOQDW-HNNXBMFYSA-N 431.455 2.394 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 733895346 SKTCOXRJRXPMQD-KRWDZBQOSA-N 447.557 2.049 10 20 IECD CC[C@@H](C)[C@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734269379 IWUHUOQWYMKMHZ-OXQOHEQNSA-N 430.528 2.149 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCCCSc2nccs2)c1 734358154 ACVAMJCCUMKVOC-UHFFFAOYSA-N 427.573 2.313 10 20 IECD COCCN(Cc1ccccn1)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743363877 WVTRBRDGBDAEBJ-UHFFFAOYSA-N 427.549 2.070 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 747402357 AVSJBWWVIZKRQC-CVDCTZTESA-N 426.561 2.109 10 20 IECD COc1ccc(C(=O)NCCN2CCN(Cc3cc(F)cc(C(C)=O)c3O)CC2)cc1 750826959 ZPCHYSCOSHOCLT-UHFFFAOYSA-N 429.492 2.290 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)n1cccn1 750873973 CDNAPGAUIHZQIM-RXVVDRJESA-N 427.549 2.176 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H]4[C@H](CCCN4C)C3)cc2F)C[C@@H](C)O1 766120986 FNIJAFBJBZOCEP-BAYUQKDNSA-N 432.584 2.472 10 20 IECD Cc1ccn(C)c(=O)c1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774211200 VETKXCBPMHBASU-UHFFFAOYSA-N 434.443 2.019 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)C3CN(C(=O)c4cccc(Cl)c4)C3)CC2)cc1 781521116 KMMTXHUQDBYDPB-UHFFFAOYSA-N 449.960 2.325 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 782052851 IOWFXPMVKFZCSH-OAQYLSRUSA-N 436.622 2.037 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(CCO)[C@H]1CCCc2ccccc21 788318012 CTKWGSNXVLBFEN-QHCPKHFHSA-N 437.540 2.038 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC([C@@H](O)c2ccccc2)CC1 788318783 HIHCCNOKJLJUEV-QHCPKHFHSA-N 437.540 2.112 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 788816141 QBFQWNMUDKABIY-FQEVSTJZSA-N 438.597 2.499 10 20 IECD C[C@H](NC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 788891843 KBXQKTHSRYGGPE-KRWDZBQOSA-N 448.564 2.074 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccccc1F 789799108 IUESFTKJFXUMIL-QGZVFWFLSA-N 447.482 2.391 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C3CCC(CO)CC3)cc2F)C[C@@H](C)O1 789837300 YOYXTTUAPOCXDI-HNXFYBAISA-N 435.540 2.065 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1CC(F)F 789861579 QFFGTECWPCBMOL-KRWDZBQOSA-N 440.560 2.044 10 20 IECD COc1ccc(CNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N2CCOCC2)c(O)c1 792788354 BVUIVHVUOWCMTQ-LJQANCHMSA-N 445.516 2.291 10 20 IECD COC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 803297681 CWENCRVGCGJJBK-QVKFZJNVSA-N 447.482 2.483 10 20 IECD COCC1(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 806507052 GDSTXMAQUDKUFH-UHFFFAOYSA-N 428.512 2.311 10 20 IECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769400 UDQZZSDSQXUTGQ-YJBOKZPZSA-N 425.476 2.401 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 808216941 GENYQYKJAZWWJY-QFIPXVFZSA-N 436.556 2.409 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 918287635 RAVPJZRCMFFPSG-GJZGRUSLSA-N 443.475 2.481 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 918311470 RNCOFMUSMFZTHN-UHFFFAOYSA-N 436.512 2.013 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)S(=O)(=O)c1ccc(F)cc1 918373431 ZHRLBFKOZUDLHT-RDJZCZTQSA-N 447.532 2.006 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C3CCN(CC(F)(F)F)CC3)CC2)cc1 919165173 GFHUWTHWWAQKNL-UHFFFAOYSA-N 443.466 2.161 10 20 IECD CCCS(=O)(=O)NC1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 920872214 PQOIXJDAMABKFU-QGZVFWFLSA-N 438.594 2.088 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1C[C@@H](C)O[C@H](C)C1 921203281 FZLPKWXWGLQKIL-DBQGFPOUSA-N 430.593 2.138 10 20 IECD Cc1nc(F)ccc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779825801 CPRZYVPFIGVMRV-NRFANRHFSA-N 449.866 2.351 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)n1cccc1 1796935664 XLIBPZMEGKDMGL-IZBJGVDFSA-N 433.512 2.480 10 20 IECD Cc1ncsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770899 UBNYLGSEPQKHRW-JJLQDPRZSA-N 437.905 2.033 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1[nH]nc2ccncc12 1804286539 UVBDBNCTTKMLKQ-BPQKRJORSA-N 449.467 2.040 10 20 IECD O=C(CC1CCC1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814122981 FHBROOPUIWMFSM-JXFKEZNVSA-N 446.598 2.138 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ccc1F)CC2)c1cc(O)nc(O)c1 1816727217 HEOINAKAHYWXTA-JTQLQIEISA-N 444.444 2.334 10 20 IECD CC1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827423978 MATDUYRIXUSBFF-HXUWFJFHSA-N 444.576 2.458 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1828767145 IOTAFTYUZWMGKE-GHTZIAJQSA-N 447.532 2.314 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)ccc21 728640840 ZMCYQXRVKHGMHU-SJLPKXTDSA-N 429.517 2.174 10 20 IECD NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN(Cc1ccccc1O)C1CCCC1 731846432 YWPNDWOIGRXSOR-UHFFFAOYSA-N 429.542 2.374 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 732455404 KILZTQYECLHREA-GOSISDBHSA-N 449.596 2.372 10 20 IECD COC(=O)c1cc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1[N+](=O)[O-] 732621340 GUFQQIFZBDBTLP-UHFFFAOYSA-N 429.429 2.118 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 732673313 BPLFBOGVHTVCMV-NSHDSACASA-N 439.456 2.323 10 20 IECD CN(CC(=O)NCc1ccc(N2CCCCC2)cc1)C1=NS(=O)(=O)c2ccccc21 742475463 BEPJXGQHGLUMKO-UHFFFAOYSA-N 426.542 2.374 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc4c(c3)OCCO4)CC2)cc1 742948507 VJJYYOWLDXCPGT-UHFFFAOYSA-N 440.544 2.130 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1 743362844 JYLHHNMMJKAARC-HSZRJFAPSA-N 425.577 2.419 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1 743363959 YRUBLIMIFFNAIK-QGZVFWFLSA-N 443.514 2.001 10 20 IECD Cc1cc([C@@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)o1 745691389 JWZCUPPHLIDZLN-JPYJTQIMSA-N 428.533 2.305 10 20 IECD O=S(=O)(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn([C@@H]2CCOC2)c1 752000420 ZLTNDZNLKFQGGR-GDBMZVCRSA-N 442.488 2.393 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ncn(C2CCCCC2)n1 755192873 QJUVYOOBIXDPIB-UHFFFAOYSA-N 426.521 2.217 10 20 IECD CN1CCC([C@@H]2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)CC1 756683376 OBYQCLBOYNTXAX-NHCUHLMSSA-N 427.593 2.262 10 20 IECD C[C@@H](c1ccccc1)N(CC(=O)N1CCN(CC(=O)N(C)C)CC1)Cc1ccccc1O 757276019 MKLAXPIQTHVVSN-FQEVSTJZSA-N 438.572 2.188 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 760743376 DWEAUMMYPQDNRS-YLJYHZDGSA-N 448.564 2.347 10 20 IECD Cc1c(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)cnn1C 760808929 VQKUILMGIBGLPD-UHFFFAOYSA-N 445.457 2.073 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc1 765999437 AZMYTMVDEQLKRO-SFHVURJKSA-N 444.498 2.027 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 774865827 UYBRAWDUIXFASY-NRFANRHFSA-N 443.519 2.460 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3COC4(CCOCC4)O3)cc2F)C[C@@H](C)O1 776897166 SSUNPCWXJXFPAZ-JZXOWHBKSA-N 437.512 2.161 10 20 IECD COC(=O)C1(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCOCC1 781796552 LUOHXBKIFIXQCQ-HZPDHXFCSA-N 437.512 2.208 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnn(C)c3C(F)(F)F)CC2)cc1 782107495 KCXJBJAVOXGOMH-UHFFFAOYSA-N 425.411 2.171 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1C 783315389 BFFHKRUSNOQINF-UHFFFAOYSA-N 446.573 2.393 10 20 IECD CCN(CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 785530138 MSJRPSUZTFHATK-UHFFFAOYSA-N 442.535 2.311 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785603855 WBQKWCYDSIBSGD-UHFFFAOYSA-N 446.433 2.281 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(S(=O)(=O)C(C)C)c3)cc2)CC1 786263480 XXFPGOHQQQSSFK-UHFFFAOYSA-N 443.569 2.467 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3Cl)cc2)C1 786681256 HLORNVKFHOAXIR-SFHVURJKSA-N 442.947 2.017 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cc([C@@H]4CCCO4)nn3C)CC2)cc1 788720841 RVIMZXVUFVPTGI-FQEVSTJZSA-N 428.537 2.224 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)cc1F 790318930 GVZHBTHIBGYGIL-UHFFFAOYSA-N 437.537 2.437 10 20 IECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306728 WXZJCHZFYADTPQ-SIKLNZKXSA-N 430.593 2.471 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(N2CCCCC2)CC1)c1ccc(N2CCOCC2)cc1 803307243 ZDCOFRSBUIFBDC-IBGZPJMESA-N 428.577 2.177 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C2CCN(C(=O)OC)CC2)cc1F 804852125 ZVHWVQHTBDOQNY-OAHLLOKOSA-N 436.528 2.271 10 20 IECD CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807195240 AJTBQOUQFZQAKL-PILAGYSTSA-N 437.487 2.303 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H](C)[C@@H](C)O1 807771174 SFZRVEFMTFFXKT-KLHDSHLOSA-N 425.476 2.397 10 20 IECD C[C@H](NCCS(=O)(=O)N(C)C)c1cc(Br)cc(Br)c1O 810261189 BZLZSJNHKOSCBU-QMMMGPOBSA-N 430.162 2.459 10 20 IECD NC(=O)[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1 841885456 AQVLTZPKPFHKHV-SFHVURJKSA-N 429.388 2.327 10 20 IECD CS(=O)(=O)NC1(CNC(=O)NCc2ccc(N3CCSCC3)cc2)CCCCC1 916253220 WEMURIKIGHGBPP-UHFFFAOYSA-N 440.635 2.291 10 20 IECD C[C@H](NC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2)c1ccc(N2CCOCC2)cc1 1318659976 IQZSZQZJPZZYIR-HNNXBMFYSA-N 429.542 2.150 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2 1785509133 SJNCPGPVINFZID-FNLFUECCSA-N 448.472 2.161 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc(Cl)ncn1 1804288683 ALWWWQCQPGDQEV-LJWNITHASA-N 444.875 2.212 10 20 IECD Cc1onc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1C 1807994421 WUOCXNPNBHMNHN-YWZLYKJASA-N 437.456 2.126 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ccn1 1807996089 XSYMCLPHFWNVNO-DYESRHJHSA-N 433.468 2.225 10 20 IECD Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721521 MNAMZTXTBOJYJL-CYBMUJFWSA-N 425.470 2.192 10 20 IECD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)nc1 1817845824 YIHDJGWBVYQEHV-INIZCTEOSA-N 438.444 2.239 10 20 IECD COc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1825670747 CEEBRZUZQRZVIA-GOSISDBHSA-N 440.500 2.444 10 20 IECD CC(C)C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837631037 IMUYYVOZENDOIU-GQCTYLIASA-N 432.517 2.471 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCN1C(=O)OCC(F)(F)F 727789082 WFDBCVJXGKUQMM-MRXNPFEDSA-N 433.402 2.442 10 20 IECD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c1 742655125 XQSMAQYFBVURJF-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749556145 XECIKFAQXJIOHM-RQZFFVEVSA-N 442.585 2.467 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN(C)CC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)c1 749835948 LUDJEACZRGHYRL-LJQANCHMSA-N 445.585 2.129 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3cc(OC)c(OC)cc3OC)CC2)cc1F 753857474 MJBZGKJZRGMVCY-UHFFFAOYSA-N 447.507 2.299 10 20 IECD COc1ccc(N2CCN(C(=O)[C@](C)(O)CN3C(=O)C(C)(C)c4ccccc43)CC2)cc1 760053997 RIRZERBEZZUVMZ-RUZDIDTESA-N 437.540 2.419 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cn1C 760511484 XQPKGACIEWAWJM-UHFFFAOYSA-N 435.911 2.028 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)cn1C 760603843 ZOTHPXMEIYUVAA-UHFFFAOYSA-N 438.487 2.241 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(N4CCCCC4=O)CC3)cc2)C1 764356579 HVASUNOLPMXGDI-LJQANCHMSA-N 441.576 2.075 10 20 IECD O=C(NOCC(F)(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 768290394 FWAHASVSXJTUAF-UHFFFAOYSA-N 435.336 2.325 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 769164827 VYNZJSNNHZMBDE-PKTZIBPZSA-N 430.593 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)CN3CCCCC3)CC2)cc1 778248276 UTJKGPJSESZKLF-JPMGXVIASA-N 428.577 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](CCO)c3ccccc3)CC2)cc1 778321789 VRVFNBIEZXBIRR-RJRNSMGGSA-N 437.540 2.182 10 20 IECD Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 781368732 UEWZMLVTFQZPOG-AZUAARDMSA-N 440.548 2.011 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@](OC)(C(F)(F)F)C3)CC2)cc1 781978794 SMCOXTRHRXQGKO-QUCCMNQESA-N 431.499 2.221 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CCCCS3(=O)=O)cc2F)C[C@@H](C)O1 784222698 NJSXAWNLDYUONY-HLLBOEOZSA-N 427.542 2.206 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1C(N)=O 784765987 FPJQKLIBJOEWBK-KRWDZBQOSA-N 444.919 2.172 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)CN1CCN(C)CC1 790182410 BWROQUYGQQOLRJ-FQEVSTJZSA-N 443.636 2.071 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)NC)c1C 802609476 CNYKYMRBCYTZKJ-UHFFFAOYSA-N 433.530 2.376 10 20 IECD C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686891 JMHYQMWSJFMQBM-AEFFLSMTSA-N 444.576 2.447 10 20 IECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCCCSc3nccs3)CC2)cc1 804345875 NZWPQKOBJXUMTJ-UHFFFAOYSA-N 446.598 2.471 10 20 IECD C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 804969369 PSZNHRMGTHBNTP-JRBPQWBISA-N 434.556 2.444 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807286911 FEEOPEFQERXGIY-KRWDZBQOSA-N 428.533 2.147 10 20 IECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768228 FXFMMZDLIAHXHM-OWCLPIDISA-N 425.476 2.399 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 808588344 DGUNPHHQMLKJJP-HXUWFJFHSA-N 438.915 2.254 10 20 IECD O=C(Nc1ccc2c(c1)C(=O)OC2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808939496 IPATWFATZWUOKM-KRWDZBQOSA-N 443.887 2.435 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2cc(C)nn2C)C1 809871796 MFXSMXOEOQPWHI-LJQANCHMSA-N 427.549 2.348 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H]3CCCc4ccc(S(N)(=O)=O)cc43)cc2)C1 810210947 IEXXEVBBPQDLSH-PGRDOPGGSA-N 442.585 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H](NC(C)=O)c3cccs3)CC2)cc1 829377828 XHOMRHAFTACGLT-LJQANCHMSA-N 445.541 2.216 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1C(=O)N1CCOCC1 916677527 TYVNFORTQKTGJO-UHFFFAOYSA-N 442.491 2.456 10 20 IECD COCC(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918032004 DFWDCHBZYYGZKX-KRWDZBQOSA-N 439.516 2.295 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@H](C)O1 918246874 UASNGKJDHJNSAF-IRXDYDNUSA-N 438.528 2.257 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CSCCN3CCOCC3)cc2F)C[C@@H](C)O1 1319579574 UMMAKLRKTKDIHD-IAGOWNOFSA-N 425.570 2.121 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNS(=O)(=O)c2ccccc2)cc1 1326357585 ZQRDPAQUMJMGQF-FQEVSTJZSA-N 431.558 2.239 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)cc([N+](=O)[O-])c1 1796604870 SQEHALZLFWJPIJ-QDMKHBRRSA-N 430.392 2.106 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccoc1Cl 1804335809 HLMHWJBQUYXVBS-JGPRNRPPSA-N 427.935 2.045 10 20 IECD C/C=C/C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808470905 ZVHHUYLAUMCENW-XIBVMUEHSA-N 431.496 2.456 10 20 IECD CN1CC(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1813605584 CNHROUWWAKXXHS-KUHUBIRLSA-N 444.919 2.027 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(Br)cs2)C1 1843445557 BQBWWKFKTJWKAY-UHFFFAOYSA-N 438.303 2.448 10 20 IECD CCOc1cnc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cn1 1845500770 NDZVQNVKUJONIA-UHFFFAOYSA-N 432.864 2.071 10 20 IECD CC(C)N[C@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)C(C)C 1847038766 IBXHUVOPJSHVFP-XSBJJCPUSA-N 431.533 2.043 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1S 1847268744 PKKPHCXAXNXTGN-PGXISHIXSA-N 427.482 2.016 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCCNC(=O)c3ccsc3)CC2)cc1 25124238 XIZMYPPMOBIFII-UHFFFAOYSA-N 445.541 2.159 10 20 IECD CC1CCC(NS(=O)(=O)CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 728068506 PVBBNBZCEDMONX-UHFFFAOYSA-N 437.606 2.010 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H]1CN2CCC[C@@H]2CO1 729497335 SEDJJCUYZKFKOH-QZTJIDSGSA-N 442.482 2.204 10 20 IECD CNS(=O)(=O)[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 733311166 NCGQCLIPRZCCHG-GOSISDBHSA-N 447.557 2.062 10 20 IECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(c3cccc(OC)c3)C2=O)cc1 739922903 PXEHDEZPRQPWMY-QFIPXVFZSA-N 426.473 2.029 10 20 IECD COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1 740775656 WBAFNFOYRHTWDT-UHFFFAOYSA-N 448.541 2.225 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C)c1 743557265 PLOTWFKZMCURLW-INIZCTEOSA-N 438.511 2.236 10 20 IECD COCCN(Cc1nnc2n(C)c(=O)c3sccc3n12)c1ccc(OC)c(OC)c1 746478368 YREQKEIFEPCMMB-UHFFFAOYSA-N 429.502 2.313 10 20 IECD Cc1ccc(C(=O)O[C@@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)c(O)c1O 750618721 LBIFLYZATIJKOF-VIFPVBQESA-N 426.347 2.124 10 20 IECD COC(=O)C[C@@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 752335318 DOGRBMHHEFXVRB-GOEBONIOSA-N 436.464 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)NCC(=O)N3CCc4ccccc4C3)CC2)cc1F 753894901 YTBPGUFSOBNRHZ-UHFFFAOYSA-N 426.492 2.251 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cncc(Br)c1 757163522 KYCGJBCHTIKBCZ-UHFFFAOYSA-N 437.269 2.075 10 20 IECD CN(C)S(=O)(=O)c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 761125782 XYSIVHUQTUGXJR-UHFFFAOYSA-N 437.905 2.260 10 20 IECD C[C@@H](CCS(C)(=O)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 762013984 XJNMFZZTAUSUDA-ZDUSSCGKSA-N 437.484 2.164 10 20 IECD NC(=O)[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(Br)c1 763376409 LGGALIPWOZAKTQ-APWZRJJASA-N 445.361 2.467 10 20 IECD C[C@H](NC(=O)c1ccccc1S(=O)(=O)CCN(C)C)c1ccc(N2CCOCC2)cc1 767327654 OOVNAEJUKUKELH-SFHVURJKSA-N 445.585 2.350 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(O)(c4ccccc4)CC3)CC2)cc1 767858330 DMIUTMKPXWYRPW-HSZRJFAPSA-N 425.573 2.162 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1C(N)=O 768016399 LOCXMWRLBUGMSE-UHFFFAOYSA-N 432.546 2.125 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccnc(O)c3Br)cc2)C1 772150241 SMGPDFOVQLQHIE-HNNXBMFYSA-N 447.333 2.110 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(Cl)cc3)cc2)C1 774647708 FEQSPMKOMUNRNV-SFHVURJKSA-N 442.947 2.017 10 20 IECD C[C@@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(N(C)C)cc1 776247880 XGZUCHVPIXRFBO-DNVCBOLYSA-N 426.517 2.437 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(F)c(NS(C)(=O)=O)c1 777828182 JCNIZABIFVHSNL-UHFFFAOYSA-N 444.868 2.372 10 20 IECD O=C(CN1CCOC[C@H]1[C@@H]1CCCC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 784356957 WRFWARXOVKBZOW-FPOVZHCZSA-N 432.476 2.471 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCCC[C@@H](SC)C3)CC2)cc1 785527663 MRTUFSMXSTWIBC-OAQYLSRUSA-N 448.633 2.068 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(F)CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 786262841 QJVVKQQNIZKCAD-HSZRJFAPSA-N 448.539 2.320 10 20 IECD CCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789826216 OZUBZIYBWDBCGK-IRXDYDNUSA-N 428.508 2.499 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789828774 YLITVNXDSNMEQP-JENIJYKNSA-N 434.556 2.045 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)N1CCCCC1 793714306 DBRPYQKYCNHLNL-CQSZACIVSA-N 426.355 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](n4cc(Cl)cn4)C3)CC2)cc1 794246923 NTINITGRVPWZAP-RURPWVQCSA-N 443.935 2.224 10 20 IECD C[C@H]1C[C@@H](N2CCOCC2)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796378457 QQQQQEKESKELMZ-FUHWJXTLSA-N 433.508 2.196 10 20 IECD COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 797619985 DTBCJQLEHOVOKL-AWEZNQCLSA-N 429.473 2.332 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687785 PPIHSKSTPRLONX-LPHOPBHVSA-N 444.576 2.447 10 20 IECD CCN(C(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCN(c2ccccc2)C1=O 803688945 GLBYFJAAZWIRKR-JOCHJYFZSA-N 434.540 2.339 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(N4CCOCC4)CC3)cc2Cl)C1 807953831 YUMLESYQVYGUKQ-QGZVFWFLSA-N 448.995 2.174 10 20 IECD Cc1cccc([C@@H](CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)NC(N)=O)c1 917834953 VECRAIXTMCDAEX-TZIWHRDSSA-N 437.544 2.113 10 20 IECD COc1ccccc1C(=O)NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918703473 ZSYJNGFVWZCWBT-HZPDHXFCSA-N 429.492 2.494 10 20 IECD CNC(=O)c1cccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1116276431 NYGPSLYLOMMZDD-UHFFFAOYSA-N 443.415 2.012 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c(Cl)c1 1791960362 ZWFBITMFKAJWIC-OWQGQXMQSA-N 445.903 2.362 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2c1OCO2)c1cc(O)c(O)c(Cl)c1 1799159815 HRUWFECUCKNZIX-CLLJXQQHSA-N 445.859 2.441 10 20 IECD Cc1ccn(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799474453 GWPCPMDORVSNKY-GGPHIMKMSA-N 433.512 2.378 10 20 IECD C[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1802082252 BHSSMMPANVCUOG-BZBAAFQNSA-N 444.528 2.233 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cccnc3S)C2)CC1 1804868133 KGXSRDXVZXRPRQ-UHFFFAOYSA-N 428.514 2.335 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccncc1F 1808883644 JVCCNRNZISQJPL-JLTOFOAXSA-N 437.431 2.055 10 20 IECD Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1 1815976455 JYFWBGDAICBXMV-QGZVFWFLSA-N 436.472 2.468 10 20 IECD O=C(CCN1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816972248 ZSWZSCRJZQCGMT-KRWDZBQOSA-N 442.520 2.398 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccccn2)CC1 1825812827 LHIJKVFNWZSAGU-QGZVFWFLSA-N 446.598 2.175 10 20 IECD O=C([C@H](O)c1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424782 ODAHTAZPYJOLHD-OXQOHEQNSA-N 429.473 2.053 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)on1 1844812353 RHDLBOAUGVFQDV-UHFFFAOYSA-N 435.484 2.408 10 20 IECD O=C(c1c[nH]c2cnccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037242 GUOJJBVADFKIRM-HWKANZROSA-N 434.452 2.210 10 20 IECD CCC1(CC)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 108287577 GKIWZBPPFNMQGW-GASCZTMLSA-N 434.512 2.166 10 20 IECD COCCNC(=O)CN1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 728201788 WFMASYUEWVLLKI-UHFFFAOYSA-N 446.979 2.197 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCn3c(=O)oc4ccccc43)cc2F)CC1 730128301 XQLONCGDMJUEJN-UHFFFAOYSA-N 441.507 2.375 10 20 IECD O=C(COC(=O)c1cc(O)cs1)NCc1ccccc1S(=O)(=O)N1CCCCC1 732354336 SCNXHRWKOQQMKK-UHFFFAOYSA-N 438.527 2.102 10 20 IECD Cc1cc(C(=O)COC(=O)CN(C)C(=O)C2CC2)c(C)n1-c1ccc2c(c1)OCCO2 733513170 ARCMRGZPAMMWEE-UHFFFAOYSA-N 426.469 2.460 10 20 IECD COC(=O)[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccn1 744372581 JMEHZNXXLYZGID-GOSISDBHSA-N 445.387 2.409 10 20 IECD CC(C)(CCO)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745736702 JMBFIBONCHSQQD-UHFFFAOYSA-N 430.528 2.150 10 20 IECD CC(=O)N1CCN(c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2[N+](=O)[O-])CC1 746805337 UBJBFNHTISSDJO-UHFFFAOYSA-N 443.479 2.398 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)n1cccn1 750873974 CDNAPGAUIHZQIM-WIYYLYMNSA-N 427.549 2.176 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1[N+](=O)[O-] 751235700 BOPMMSXDLZSOOJ-UHFFFAOYSA-N 435.502 2.291 10 20 IECD COC(=O)C[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 752955854 HQDOBSNVDSZFEK-QGZVFWFLSA-N 427.448 2.230 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](OCC(F)(F)F)C3)CC2)cc1 754043140 PVXGDTAVVYGRNV-AZUAARDMSA-N 431.499 2.221 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)c1 756327950 XACQTCMSUCTOEZ-LJQANCHMSA-N 447.557 2.262 10 20 IECD CN(CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1)c1ccc2c(c1)OCO2 756655451 UKGFBHOSPHVSFP-UHFFFAOYSA-N 425.894 2.394 10 20 IECD COC(=O)[C@H](Cc1ccc(Cl)cc1)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 759498739 JEKMPJNCZZEXFJ-INIZCTEOSA-N 427.862 2.358 10 20 IECD COC(=O)[C@@H](C)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 761095688 ASQUQSVUMTVMTJ-SZJBZFAYSA-N 443.344 2.328 10 20 IECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765904774 VMZZXSUICRZTKP-RUZDIDTESA-N 425.304 2.288 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)NC(=O)C(C)(C)C)n3)CC2)cc1 771065337 FBQQDMWWIDBPQI-HNNXBMFYSA-N 429.521 2.193 10 20 IECD CCc1nn(C)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 771173409 SZEAZLLQXDTBKL-UHFFFAOYSA-N 444.513 2.077 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)CCOC)cc1 784025432 DXMSIBPWBXIXQF-UHFFFAOYSA-N 434.514 2.190 10 20 IECD CN(C[C@H](O)CN1CCOCC1)C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 784971313 MJBSNWKVWFLXDP-FQEVSTJZSA-N 425.489 2.192 10 20 IECD COc1cc(OC)cc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785432630 GBKKDMYXLWYWRS-GOSISDBHSA-N 440.544 2.029 10 20 IECD Cc1ccc(OCCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 787924590 HYPQWRRZTQPUOO-UHFFFAOYSA-N 425.529 2.423 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789825487 MHACKCQWJYQGAL-ZIAGYGMSSA-N 432.496 2.019 10 20 IECD CN(Cc1ccoc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950256 MXJWNDCKRFYKSZ-UHFFFAOYSA-N 425.407 2.410 10 20 IECD CC(C)(CCCO)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951173 SXJBEXFCQSEBTR-UHFFFAOYSA-N 445.482 2.073 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1nc(Br)cs1 792248791 MESXWFMGTIMQEC-UHFFFAOYSA-N 430.349 2.070 10 20 IECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793806701 GJGYBEQHDKGVPG-HXUWFJFHSA-N 449.511 2.105 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)Cc3ccccc3)cc2F)C[C@@H](C)O1 796270862 WIIKJTVRSINXME-JKSBSHDWSA-N 444.503 2.202 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803297831 HQWJRBVSTWKFSH-TZIWHRDSSA-N 436.556 2.486 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H](C)N1CCOCC1 803677054 DVRIKNKUXFSYRY-RTBURBONSA-N 430.593 2.297 10 20 IECD COC(=O)N1CCC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 804010629 SGMCJACBCIZQKN-SFHVURJKSA-N 442.516 2.221 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@H](O)c3ccc(C)cc3)CC2)cc1 804467192 ATCCYYLQIDRZSV-URAWOPRGSA-N 437.540 2.447 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCOc3ccccc3OC)CC2)cc1 804628929 WWMSCMBXFHNOKW-UHFFFAOYSA-N 441.528 2.328 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 807469294 GNGQSDJXHDJQDY-XXBNENTESA-N 438.572 2.117 10 20 IECD CCOC(=O)C[C@H](C(F)(F)F)S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809388882 GSNZQKLECJGQEH-MRXNPFEDSA-N 438.468 2.169 10 20 IECD CS(=O)(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 809392639 ZYPREJIQOYVNOJ-UHFFFAOYSA-N 444.962 2.059 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnn([C@@H]4CCOC4)c3)ccc21 816463474 JBYGYRCOCLSWFJ-QGZVFWFLSA-N 446.529 2.181 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Nc3cccc(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 917998585 LPXIZBPLVIEMAI-ZIAGYGMSSA-N 436.509 2.408 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918295547 QHJXFICZGCOMKY-INIZCTEOSA-N 430.432 2.464 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 918372191 WCZLZYBLEVBYRB-FQEVSTJZSA-N 445.541 2.233 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)N3CCC[C@@H](NC(C)=O)C3)c2C)cc1 918895354 IEJGVZBWBVKELE-GOSISDBHSA-N 427.501 2.387 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(F)cc1F 920925351 JWYYNQPJOQCKKV-CYBMUJFWSA-N 447.438 2.404 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc(Br)c1C=O 1318859266 MAAXDMDGYDXYLJ-AWEZNQCLSA-N 447.333 2.232 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccc2)c1COC 1324137052 WFZWZIRWHPFMLG-SFHVURJKSA-N 439.468 2.334 10 20 IECD Cc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)s1 1784431637 LUIIKOSYRYHFIS-FNEOHHHZSA-N 429.498 2.020 10 20 IECD COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)cc1 1822217783 PFZQGPZNDNBCHL-CYBMUJFWSA-N 440.481 2.498 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncc[nH]1)CC2)c1cc(O)c(O)c(Cl)c1 1823707885 FSFIBJHJMXNRHR-SECBINFHSA-N 433.877 2.470 10 20 IECD Cn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c1 1825732985 ZRTPFQWIOROZQJ-QGZVFWFLSA-N 448.614 2.119 10 20 IECD CC[C@@H](NC(N)=O)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845398438 NGZGAZLXIUQKRT-HXUWFJFHSA-N 437.544 2.358 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1-n1nnnc1C 726701487 PKNITABJBNHEEK-UHFFFAOYSA-N 441.467 2.277 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3[C@H](O)C(F)(F)F)cc2F)C[C@@H](C)O1 732201862 PSJSCMPORVXERD-JSOPPFHZSA-N 447.473 2.443 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)c(OC)cc3C)CC2)cc1 732923136 PYEXNZVFAFGTQJ-UHFFFAOYSA-N 433.574 2.421 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)OCCOCCO 740212727 SPKVGNNCZCXNEZ-UKTHLTGXSA-N 446.344 2.202 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc4c(c3)OCCO4)CC2)cc1 742948329 ROPBPHNPOBHQLX-UHFFFAOYSA-N 426.517 2.088 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](Cc4cnn(C)c4)C3)CC2)cc1 746743362 WEAYGLUFQJSSMV-HXUWFJFHSA-N 440.592 2.215 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 749730664 ATDUVGWAHPJYKA-OAHLLOKOSA-N 434.543 2.498 10 20 IECD CN(C)C[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 752484669 WJWSPAQCLCRYLK-BLSFAOBESA-N 427.617 2.158 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)cc1C 765053053 RUBBHHKBMKCVQG-UHFFFAOYSA-N 427.504 2.221 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1F 765903886 PEWPZPDKMWCSOK-UHFFFAOYSA-N 425.210 2.335 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 766268803 GORBBZMCVPNEHJ-QUCCMNQESA-N 436.574 2.033 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 771768070 OHTIFEXTPGFKMV-UHFFFAOYSA-N 435.532 2.434 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 773744181 OVISEBHTQVUOIG-AWEZNQCLSA-N 436.505 2.385 10 20 IECD C[C@H](NC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccc(N(C)C)cc1 773993552 HVXYMDQPFQRNLC-INIZCTEOSA-N 447.557 2.460 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(Cl)cc3)cc2)C1 774647706 FEQSPMKOMUNRNV-GOSISDBHSA-N 442.947 2.017 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 777826483 OFCYZMSLMCPUPC-HNNXBMFYSA-N 444.871 2.066 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(Cl)ccc3-n3cnnn3)c2)CC1 781271332 KPKRIAYRCPFNTP-UHFFFAOYSA-N 425.880 2.237 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCc4occc43)CC2)cc1 785528223 OQQUOVHUOVPUTA-OAQYLSRUSA-N 440.544 2.110 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CC23CCOCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 786445954 VWDHCTAIZWNIOV-IBGZPJMESA-N 446.525 2.284 10 20 IECD Cc1cccc(=O)n1C[C@](C)(O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 792123255 HKYQBZRRLCSQCP-QFIPXVFZSA-N 435.471 2.294 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(OC)c(C)cc3C)CC2)cc1 796745302 JHFAMZRKLMPBAD-UHFFFAOYSA-N 440.544 2.198 10 20 IECD Cn1ncc2c1C[C@H](C(=O)OCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 798767061 YIJQWCHXCRBGRS-CQSZACIVSA-N 443.459 2.482 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688144 VXHFDMWAWWCMCE-QFBILLFUSA-N 444.576 2.447 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@H]3[C@@H]5OC)CC2)cc1 806332832 BGALOTRPHNRRMY-QUUXARLESA-N 428.577 2.272 10 20 IECD CCN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1)CC(F)(F)F 807101122 QGXOAFATPDZJLW-MRXNPFEDSA-N 428.499 2.410 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(N(C)C)cc1 808568418 KGDIMINVFMXXRU-UGSOOPFHSA-N 430.455 2.130 10 20 IECD CCN(C(=O)[C@@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 914613212 KZJOZDZGYOYBGK-IAGOWNOFSA-N 433.530 2.070 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)c4ccc(C)cc4)CC3)CC2)cc1 917108868 XIMVUNQSSPNBPA-UHFFFAOYSA-N 436.556 2.110 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1CCC(NC(=O)OC(C)(C)C)CC1 917126765 LWHOLIJXPVFYMF-UHFFFAOYSA-N 446.592 2.471 10 20 IECD CN(C)C(=O)COc1cccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918013650 YFNMPELGFNQEGF-UHFFFAOYSA-N 440.544 2.332 10 20 IECD C[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1785509918 CKUVUTKKXPHTNL-JBTZNLARSA-N 444.528 2.473 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245034 NAMSNWOXNSPZJR-JDFRZJQESA-N 449.866 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccccc1)C1=NN(c2ccccc2)C(=O)C1 1795584271 UGQOBOPUAHNMCP-FNLKRUPLSA-N 446.507 2.497 10 20 IECD O=C1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)=Cc2ccccc2N1 1796601426 HMIARSAINAKJFT-BCDXTJNWSA-N 448.479 2.170 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(F)(F)C(=O)O)c1cc(O)c(O)c(Cl)c1 1796795400 WEINLKSQSCRAML-JGPRNRPPSA-N 432.807 2.113 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CCCCC1 1797794905 QWSFUIDLAYBOFP-BTTYYORXSA-N 427.567 2.157 10 20 IECD Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805496117 QKAQCHRHVSCADS-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CC(C)n1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n1 1810546919 MROQCWPCDIIIRQ-UHFFFAOYSA-N 427.505 2.429 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnoc1C1CC1)CC2)c1cc(O)nc(O)c1 1816722814 YNPWMVUCWWWJEP-NSHDSACASA-N 441.469 2.354 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2)CC1 1825833339 IKUBCYDNEQDZGG-QGZVFWFLSA-N 446.598 2.175 10 20 IECD O=C([C@@H](O)c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426170 NKKDWCGVXCMYLX-KNQAVFIVSA-N 439.512 2.460 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1827428492 RAQYIRFSRSNUBX-WIYYLYMNSA-N 447.532 2.314 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCCc2ccncc2)C1 1842074038 VMFJGFITNPIQRH-SOFGYWHQSA-N 437.496 2.438 10 20 IECD O=C(CSc1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249019 OKQGWUVGQPFSCR-UHFFFAOYSA-N 435.452 2.380 10 20 IECD CC(C)(Cc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847507129 YSZWJOPWBZKKFM-IRXDYDNUSA-N 445.610 2.317 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3cccnc3N3CCN(C)CC3)CC2)cc1 110460979 WGPMSYATHLTOKJ-UHFFFAOYSA-N 438.576 2.310 10 20 IECD CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727990999 DGXOQQQAOSDJNY-DWDXXMRJSA-N 444.601 2.262 10 20 IECD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 728207143 GMDWRKKSISYDSL-CQSZACIVSA-N 439.491 2.098 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@@H](C)C(=O)N3CCN(C(C)=O)CC3)ccc21 728637697 DVSOKOYJXPJNIK-KRWDZBQOSA-N 429.517 2.141 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(C(=O)N(C)CC)c3)nc12 729125670 AMCRITPDRKSZSC-UHFFFAOYSA-N 426.429 2.061 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)cc2F)C[C@@H](C)O1 734270543 UCVLMRUUSGRZRH-NSHGMRRFSA-N 447.599 2.407 10 20 IECD CCN(CC(=O)N1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)c1ccc(OC)cc1 746109042 IEOCXSWVJZEURO-UHFFFAOYSA-N 447.557 2.063 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n(C2CCOCC2)n1 746364827 USJWNNLEKZPSBR-UHFFFAOYSA-N 443.573 2.351 10 20 IECD Cc1c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 752154046 IFMDOUIEUOSKJY-OAHLLOKOSA-N 449.485 2.078 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)CC2)cc1 752287559 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IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cn[nH]c2)CC1 1827799067 JGBBMYYNCMPDEC-NRFANRHFSA-N 448.527 2.436 10 20 IECD CCN1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1832950580 PVZZEFKKJMSMNR-HXUWFJFHSA-N 444.576 2.458 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2noc3ccccc23)C1 1843031871 FSBDESPNRFSPLK-VQHVLOKHSA-N 449.463 2.404 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)ncc1[N+](=O)[O-] 1843517828 FWWAFONKNDBWRO-UHFFFAOYSA-N 446.847 2.494 10 20 IECD CC(C)n1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n1 1847038996 WYCJJVCEKKEPAM-FNORWQNLSA-N 426.473 2.111 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccnc3N3CCOCC3)cc2F)CC1 303321168 RFUMGAYMRVGZPF-UHFFFAOYSA-N 427.524 2.129 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3c[nH]c4ccccc4c3=O)CC2)cc1 726563825 SSRUUEICVGIFHX-UHFFFAOYSA-N 434.496 2.052 10 20 IECD CCOC(=O)C1=C(CN2CCN(c3ccc(OC)cc3)CC2)NC(=O)N[C@H]1c1ccco1 727110376 LRSVTPXYOYJBRM-NRFANRHFSA-N 440.500 2.282 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc2)CC1 729062496 CGOILIKVWOEJER-INIZCTEOSA-N 426.517 2.359 10 20 IECD C[C@@H](NC(=O)Nc1ccc(CNS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 735577025 NFXGZMXCQFBJSV-MRXNPFEDSA-N 432.546 2.455 10 20 IECD CCOC(=O)C1=C(CN2CCOc3cc(N(C)C)ccc32)NC(=O)N[C@H]1c1ccco1 746492790 MBHUDUFWGLYFLV-FQEVSTJZSA-N 426.473 2.416 10 20 IECD CCN(CC)c1ccc(CNC(=O)NC[C@H](O)CS(=O)(=O)c2cccs2)cc1 752148398 GRZJOYXUJUMSSQ-KRWDZBQOSA-N 425.576 2.228 10 20 IECD O=C(c1cnc2c(c1)c(O)nc(=O)n2C1CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 752152381 XKKFQRNYDKMPTN-QGZVFWFLSA-N 436.468 2.359 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)CC2)cc1 758992685 MQDKFSSROSPBNJ-UHFFFAOYSA-N 438.463 2.139 10 20 IECD COc1ccsc1S(=O)(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759100001 YJUVFPGVAUKJTF-UHFFFAOYSA-N 428.532 2.293 10 20 IECD COc1cc(N2CCN(C(=O)NCc3csc(N(C)C)n3)CC2)cc(OC)c1OC 759273170 LJMIIKFGVUBYAW-UHFFFAOYSA-N 435.550 2.267 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(C)cc3F)CC2)cc(OC)c1OC 759410271 QWHQFQUNZFRFLD-UHFFFAOYSA-N 431.464 2.447 10 20 IECD Cc1onc(-c2ccncc2)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 764939113 LJHYMONOJXTHAH-UHFFFAOYSA-N 426.498 2.210 10 20 IECD C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 765896467 IYQKFXNWILIEGV-MRXNPFEDSA-N 430.014 2.336 10 20 IECD Cc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1-c1ccc(O)nn1 768912132 NANLUUNWHIMYHF-INIZCTEOSA-N 442.907 2.430 10 20 IECD Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 769893877 AMCVUQQOEZIKAM-KRWDZBQOSA-N 428.470 2.395 10 20 IECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)c1 771418845 STRQNAHWCHEVCD-HXUWFJFHSA-N 435.839 2.277 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 775046065 WRPYDFBKKKFBLY-KNQAVFIVSA-N 436.556 2.091 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4ccc(C)cc4[nH]3)CC2)cc1 778292877 AHINSVQEWICJRG-KTKRTIGZSA-N 433.512 2.401 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(CCC(=O)O)cc3)c2)CC1 780408046 TXSWKFUKHPHONL-UHFFFAOYSA-N 431.514 2.173 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 784702997 MYTQMXVDDGUJEC-UHFFFAOYSA-N 444.557 2.086 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1 785298897 XOCRTOFFZZSGEI-GFCCVEGCSA-N 429.864 2.077 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@H](C)C4(CCC4)C3)CC2)cc1 785529066 UUCVIHYJPGQVJC-FQEVSTJZSA-N 442.604 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@@H]3c3ncon3)CC2)cc1 787262338 QECZFRZUDBSLPA-JPMGXVIASA-N 439.516 2.427 10 20 IECD C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 787904453 SMIICAQINUJAPK-UXHICEINSA-N 430.593 2.471 10 20 IECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccnn1C 788112913 YARORSIOONLULY-UYAOXDASSA-N 426.565 2.361 10 20 IECD COCc1ccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789813254 QZQFOLPGXIJZAI-HXUWFJFHSA-N 445.491 2.382 10 20 IECD COc1ccccc1CONC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789827367 SFEVLIVRXFARAZ-HZPDHXFCSA-N 445.491 2.312 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833197 FJXRLLBNIDTCKD-UHFFFAOYSA-N 442.535 2.094 10 20 IECD C[C@H](COc1cccc(F)c1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833690 IIOUAOPKBVZDPG-OAHLLOKOSA-N 447.482 2.126 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(Br)n1 792956072 JGXBFIDNONTLLM-UHFFFAOYSA-N 437.269 2.075 10 20 IECD CN(CCNC(=O)NCCCSc1nccs1)S(=O)(=O)c1ccc(F)cc1 798109508 NUWGPQRGWMQZHW-UHFFFAOYSA-N 432.568 2.384 10 20 IECD COC(=O)c1c(F)cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 800877233 DVNFAPZHPKRRHO-UHFFFAOYSA-N 437.418 2.455 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(Br)c(O)nc3C)cc2)CC1 803161532 DELVFFYEJKDNEH-UHFFFAOYSA-N 447.333 2.457 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N(C)C3CCN(CCc4ccccn4)CC3)ccc21 803686217 ZVUSUPBINQWJQC-UHFFFAOYSA-N 449.599 2.246 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)[C@H]3CCCc4c3cnn4C)CC2)cc1 804316396 CWYDCUOERYADKN-FQEVSTJZSA-N 425.533 2.050 10 20 IECD COc1cc(OC)cc(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 807095483 AXSGUFPFURYKJN-SFHVURJKSA-N 440.544 2.090 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](c2nc(O)n[nH]2)C1 808777917 ZXFXKIPJZPQKOX-KGLIPLIRSA-N 445.479 2.492 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3c(Br)nnn3C)cc2F)C[C@@H](C)O1 810167799 OWIQJTKHWKEPBK-GHMZBOCLSA-N 426.290 2.260 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCc3nncn3C2)NC(=O)OC(C)(C)C)cc1 815710894 YNHCPILQTGAOQI-AEFFLSMTSA-N 428.537 2.289 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)S(=O)(=O)c1ccc(F)cc1 918373430 ZHRLBFKOZUDLHT-NVXWUHKLSA-N 447.532 2.006 10 20 IECD CCCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918464688 ZIIIFPNSQMMRPR-SFHVURJKSA-N 438.528 2.432 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2cccc(I)c2)C(=O)NC1=S 920977048 WSGNZXAKLBRJMH-KPKJPENVSA-N 429.283 2.486 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(S(N)(=O)=O)c(Br)s1 1117531861 UOLKFAYGFBMWBZ-UHFFFAOYSA-N 440.337 2.279 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnn1-c1ccccc1 1796601363 YAIKMTKIOKBKNL-VBUUOAMHSA-N 433.468 2.244 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cnn2ccccc12 1804286558 VLKMVFKKROLTHT-FJXIAYRNSA-N 448.479 2.416 10 20 IECD C[C@H](CN)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807017906 MUUZTJYVRRCOLK-IAISJRAMSA-N 432.908 2.061 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c(C)n1C 1807994958 MBYPREZRVVQEBZ-HTAPYJJXSA-N 449.511 2.477 10 20 IECD O=C(c1cc(Cl)ncn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428303 NUMWSHLOCHAESO-INIZCTEOSA-N 445.907 2.483 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnco1)CC2 1828195276 KHBCGDBCGOOHPD-SZHMKSFOSA-N 442.453 2.187 10 20 IECD O=C(c1noc2c1CCCC2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038816 JINJROMNKRLVPQ-VQHVLOKHSA-N 439.468 2.201 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cccc(S(=O)(=O)N(C)OC)c3)CC2)cc1 108433367 LDQQDNILBWFMBT-UHFFFAOYSA-N 433.530 2.230 10 20 IECD Cc1cc(C(=O)CN2CCN(CC(C)(C)O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 303212485 PDSMTWDGLCPUPE-UHFFFAOYSA-N 427.545 2.437 10 20 IECD COc1ccc(N2CCC(NC(=O)c3nc4ncc(Br)cn4n3)CC2)cc1 726562912 PRFNUUXHKXZMHL-UHFFFAOYSA-N 431.294 2.294 10 20 IECD C[C@@H](C(=O)N(C)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)n1cccn1 726567552 QIRODFGHCYJTGN-HNNXBMFYSA-N 435.475 2.289 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3cc(C)nn3[C@@H]3CCS(=O)(=O)C3)CC2)cc1 726694144 CDDUYSGWFAJWNX-GOSISDBHSA-N 447.561 2.350 10 20 IECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c2ncccc2c1 728014824 HZNLGKSPLUZWNC-UHFFFAOYSA-N 435.483 2.414 10 20 IECD Cc1ccc(C(=O)NCCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(O)c1 728068462 OCMVDQPFHKDZJH-UHFFFAOYSA-N 429.492 2.237 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3cc(-n4cnnn4)ccc3F)cc2F)CC1 730383788 PFQCYEZQQHDKSR-UHFFFAOYSA-N 442.474 2.404 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)n(C)c(=O)n4C)cc2)CC1 731132265 XHIITFQMNNWYID-UHFFFAOYSA-N 435.528 2.368 10 20 IECD COc1ccc(COCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 736069273 GKPGJKKKKBVIRI-UHFFFAOYSA-N 432.542 2.153 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 741671402 GWTHHIKXXTZHLV-UHFFFAOYSA-N 431.558 2.487 10 20 IECD CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 743917155 GVTVYXJIHATDEP-UHFFFAOYSA-N 433.917 2.375 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 745777521 QLDFKAJEWUMDHF-CQSZACIVSA-N 434.356 2.110 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](C(=O)Nc4ccc(C)cn4)C3)nc12 746458505 ZPURUKWWBBHKSA-OAHLLOKOSA-N 438.488 2.166 10 20 IECD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 748298202 SBSVBWKJXXJKRD-UZUQRXQVSA-N 448.539 2.354 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1(S(=O)(=O)c2ccccc2)CC1 749405832 KEQMXSJDLKLFBC-UHFFFAOYSA-N 432.517 2.410 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@@]3(C)CCC(=O)N3)cc2F)C[C@@H](C)O1 751523330 XOBQLKFBDUWMAF-CKNGIIGNSA-N 449.523 2.048 10 20 IECD CON(C)S(=O)(=O)c1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 753639800 DWXHLXCPSUQRRS-LLVKDONJSA-N 428.894 2.294 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)COc2cc(Br)ccc21 753644868 OSQFKDCGDTXBGH-LLVKDONJSA-N 435.274 2.333 10 20 IECD COc1ccc(N2CCN(CN3C(=O)C(=O)N(CCc4cccs4)C3=O)CC2)cc1F 754011610 HKNIDWZKWLDUAS-UHFFFAOYSA-N 446.504 2.009 10 20 IECD O=C(Cc1ccc(O)cc1)NCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 765589720 NAOCPPKJRRLZLT-SFHVURJKSA-N 431.920 2.191 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C=C3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 766144885 KWHLZVBXHZQPGM-UHFFFAOYSA-N 445.516 2.064 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n(-c2ccccc2F)n1 768036281 MLFAAZUVIAHPND-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COc1cc(N[C@H]2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc(OC)c1 769244666 ZXMKMPCVGNRPTG-HNNXBMFYSA-N 449.529 2.498 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2C(=O)NCC(F)(F)F)c1 769653526 SYPKZFTWFFYYRO-UHFFFAOYSA-N 431.392 2.308 10 20 IECD C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769662830 DJHQOMOTGDQBQZ-GFCCVEGCSA-N 426.516 2.000 10 20 IECD CCN1CCN(c2cccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)c2)CC1 770730591 OVESEKWJUIZTRT-UHFFFAOYSA-N 435.572 2.466 10 20 IECD COCc1nc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc(OC)n1 771988145 IMUNCSUPYDHLQX-UHFFFAOYSA-N 439.495 2.499 10 20 IECD Cc1cc(C(=O)N2CCOC[C@@H]2c2noc(-c3cnn(C)c3)n2)c(C)n1-c1ccccn1 779841199 CHZIBZBTFYDZLI-GOSISDBHSA-N 433.472 2.486 10 20 IECD Cc1nc(Cn2nnc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2C)no1 783343702 JDVANCMPKQOHNQ-UHFFFAOYSA-N 447.446 2.326 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc(OC(F)F)cc1 785410482 FDPOBLROKGFVFV-UHFFFAOYSA-N 447.482 2.442 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(C(=O)OC)cc3OC)c2)CC1 785553790 JZCWHJPCRPTLRS-UHFFFAOYSA-N 433.530 2.425 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cs1 785670178 MRYXLLFIOCVMHK-UHFFFAOYSA-N 442.463 2.240 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1 785723339 AOMKTYAOCXUWSV-UHFFFAOYSA-N 449.548 2.180 10 20 IECD CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788932380 LVVOWVWKYLDHTE-UHFFFAOYSA-N 449.599 2.184 10 20 IECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1 789819432 MSFCEWXZHCOPRA-IRXDYDNUSA-N 428.508 2.418 10 20 IECD COC(=O)CC1=C(C(=O)OC)[C@@H](c2ccc(N(C)C)cc2C(F)(F)F)NC(=S)N1 794781659 MIAAHYDYJUXUPH-OAHLLOKOSA-N 431.436 2.280 10 20 IECD CN(C)c1ccc([C@@H](CNS(=O)(=O)C[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795250265 ZLIGJYIBWWYCMX-CRAIPNDOSA-N 427.567 2.274 10 20 IECD COc1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(O)c1 795358699 SOIPESNVTQRKRF-UHFFFAOYSA-N 440.543 2.054 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc4nn[nH]c34)cc2F)C[C@@H](C)O1 800205632 LIMWFGGCEVMNJH-ZIAGYGMSSA-N 441.463 2.184 10 20 IECD COc1ccc(OCCN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 803297931 KFNVZQCGLZIRAQ-GOSISDBHSA-N 441.528 2.246 10 20 IECD CCOc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1OC 803306681 VYOHSHHJZBPKPK-KRWDZBQOSA-N 441.528 2.424 10 20 IECD CN(CCc1ccncc1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451073 YBAMFRSUQNFWBD-UHFFFAOYSA-N 432.471 2.469 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC([C@H]4CCCO4)CC3)cc2F)CC1 805010147 VQCWGBNFARQPGQ-JOCHJYFZSA-N 446.567 2.001 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 807631630 BUXHYHQQKUKKFR-UWJYYQICSA-N 442.512 2.492 10 20 IECD COc1cc(O)c(CNc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)cc1OC 809683082 ONIONBSFEQVLDN-UHFFFAOYSA-N 435.546 2.348 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(CC(=O)OC)c2)cc1C 811683629 VGMUPUCANXVEKU-UHFFFAOYSA-N 426.516 2.273 10 20 IECD C[C@@H](Cc1cnc2ccccc2n1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 815065596 IFRCPULOPDETOV-KRWDZBQOSA-N 438.553 2.360 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cn4c(n3)CCCC4)CC2)cc1 916196473 IEOOAGXYCUPNGI-UHFFFAOYSA-N 440.592 2.282 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)CC2)cc1 917821376 CZQXPJWRKIIVIQ-DEOSSOPVSA-N 436.512 2.201 10 20 IECD COC(=O)COc1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918035658 YADDRRGHKMBOBG-KRWDZBQOSA-N 440.500 2.262 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 918441197 YHTABGWTQYJIJN-UHFFFAOYSA-N 430.480 2.224 10 20 IECD CC(C)NC(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644267 VEQKDOHTYAVWAI-UHFFFAOYSA-N 444.557 2.381 10 20 IECD NC(=O)Cn1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 918668326 FSMBODLZZYKWCW-XFXZXTDPSA-N 435.556 2.050 10 20 IECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 919022833 TVOXHYBATICZTD-GJZGRUSLSA-N 431.464 2.316 10 20 IECD O=C(CCOC[C@H]1CCCO1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919699736 ZHDDSUJYWKDZPD-LJQANCHMSA-N 443.523 2.144 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(S(=O)(=O)C(C)C)c1 1324136405 NZFRBMAZARFXTB-KRWDZBQOSA-N 435.498 2.184 10 20 IECD O=C(Cc1cccs1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002602 UKTMZEZUKUZBLM-FQEVSTJZSA-N 436.917 2.499 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1 1782740230 JPBSVDUEURVLPC-QFZSKUSHSA-N 436.917 2.070 10 20 IECD Cc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1785980337 GXTKQPPDBSHDQB-JDFRZJQESA-N 449.891 2.263 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)o1 1797260513 APYUTJLGIJBUBR-JGPRNRPPSA-N 427.935 2.045 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc(Cl)cnc3O)CC2)C1 1810549693 YMAZDYOYAPOCAV-UHFFFAOYSA-N 446.891 2.405 10 20 IECD C[C@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815299199 MHZMJVVCEJXFJJ-YGRLFVJLSA-N 449.895 2.292 10 20 IECD CC(C)(F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817203119 OMNZFISYTKNKEV-NSHDSACASA-N 427.527 2.010 10 20 IECD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C1(O)CCC1 1817842799 OSXWHQKQIWFNNO-SWLSCSKDSA-N 429.477 2.073 10 20 IECD O=C(CC[C@@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823028161 IQTGTLLGQDIDKY-CJNGLKHVSA-N 429.477 2.339 10 20 IECD O=C1CC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)[nH]n2)C1 1823405656 BNQRSCAUSLIUCZ-LJQANCHMSA-N 448.483 2.174 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)n1ccnc1 1827423742 FBOUALZCVABWHH-QAPCUYQASA-N 427.505 2.184 10 20 IECD O=C(c1cccc2c[nH]nc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039199 WQTUEBODGRBDAI-SOFGYWHQSA-N 434.452 2.210 10 20 IECD O=C(Cc1cnc2ccccn12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847538963 MAYPGGRFLMVVLS-IRXDYDNUSA-N 440.887 2.457 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3cccnc3N3CCOCC3)CC2)cc1 110462214 NYIHIYMHFHFHBL-UHFFFAOYSA-N 425.533 2.395 10 20 IECD CN(C)C(=O)N1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726722213 NYGNYWLFYZTQCD-UHFFFAOYSA-N 425.480 2.266 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 728984739 SVZWYGHZLXDPHN-INIZCTEOSA-N 448.541 2.232 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)NCC4CC4)C3)cc2F)CC1 730134057 LQBRRTYXILZSNP-HXUWFJFHSA-N 445.583 2.415 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(F)(F)Oc3ccc(C=O)cc3)cc2)C1 731612280 ITMMIICKOGPCEZ-KRWDZBQOSA-N 431.439 2.489 10 20 IECD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2=O 731856867 UTZWRHPXKVINAH-JTUHZDRVSA-N 429.517 2.401 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1 731964094 IWUSZZIPMHRTHK-QFIPXVFZSA-N 430.593 2.205 10 20 IECD COC(=O)[C@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 752301018 DSBVANVSUONHGK-HSZRJFAPSA-N 441.503 2.051 10 20 IECD COc1cc(NC(=O)CN(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)cc(OC)c1 752333860 WWKSABGRTZNNEJ-UHFFFAOYSA-N 428.533 2.299 10 20 IECD Cc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)nc1 753490634 LLNVOHJZLFTUFX-UHFFFAOYSA-N 427.482 2.485 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)c3ccsc3)CC2)cc(OC)c1OC 759239511 MIVCUTVETKDXJP-UHFFFAOYSA-N 433.530 2.243 10 20 IECD O=C(NCCS(=O)(=O)CC1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765956148 CQMQKWHGBQHQBB-UHFFFAOYSA-N 431.505 2.381 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN([C@@H](C)c4nccs4)CC3)CC2)cc1 767009477 ZXCTYOHNJMSDGK-PZJWPPBQSA-N 445.633 2.013 10 20 IECD O=C(CCS(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1)OCc1ccccc1 767261733 BIVAOLMOZMDEPT-UHFFFAOYSA-N 446.569 2.448 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 769164032 TZHWNPRZXXRQJR-RPWUZVMVSA-N 444.620 2.462 10 20 IECD CCCN(Cc1ccccc1O)C(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 769292890 SOMCLWNGOAETSN-UHFFFAOYSA-N 438.571 2.456 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)nc12 772328926 YYODKKFMKDCSGC-KGLIPLIRSA-N 433.509 2.441 10 20 IECD O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 774064185 CBYGNVVWYOTWJD-GOSISDBHSA-N 439.443 2.401 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 774125595 DQAICIRIIXAIAJ-UHFFFAOYSA-N 438.937 2.375 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)CC2)cc1 774754453 JOBLBCDCCDBZAC-XQBPLPMBSA-N 430.593 2.264 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ncc(C)c(OC)c3C)CC2)cc1 778252971 XSTJHAORDPVGTP-KTKRTIGZSA-N 438.528 2.237 10 20 IECD COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1cccc(OC)c1O 781517723 QPKKKJDSPYCBCG-UHFFFAOYSA-N 426.347 2.461 10 20 IECD Cc1cc(C(=O)COC(=O)Cc2cncs2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782354642 MPIOPRVXVSPPQS-UHFFFAOYSA-N 433.511 2.167 10 20 IECD O=C(NCCc1cccc2[nH]ccc12)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842622 FHRZJQHNCJNYJN-UHFFFAOYSA-N 438.503 2.243 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCN(Cc4ccccc4)C3=O)cc2)CC1 804004466 LZGNPNPDMOIXLN-QHCPKHFHSA-N 448.567 2.456 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCC(C)(C)C3)CC2)cc(OC)c1OC 806759329 XVRSQFAVYIUZKO-INIZCTEOSA-N 433.549 2.446 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290396 HVUPMHHHTJNNHC-KRWDZBQOSA-N 428.533 2.052 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290397 HVUPMHHHTJNNHC-QGZVFWFLSA-N 428.533 2.052 10 20 IECD C[C@H]1[C@@H](C)SCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854961 ORKYOFRXRRDBLA-ZWKOTPCHSA-N 430.618 2.187 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 918220219 IHRBQVGDUGKFIZ-NUJGCVRESA-N 441.569 2.406 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1C 918442191 BDPIRFHXELRTKB-UHFFFAOYSA-N 438.528 2.417 10 20 IECD COc1ccc(OC)c(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 919786553 XHVYNYCFFLGLSI-LJQANCHMSA-N 440.544 2.447 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccccc4)CC3)cc2F)CC1 1253976642 XRFOLHBADZDZAV-UHFFFAOYSA-N 425.552 2.334 10 20 IECD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)c1ccccn1 1784657555 RXQAJZHMQKHJCY-FPTDNZKUSA-N 445.903 2.393 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3cnccc3F)sc2C1)c1cc(O)nc(O)c1 1815964404 DBILMFXEGJZGJY-JTQLQIEISA-N 429.433 2.023 10 20 IECD O=C([C@@H]1Cc2ccccc2O1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037999 YLUGRHVCALNOOG-XSBJJCPUSA-N 436.464 2.024 10 20 IECD CN1CCN(C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 727843115 SFHLYMIDLILRQT-XMMPIXPASA-N 437.588 2.311 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@H]1CN2CCC[C@H]2CO1 729497337 SEDJJCUYZKFKOH-ZWKOTPCHSA-N 442.482 2.204 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)CC2)cc1 748570164 KVZYTZUZXIIFBF-IBGZPJMESA-N 447.532 2.287 10 20 IECD C[C@@H](OC(=O)c1cc(C(N)=O)c[nH]1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 750421873 YMWAIKWDBRXACA-LLVKDONJSA-N 431.404 2.073 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCCCSc2nccs2)c(C(=O)OC)s1 751085010 JLHNSKCCSAZAJL-UHFFFAOYSA-N 436.558 2.239 10 20 IECD O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751213116 PFZLBQHOCRPBMB-UHFFFAOYSA-N 445.906 2.284 10 20 IECD O=C1NCCc2ccc(S(=O)(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc21 751371901 MBWVAIYFEIBVMN-KRWDZBQOSA-N 449.960 2.274 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3c(C)nc4sccn34)CC2)cc1 754071465 LSUFRPHXQODPCO-IBGZPJMESA-N 429.590 2.328 10 20 IECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4CCOCC4)cc3C(F)(F)F)C(=O)[C@H]2C1 761096598 JYVRTHHGGRVQHB-NVXWUHKLSA-N 427.423 2.484 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN([C@@H](C)c4nccs4)CC3)CC2)cc1 767009476 ZXCTYOHNJMSDGK-FPOVZHCZSA-N 445.633 2.013 10 20 IECD CC(C)C[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768513045 VJGYYFXTVMJHEF-PXAQALGRSA-N 448.539 2.412 10 20 IECD CS(=O)(=O)[C@H]1CCCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 770003195 XJALRQZDRIQDKJ-INIZCTEOSA-N 440.521 2.300 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(Cn4cncn4)cc3)CC2)cc1 778229814 AUHQWPSOOWKMHM-KHPPLWFESA-N 446.511 2.179 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 778625996 CYOSDDLCIFPWRI-UHFFFAOYSA-N 436.530 2.316 10 20 IECD Cc1nnc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)s1 780812945 DHGZPEQEWRTQIA-UHFFFAOYSA-N 449.470 2.191 10 20 IECD C[C@H]1C(=O)CC[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 781314743 WFLRRTFFCJWAMZ-RDJZCZTQSA-N 434.508 2.463 10 20 IECD COc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1[N+](=O)[O-] 782782919 ZCLWOZARLOREIN-INIZCTEOSA-N 429.429 2.455 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 788910464 LCZGQUMFCDXNSQ-GOTSBHOMSA-N 437.540 2.254 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2)CC1 789214673 KBKNBYISZJEDDN-HXUWFJFHSA-N 442.560 2.228 10 20 IECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 789388683 PTIRISQGOVKINL-UHFFFAOYSA-N 439.516 2.228 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccccc1OCC1CC1 789797511 ADAXZPPCBORSNG-UHFFFAOYSA-N 441.503 2.384 10 20 IECD CC[C@@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 789799029 HNAGCYCKVQQBLT-MRXNPFEDSA-N 444.507 2.167 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@@H]1COC2(CCCCC2)O1 789859261 BOHAPEGFDSSXNK-LJQANCHMSA-N 433.574 2.048 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 798337785 ZWSPZXZSRRJTBI-UHFFFAOYSA-N 447.296 2.162 10 20 IECD CC[C@H](C)N(CC(=O)OC)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 799169549 MUTYOZDROHBKPT-AWEZNQCLSA-N 435.546 2.198 10 20 IECD CN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1)C(=O)OC(C)(C)C 803685740 JKTPGOSSYNJGGU-SFHVURJKSA-N 444.576 2.401 10 20 IECD O=C(NCc1nccn1C(F)F)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 803800472 ZKGOWNILSMZSGK-GFCCVEGCSA-N 443.401 2.281 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)c(C)o1 807672909 KFAOOUCZRBOONA-INIZCTEOSA-N 426.517 2.124 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c[nH]1 814531862 MKBRBAHJJAHKLK-OKILXGFUSA-N 447.463 2.027 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccccc3NS(C)(=O)=O)CC2)cc1 849192421 HXQIFYROTRFMJA-UHFFFAOYSA-N 446.573 2.009 10 20 IECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(=O)O 871823739 PNVVYZZOAYPZCC-UHFFFAOYSA-N 438.477 2.238 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(N(C)C)nc3)CC2)cc1 916196522 KAFRZSBDELGUBG-UHFFFAOYSA-N 426.565 2.168 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)cc1[C@@]1(C)NC(=O)NC1=O 917897632 ASYZNNRNNNWFPW-GOSISDBHSA-N 448.482 2.267 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 918289573 YKPGPQYKDJPWKS-GJZGRUSLSA-N 442.491 2.054 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3cccc(Cl)c3)cc2)C1 918372632 NXOZCHUHFJKOGK-QGZVFWFLSA-N 428.920 2.088 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccn1 919076476 LLNPFWACCSSTCQ-UHFFFAOYSA-N 441.509 2.366 10 20 IECD CCOC(=O)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919782045 BIZMJWRBAACHFN-UHFFFAOYSA-N 444.511 2.085 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 1321048275 GSXLTENCDBTJIS-YOEHRIQHSA-N 446.887 2.395 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(c2ccccc2)C1=O 1324540254 GIFQGTHAGGKQNT-ROUUACIJSA-N 426.469 2.131 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCC(=O)Nc3cc(C)ccc3OC)CC2)cc1 1341185422 BQMBMRJBMUYQFF-UHFFFAOYSA-N 440.544 2.279 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3)C2)C1 1780617442 ZJEFSWIIFCJFAR-NKOINVLESA-N 442.443 2.099 10 20 IECD CCC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1783131369 ONYSKWYSUSDOBL-QHCPKHFHSA-N 426.517 2.045 10 20 IECD Cc1cc(C)nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1795984228 NOTLAAJJFZFGPB-CCWDJLKJSA-N 445.903 2.280 10 20 IECD Cn1cc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1797209630 KMJZOFAUIITBMM-NCSLWMNCSA-N 429.448 2.246 10 20 IECD Cc1nc(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816726762 YZRVKLAMVHBQPR-LLVKDONJSA-N 429.458 2.094 10 20 IECD COCCCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195573 RBTBHFIPLCDEGV-NEXMIYJRSA-N 447.513 2.312 10 20 IECD O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1830737941 ZLYADTOZIURBBH-SJORKVTESA-N 449.935 2.263 10 20 IECD Cc1ncc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1846586308 HDLKFYOCDDLPDD-GQCTYLIASA-N 429.498 2.028 10 20 IECD C[C@H](Oc1cccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846628248 OQGSRGMICJFSHN-ZDUSSCGKSA-N 431.876 2.431 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)CC2)cc1 108430914 CZUXXGGWAJJKMM-UHFFFAOYSA-N 429.542 2.370 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3CCN(C(=O)OCC(C)C)CC3)CC2)cc1 726162222 OSAJLLZNOPVDPV-UHFFFAOYSA-N 446.592 2.438 10 20 IECD Cc1noc([C@H](C)NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 726235470 CIISLNFSSKKZEN-AWEZNQCLSA-N 440.483 2.194 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCCC[C@H]3CCNS(C)(=O)=O)CC2)cc1 726714240 WMSSGDZKTUBGGD-IBGZPJMESA-N 438.594 2.167 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cs1 728746714 BSUSZGZGXXUZJX-UHFFFAOYSA-N 449.602 2.050 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 728980159 WUVGQYUAXOCRQN-WMLDXEAASA-N 434.514 2.349 10 20 IECD NC(=O)[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1Cl 731756314 ISGOZGPAKXLRAL-QGZVFWFLSA-N 448.926 2.459 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 734407369 QFBDGTYGSHYJGN-HXUWFJFHSA-N 446.529 2.439 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(N(C)CCCO)CC3)cc2F)C[C@@H](C)O1 741079190 BGRXPYATWFMJMQ-HDICACEKSA-N 436.572 2.428 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3cnn(-c4ccccc4)n3)CC2)cc1 742948145 MVWNQEUGHKWNCA-UHFFFAOYSA-N 449.559 2.240 10 20 IECD Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 748980314 KGIFEHNQPPRTEA-UHFFFAOYSA-N 428.508 2.287 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@@H]3OCCc4ccccc43)CC2)cc1 754026610 XCKPDAKFYAIHAQ-DHLKQENFSA-N 425.573 2.424 10 20 IECD COCCOCCS(=O)(=O)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 768212431 WGYIILYYSZHFOX-UHFFFAOYSA-N 428.938 2.399 10 20 IECD CNS(=O)(=O)c1ccc2c(c1)nc(-c1ccc(N3CCN(C)CC3)cc1)n2CCOC 771512199 BLIOUAAPOQNWAM-UHFFFAOYSA-N 443.573 2.010 10 20 IECD CSCC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 773742691 ZGVJHEIBSVXSLP-BSWAZPDLSA-N 434.558 2.442 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 787093928 QBIBZDOVGHNWFT-UHFFFAOYSA-N 440.519 2.237 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 788399922 FVONDSQDWVFMHK-ZWKOTPCHSA-N 441.528 2.293 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc([C@@H]4CCCO4)nn3C)CC2)cc1 789448000 HJVNQKJGAWBLDC-IBGZPJMESA-N 427.505 2.004 10 20 IECD Cc1cnccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789818726 KNWQCHUFNDXJCR-IRXDYDNUSA-N 428.508 2.118 10 20 IECD CCC[C@@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789827729 VEUIDEDQHFDUTR-MFEFFIJZSA-N 435.540 2.209 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CCC(=O)OC(C)C)CC2)cc1 792601567 YIXNIYUWOPBHEY-LENZSSGSSA-N 431.533 2.137 10 20 IECD CCC[C@H](C)[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793729346 ZSCGMRDYYGEKLC-HFSMHLIXSA-N 428.577 2.432 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)C1 793729580 AHMAVFRTWKPHJU-VXKWHMMOSA-N 448.567 2.096 10 20 IECD CC(C)(CCCO)CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449127 OWNHYJLQBWCHIP-UHFFFAOYSA-N 427.492 2.288 10 20 IECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664519 MTQXBNGZYMWSKB-UHFFFAOYSA-N 425.464 2.205 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 804266427 CFWFZURTNDCUHS-LJQANCHMSA-N 428.533 2.195 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 804316983 PQHFYJSDYCSXIV-MRXNPFEDSA-N 448.564 2.057 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1 806887140 YWFCEZHFGHLPKM-NSHDSACASA-N 429.404 2.009 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)s1 807695987 YCUYCBSCLLSAEK-UHFFFAOYSA-N 449.598 2.417 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OCC(F)F)c1 810368178 QLIQQMLPUCMLKM-UHFFFAOYSA-N 444.438 2.061 10 20 IECD CN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CN(C(=O)OC(C)(C)C)C1 812011355 ZOGKOVVGXGCBBS-QGZVFWFLSA-N 445.564 2.149 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1)N1CCC[C@@H]1CO 864044736 JPCFVPQKYBDUSC-OAQYLSRUSA-N 431.558 2.281 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(C(=O)O)c1F 871823423 KRTOVRVYXRFMGC-UHFFFAOYSA-N 426.441 2.287 10 20 IECD COC(=O)c1cc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)oc1C 918117810 JRVLBNQWAIBCJE-QGZVFWFLSA-N 442.516 2.418 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccccc1F)CCO2 1785507672 RQVZDTIRORJKJO-DRGXBFSJSA-N 442.443 2.099 10 20 IECD Cc1noc(C)c1CC(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806762135 BNEHULGUFHMICT-UHFFFAOYSA-N 428.489 2.185 10 20 IECD CCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816560102 ATNAYMJPQWCXTC-AWEZNQCLSA-N 425.449 2.052 10 20 IECD O=C(c1cc(O)ccc1O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429237 HDOXJPIOLFHXPQ-GOSISDBHSA-N 441.484 2.451 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)no1 1842542384 SBUKIDPKAPJUKD-UHFFFAOYSA-N 435.484 2.408 10 20 IECD CCN1CCN(c2ccc(CNc3cc([N+](=O)[O-])ccc3S(N)(=O)=O)cc2F)CC1 302121605 YEXVLKFMMDHXOL-UHFFFAOYSA-N 437.497 2.135 10 20 IECD CN(C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)C(=O)OC(C)(C)C 729537392 DHASCXNRFMHAON-CYBMUJFWSA-N 427.523 2.093 10 20 IECD CCOC(=O)c1c(C)[nH]c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1C 742916765 LXRZXXVDFSZQRN-UHFFFAOYSA-N 428.533 2.369 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc(Br)cc1 744372723 IENDZBKFEQXAPO-UHFFFAOYSA-N 440.363 2.452 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C)CC2)cc1 747071476 OZDSBJWTYSFYCC-KRWDZBQOSA-N 449.548 2.390 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1c1ccccc1 749011555 WCGPKYGZOREISR-NRFANRHFSA-N 426.492 2.170 10 20 IECD O=C(Cn1ccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)n1)N1CCOCC1 760698407 YQEMEDVMEPAXAQ-UHFFFAOYSA-N 428.493 2.253 10 20 IECD O=C(CONC(=O)CCCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 772895958 JXJKJXRPTCHFAE-UHFFFAOYSA-N 429.492 2.349 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2)cc1 773741803 YMRHUTXUJGZERS-FVNWOWOISA-N 439.512 2.059 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 775656156 YAFOXANXHBUOPO-BBWFWOEESA-N 428.537 2.468 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4ccccc4n3C)CC2)cc1 778219525 HLEZBZHYJDZLRN-VAWYXSNFSA-N 433.512 2.103 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 778395766 SVQZVIIBEDLAJK-BAPBRVRGSA-N 439.556 2.364 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](O)C2CCCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782362172 NILGSKOOOYXGSV-NRFANRHFSA-N 448.541 2.409 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1 784026593 VRKXKLMGQMKCOW-UHFFFAOYSA-N 443.475 2.381 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F 785296814 IMMLNBKSDCIMGH-LLVKDONJSA-N 449.389 2.383 10 20 IECD CCn1c(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nc2ccccc21 785464083 XQDPVAXRVJEJEZ-UHFFFAOYSA-N 435.528 2.168 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 787192493 XZRCAVCJWGREJI-UHFFFAOYSA-N 439.560 2.039 10 20 IECD O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803623814 MLVOYMGSUAIMFK-IBGZPJMESA-N 440.496 2.378 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1cccc(S(=O)(=O)N(C)C)c1 804389303 BRCRNGHVVHYRSF-CVEARBPZSA-N 446.573 2.058 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CCc3cccn3C)cc2F)CC1 805008035 YKEPBYUKVOFQEU-GOSISDBHSA-N 443.567 2.060 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O 807103952 YUIHHQUQFHPRMF-JOCHJYFZSA-N 436.556 2.027 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 807195580 HTIJDJLBJLDDRY-NUEKZKHPSA-N 425.323 2.433 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1O 809714382 GTIAVUOGVIDAJU-INIZCTEOSA-N 436.509 2.436 10 20 IECD C[C@H](NC(=O)c1c(I)cnn1C)c1ccc(N2CCOCC2)cc1 814113326 HZXQWZNMFPURAV-LBPRGKRZSA-N 440.285 2.352 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)C1CCCC1 815550141 FEJCPUNUKUMKPA-UHFFFAOYSA-N 446.525 2.420 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)c1 817044656 JDZGEESUPDBLQJ-CQSZACIVSA-N 447.282 2.129 10 20 IECD CCc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917930392 RWUUNVNYZFDOGX-SFHVURJKSA-N 445.541 2.127 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918209819 IUBFAABWCOREDY-UHFFFAOYSA-N 435.521 2.190 10 20 IECD O=C1CCCc2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc2N1 918337811 OLKYAGXGTVWEMM-UHFFFAOYSA-N 427.526 2.126 10 20 IECD NC(=O)Cn1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 918581254 JIPLATDFTLGTEL-QPEQYQDCSA-N 435.556 2.050 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1C(C)(C)C 919350903 CCSGVDAAGDZVHP-UHFFFAOYSA-N 432.496 2.395 10 20 IECD CN(C)c1ncccc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919854962 BLZDLQJSBDAALO-UHFFFAOYSA-N 435.507 2.333 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(S(=O)(=O)NC2CC2)cc1 919968598 HDCZZDVVUNOQDY-UHFFFAOYSA-N 443.569 2.266 10 20 IECD CSc1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccn12 920290562 HMLRIDRYXWQYKJ-UHFFFAOYSA-N 430.555 2.221 10 20 IECD CCc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1Cl 1794744133 JCIVQPSEQAXABG-CLLJXQQHSA-N 433.896 2.008 10 20 IECD COc1c(Cl)ccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601477 OCDHGMWHVUZVDQ-CLLJXQQHSA-N 432.864 2.115 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1796930897 IWYCQCXPXLABCO-GGPHIMKMSA-N 447.495 2.135 10 20 IECD O=C(COc1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931949 UTPQPDUNUQMKSO-FNLKRUPLSA-N 446.507 2.497 10 20 IECD COc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1798785148 LCRGBOCEGIKSIS-VBUUOAMHSA-N 447.495 2.135 10 20 IECD CC1(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CCC1 1802427631 XLBSTKFGHWKZFK-QAPCUYQASA-N 446.598 2.138 10 20 IECD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c(O)n1 1820264168 HUWPCOMZHVMKEP-HNNXBMFYSA-N 438.444 2.245 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2O)CC1 1829176236 LUBSVXVOKLSCIW-QGZVFWFLSA-N 426.473 2.141 10 20 IECD COc1ccc([C@H](O)C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1 1841185194 MMHFAOAKDKSRDI-SFHVURJKSA-N 446.887 2.310 10 20 IECD Cc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)s1 1846583587 MJZUYZQHSDGNNR-AATRIKPKSA-N 435.596 2.133 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)n(C)c2ccccc12 579273135 GLPZZENLIYMZMY-LJQANCHMSA-N 436.487 2.159 10 20 IECD CCN(CC)CCOC1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 584073962 UPSAEESFDOQGHZ-UHFFFAOYSA-N 428.577 2.452 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 725899809 JOZZELXRENUKRO-CYBMUJFWSA-N 427.523 2.141 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729067932 YBJNENWIULLKAV-AWEZNQCLSA-N 449.529 2.247 10 20 IECD COc1cc(F)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 730679796 INWBCGLSZVGGGP-UHFFFAOYSA-N 431.464 2.277 10 20 IECD Cc1cc(-n2c(C)cc(C(=O)CN3CCN(CC(N)=O)CC3)c2C)ccc1Br 730808621 PMIVGOZHECITEB-UHFFFAOYSA-N 447.377 2.451 10 20 IECD C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732451544 VVMYQYDBHXKHLF-SJLPKXTDSA-N 447.580 2.443 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCCC4=O)C3)cc2)C1 732887247 IMFMHTAFSMJOCB-CTNGQTDRSA-N 441.576 2.075 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)c1O 737283699 FEMUXKUZOYAZBZ-UHFFFAOYSA-N 439.390 2.176 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(I)c2)c1O 737285519 FIJJDXUPWZPSKN-UHFFFAOYSA-N 426.210 2.260 10 20 IECD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739767830 GGQWTDNHEXTPBP-UHFFFAOYSA-N 448.520 2.030 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3c(C)nc4cc5c(cc43)OCCO5)CC2)cc1 758198548 TWCASYXVVRLCSD-LJQANCHMSA-N 438.528 2.308 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1F 759511287 JWUXTGOPMUSXGD-UHFFFAOYSA-N 434.489 2.210 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)c1 769741635 KZJMTSYCZFCEGN-UHFFFAOYSA-N 440.481 2.341 10 20 IECD CCOC(=O)CNC(=O)C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 770361050 SROHEIRLGDRVCU-UHFFFAOYSA-N 432.521 2.476 10 20 IECD CN1CCC2(CCN(CC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2)C1=O 773922880 OUVNBIBFRDDKKY-UHFFFAOYSA-N 431.492 2.345 10 20 IECD COc1ccc(N2CCCN(C(=O)Nc3ccc(C[C@@H]4NC(=O)NC4=O)cc3)CC2)cc1 775701718 HXJJTQZMRYYJMS-FQEVSTJZSA-N 437.500 2.190 10 20 IECD C[C@H](NCC(=O)NN1C(=O)N[C@@](C)(CCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 775832350 ZHRNYROBFUXULP-XDHUDOTRSA-N 437.544 2.378 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C\C(=O)Nc3ccc4n[nH]cc4c3)cc2)C1 778638415 YGJKWHRRBSYASE-IBSYWUHOSA-N 446.511 2.076 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 785391848 YQAMQPQPXFNRFY-FQEVSTJZSA-N 438.572 2.243 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2)CC1 786660271 CGYRXVUNDKHIMQ-HXUWFJFHSA-N 426.561 2.153 10 20 IECD COc1ccc(OC)c(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 786684617 QOGXYADMVRGVBF-UHFFFAOYSA-N 443.569 2.232 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)cn3)cc2F)C[C@H](C)O1 789829023 ZZXYGTUHSCEWHL-KBPBESRZSA-N 434.899 2.420 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3C(=O)c3cccs3)CC2)cc1 794753796 HRPQYUSSTQJDMG-GOSISDBHSA-N 426.542 2.367 10 20 IECD CC[C@H](c1nnc(Sc2ncc([N+](=O)[O-])s2)n1CCN1CCOCC1)N(C)C 799927429 ABDLPQICAZAEEG-GFCCVEGCSA-N 427.556 2.139 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCc4c(O)cccc43)cc2F)CC1 804401329 UBYMFWYFCUVPRE-FQEVSTJZSA-N 440.519 2.093 10 20 IECD Cc1cccn2cc(CCNC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)nc12 806537336 VGMXABHAMLVHEJ-SFHVURJKSA-N 435.528 2.015 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 807387056 XCCAFZGTOZMSHJ-UHFFFAOYSA-N 433.262 2.153 10 20 IECD CC[C@@]1(CO)CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768410 JGKBQSZUULTUMN-BTYIYWSLSA-N 425.476 2.137 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1C 810161319 IDXPFQASHABEGI-UHFFFAOYSA-N 433.599 2.451 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)SCC(=O)N4)CC2)cc1 810395716 SZFHTHPOQGQMAJ-UHFFFAOYSA-N 426.542 2.291 10 20 IECD CCOCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)no1 812032938 NCBPIIGXLAKKNS-OAHLLOKOSA-N 434.516 2.448 10 20 IECD O=C(CCC(=O)c1ccc(F)cc1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338203 YFESVQDWRWDXCH-UHFFFAOYSA-N 436.480 2.479 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3cccs3)cc2F)C[C@@H](C)O1 918632995 HJIGVQBCDONICX-OKILXGFUSA-N 441.550 2.096 10 20 IECD COc1ccccc1[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N1CCCC1 919805914 APTMWADGFWDHNW-GOSISDBHSA-N 433.530 2.339 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(C)cc3OCC(=O)N(C)C)CC2)cc1 920402532 KQXQITTVXANCLA-UHFFFAOYSA-N 440.544 2.231 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3cccnc3N3CCN(C)CC3)CC2)cc1 921200143 UHZUXXUADRXWRX-UHFFFAOYSA-N 438.576 2.264 10 20 IECD CC(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)no1 1794932939 RPSURVOALYZUAO-IVWMJMPLSA-N 449.891 2.380 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1c(F)cccc1F 1804335755 CYQHBWZPXVSVDF-ZSBIGDGJSA-N 439.509 2.077 10 20 IECD Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1808532506 CKPBSEVNACUQRE-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1 1838031848 RCPNABDUBRWUQI-MGPUTAFESA-N 441.887 2.030 10 20 IECD CC(C)c1nc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)no1 1848162268 DOIVZFRNHQORLO-KBPBESRZSA-N 434.880 2.316 10 20 IECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1OCC(=O)O 109765489 OEFBMDRQNYAZRJ-UHFFFAOYSA-N 448.906 2.284 10 20 IECD C[C@H]1Cc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1S(C)(=O)=O 117528358 MFTOEPGSVIFLHP-HNNXBMFYSA-N 447.532 2.303 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN([C@H](C)C(=O)NC4CC4)CC3)cc2)CC1 303381216 MPRBGCUOUPUZQQ-LJQANCHMSA-N 427.593 2.417 10 20 IECD O=C(CN1CCO[C@H](c2cccc(F)c2)C1)NCc1ccc(N2CCOCC2)c(F)c1 727434108 FALCHYYIZLNDDN-QFIPXVFZSA-N 431.483 2.491 10 20 IECD CCCCC(=O)N1CSC[C@H]1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 728017824 BNJCHMQLODXLIB-NRFANRHFSA-N 448.633 2.415 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1 728979117 YFJLQBZRZAIUCC-SWLSCSKDSA-N 436.534 2.019 10 20 IECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NCc1ccc(N2CCSCC2)cc1 730105676 LNTFCIQWXMIRQE-UHFFFAOYSA-N 425.558 2.291 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCO)CC(F)(F)F)cc2F)C[C@H](C)O1 731214012 OMTFHPJGFVBUGC-GJZGRUSLSA-N 435.462 2.302 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCCCSc3nccs3)C2=O)cc1 733881004 VJYRDAZGMSJSNO-LJQANCHMSA-N 434.543 2.217 10 20 IECD C[C@@H]1CS(=O)(=O)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 739744421 HHSARDXXRVVGBY-HLVNSREUSA-N 444.625 2.375 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 751062447 INPURKDUIMEDOD-UHFFFAOYSA-N 439.921 2.478 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)cc1 759597273 QHGKTABBPVLJIW-WUXMJOGZSA-N 448.497 2.323 10 20 IECD O=C1N[C@H](c2cccnc2)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 761126276 YDAPSBSNSYDDOF-HXUWFJFHSA-N 447.474 2.130 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(NC=O)cc3)cc2F)C[C@H](C)O1 762859704 PZIBKXHPZJQXTK-HOTGVXAUSA-N 443.475 2.481 10 20 IECD CN(C[C@@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 769924497 ZJGDLMRAPKJCJK-AWEZNQCLSA-N 427.523 2.235 10 20 IECD COC(=O)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(Cl)c1 769933027 VETTXHBQUHNKNM-OAHLLOKOSA-N 426.878 2.451 10 20 IECD COc1cccc(CNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c1O 771015546 MFAZGBZSWIKRRC-LLVKDONJSA-N 432.420 2.403 10 20 IECD CNC(=O)c1cc(Cl)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772905266 XKLOZXCOJPRVFI-UHFFFAOYSA-N 434.899 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-c4nc[nH]n4)cc3)CC2)cc1 778270665 WGFVULONDCTUME-KHPPLWFESA-N 432.484 2.324 10 20 IECD COc1cc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)c(O)c(C(C)(C)C)c1 779869145 FBGWOXQIQDVWJH-SFHVURJKSA-N 426.579 2.325 10 20 IECD COCCOc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1C 780408097 AFAZKJDUQUBNNH-UHFFFAOYSA-N 447.557 2.490 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@@H](N2CCNC2=O)C1 782971762 NKIZYOIROHMFOV-DOTOQJQBSA-N 437.491 2.456 10 20 IECD CC1CCN(CCCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 785519940 LFNWKSXTFIODRB-KDURUIRLSA-N 448.583 2.294 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3ccc(C)s3)CC2)cc1 785526976 HMCZYOYUBSUNJL-UHFFFAOYSA-N 430.574 2.010 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](CO)Cc3ccc(C)cc3)CC2)cc1 786116663 LVVLAXVTGQGGQO-OAQYLSRUSA-N 426.561 2.028 10 20 IECD C[C@H]1CCCCN1CCCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 787904454 SMIICAQINUJAPK-VQTJNVASSA-N 430.593 2.471 10 20 IECD COc1ccccc1C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310240 JSXNEATYTQCXBI-UHFFFAOYSA-N 425.529 2.242 10 20 IECD C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793717138 HHSIQLGPVVOOSP-QIJUGHKUSA-N 448.567 2.409 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061657 OAZMPCQHZXFFBI-MJGOQNOKSA-N 431.499 2.220 10 20 IECD C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665383 ZWGKIOSIIPRXSP-HOCLYGCPSA-N 436.528 2.412 10 20 IECD CC(C)CO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n1 803688379 YDYDJORUHAAGOT-MRXNPFEDSA-N 443.548 2.460 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@@H]3CCOC3)CC2)cc1F 804852069 YEJHYXXEPQAYDD-GOSISDBHSA-N 435.540 2.332 10 20 IECD CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 806634326 JPVCEDPZVRCMHO-HNNXBMFYSA-N 428.574 2.483 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12 807836831 QRCJKNKNFAOEJT-UHFFFAOYSA-N 440.268 2.040 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@H]1CCCCS1 808854029 OFZOPEYXZBWNNT-OAQYLSRUSA-N 430.618 2.237 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)nnn1Cc1ccccc1F 815446232 RILAERWQAOEFEN-UHFFFAOYSA-N 428.443 2.234 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cn2)CCO1 916393085 SPOZKRDTDALPLM-IBGZPJMESA-N 439.560 2.485 10 20 IECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 918285125 ZSBMVTJAOSKTBL-UHFFFAOYSA-N 431.464 2.325 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C[C@@H](C)O1 918443506 CNIQKZJALIQKIU-IYBDPMFKSA-N 425.485 2.239 10 20 IECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918633832 PHAGWGOMQNJPRV-VXGBXAGGSA-N 439.509 2.227 10 20 IECD COC(=O)CC1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 919655521 RLTLOWYMRRDITN-UHFFFAOYSA-N 432.565 2.192 10 20 IECD O=C(CCn1cnc2sccc2c1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968297 ARQBYAPDSSENQT-UHFFFAOYSA-N 426.542 2.373 10 20 IECD CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920194830 JJOAGKYAPUWIGJ-UHFFFAOYSA-N 438.528 2.260 10 20 IECD C[C@H](NC(=O)NCc1ccnc(N2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 920869883 CGUDBJZJFCZCPA-SFHVURJKSA-N 425.533 2.315 10 20 IECD C[C@@H](NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)c1ccc(N2CCOCC2)cc1 920882152 UBVWMLGTLQMGPU-OAHLLOKOSA-N 440.456 2.034 10 20 IECD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccn1 1801469560 XEWRQGHJVUHBTG-FIIQBIKZSA-N 445.903 2.153 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cn[nH]c1 1818232679 ZSXNEXKYOMXSLQ-SFHVURJKSA-N 446.471 2.232 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3ncccc3F)sc2C1)c1cc(O)nc(O)c1 1820920910 RSLBINLLTFFHCQ-JTQLQIEISA-N 429.433 2.023 10 20 IECD CC(F)(F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898606 RSXBLFPCRJXKBZ-ZDUSSCGKSA-N 433.546 2.122 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)C1CCC1 1834357943 KZBOMOYXOOKDBG-FNORWQNLSA-N 443.544 2.188 10 20 IECD CC(C)(C)n1ncc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1Cl 1842258089 LEKJTWYEURBTDO-UHFFFAOYSA-N 433.896 2.229 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2cccnc2)C1 1843092959 NTJVBFYDZSJPKW-UHFFFAOYSA-N 431.496 2.011 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc3ccoc3c2)C1 1845629845 VCUIUJUNXKFIKQ-UHFFFAOYSA-N 429.523 2.110 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 19181974 AFCIYYGPBRAVOO-UHFFFAOYSA-N 429.429 2.247 10 20 IECD Cc1cc(C(=O)CN2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(OC(F)(F)F)cc1 730806259 NDNKBJRNQPSAHE-UHFFFAOYSA-N 438.450 2.278 10 20 IECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1 732575577 FHOVCLVOQNGZKW-GOSISDBHSA-N 437.544 2.295 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)c1O 737286322 VDFLEGYEJFQMOW-UHFFFAOYSA-N 445.431 2.456 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 741375865 AYNFAGYYMZSRRP-QFIPXVFZSA-N 425.529 2.155 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(OC(F)F)c3)CC2)cc1 743432450 MTXUTBQVMZVPQM-UHFFFAOYSA-N 448.470 2.174 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1=O 744877902 KRIBYWFQQQOYAF-OAQYLSRUSA-N 440.519 2.387 10 20 IECD Cc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1 745692246 SVYSFTNAPKVLLW-DENIHFKCSA-N 449.555 2.301 10 20 IECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 746281012 WBVQBAASEOSYTE-LJQANCHMSA-N 444.536 2.352 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1-c1cccc(Cl)c1 748061213 YFSWPNWHYQXMEN-UHFFFAOYSA-N 425.938 2.139 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751938376 ZHFPRVXPSABHNC-UHFFFAOYSA-N 443.485 2.022 10 20 IECD O=C(CN1CCC(Cn2ccnn2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753217951 LDOOZXSLDMKLBK-UHFFFAOYSA-N 429.480 2.404 10 20 IECD COc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5sccc5n34)CC2)cc1F 753856758 HHLLTNKRRMZTET-UHFFFAOYSA-N 428.493 2.113 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)CC2)cc1 754070491 YUZZTBHJQXRLKE-FPOVZHCZSA-N 448.608 2.119 10 20 IECD CC(C)c1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 756084978 STTNEXBVIHYHBS-HNNXBMFYSA-N 429.546 2.223 10 20 IECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 756937193 UYSQSEKEAMQTJV-RSQQPWMTSA-N 446.523 2.025 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(-c4ccccn4)n3C)CC2)cc1 758225227 XWVABQLMOBGGOM-GOSISDBHSA-N 440.573 2.161 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])cc3C(C)=O)CC2)cc1 758234379 YKHNVXQINWYFSI-LJQANCHMSA-N 429.473 2.368 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N(c1ccc(F)cc1)[C@@H]1C=CS(=O)(=O)C1 759596089 MCPJIKGOEWBNFY-CRTCLFFXSA-N 447.440 2.137 10 20 IECD CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN1CCOC 766772337 QBBSIVNVPDSBEK-IFMALSPDSA-N 445.608 2.031 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 768656388 QZHFKWZCZRDNSG-KCVNTPOGSA-N 427.545 2.221 10 20 IECD O=C(CS(=O)(=O)Cc1cccc(Br)c1)NCCc1ccc(O)c(O)c1 768904510 ZXRWZWBRUKZJJQ-UHFFFAOYSA-N 428.304 2.134 10 20 IECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 769320680 UHPBIEQLKJCMDR-PZJWPPBQSA-N 432.584 2.475 10 20 IECD CC[C@@H](C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)N1CCO[C@H](CC)C1 773734522 SCLLJHVXTFTGEJ-GGAORHGYSA-N 432.609 2.213 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)c1O 774823310 STSUNZHFXBBDKN-UHFFFAOYSA-N 443.428 2.094 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3ccco3)N3CCCC3)CC2)cc1 774865071 GJQKEJKQOICVOT-OAQYLSRUSA-N 440.544 2.327 10 20 IECD COc1ccccc1[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCCC1 774915795 FEGZGPGMKPYANB-NRFANRHFSA-N 442.535 2.470 10 20 IECD Cc1sc2ncc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c(=O)n2c1C 775665630 GXCRFTLWOWZGJC-INIZCTEOSA-N 439.541 2.005 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)cc([N+](=O)[O-])cc3C)cc2)CC1 786120849 VBDPXNULUSJYSC-UHFFFAOYSA-N 446.529 2.359 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)Cc3cccc(C)c3)CC2)cc1 786226312 GYSJPGDRPSTBMU-QFIPXVFZSA-N 440.588 2.419 10 20 IECD CC(C)Oc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786843361 ZXCDEBLSYWVVQM-UHFFFAOYSA-N 429.492 2.382 10 20 IECD CN(C)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 786898339 KVHMCLJAMDFRGG-UHFFFAOYSA-N 449.599 2.217 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934321 VVGSTWLVWJJBGB-LJQANCHMSA-N 430.549 2.419 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@H]1C 789950320 OCQVEXVXKSFTKO-RDTXWAMCSA-N 443.466 2.042 10 20 IECD CS(=O)(=O)C1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 793999221 RTTGCEHCIQDVPI-RAXLEYEMSA-N 444.625 2.423 10 20 IECD CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795360979 RZICTGOSSYPIQO-KRWDZBQOSA-N 437.512 2.305 10 20 IECD Cc1cc(-c2nnc(N3CCN(c4cnn(C)c4)C(=O)C3)n2C)c(C)n1-c1ccccc1 800768896 ISNPRQUCYTYNIQ-UHFFFAOYSA-N 430.516 2.476 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(N2CCOCC2)cc1 803303249 JGYTZEVYHZYBKG-PKOBYXMFSA-N 447.601 2.261 10 20 IECD CC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCCO1 803450664 NUOLXWQUYUQRQL-MSOLQXFVSA-N 425.476 2.447 10 20 IECD Cc1cnc(COCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 803899463 HQGBFBGFYDBFAI-IYBDPMFKSA-N 449.479 2.112 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)cc1 804754972 HERVWDMXUPSZDB-UHFFFAOYSA-N 432.565 2.474 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3nc(C)c(C)s3)cc2F)CC1 805009029 DQUOPSDHCCAAGT-UHFFFAOYSA-N 447.580 2.016 10 20 IECD COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 808034075 HXBXCXNYFJFCAE-IAGOWNOFSA-N 443.500 2.497 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)O[C@@](C)(c4ccccc4)C3=O)CC2)cc1 809210199 SBPYFZSEVCWICD-YKSBVNFPSA-N 439.512 2.072 10 20 IECD CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 815612450 NAZWVZGTXCBTIH-ZDUSSCGKSA-N 430.457 2.107 10 20 IECD O=C(CN1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1)NCc1ccccc1 916587909 LRBKVMIWHFORKW-UHFFFAOYSA-N 435.572 2.430 10 20 IECD C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 919046322 YJQTWGPEEIJHCM-ZDUSSCGKSA-N 436.424 2.170 10 20 IECD CC(C)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CCC1 1777851450 JUAPRELOTJJUGQ-VGOFRKELSA-N 431.533 2.447 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)n3)C2)C1 1779491070 VNWJEMNYRIXNBG-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(/C=C/c1cccnc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004328 BPSYABXUZFFULN-SIAOZKNOSA-N 443.887 2.303 10 20 IECD CCc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004442 FGFTYZXYPXYEDH-JOCHJYFZSA-N 445.903 2.466 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1 1784075669 QTNNZZVJEBNDDC-FJNPEDAXSA-N 433.263 2.119 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@H]1C[C@@]1(F)Cl 1791372601 BJTWNWXCTJNGQS-SITOJSDFSA-N 447.290 2.269 10 20 IECD CC(C)(C)c1ccc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cn1 1840988518 BHJCTQGGTPWRJD-UHFFFAOYSA-N 446.598 2.056 10 20 IECD Cc1cc(C)nc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1843163673 WCPTUTIOJOQNBZ-UHFFFAOYSA-N 431.496 2.308 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(F)c1 737156701 CXABCAQBIQEPHE-AWEZNQCLSA-N 429.448 2.265 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 743760484 PHMZKWOPJPLUSN-UHFFFAOYSA-N 435.458 2.356 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCN(Cc2ccccc2)C1=O 744878441 WKNBAMFIBZWBCO-QHCPKHFHSA-N 436.556 2.496 10 20 IECD COC(=O)c1cc(OC)c(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 749107654 ZVZGVNHSSQSPAV-UHFFFAOYSA-N 440.543 2.453 10 20 IECD CCOC(=O)CN(CC(N)=O)C(=O)c1cc(C)n(-c2ccccc2Br)c1C 749585763 YKAJQIPXFWWMBX-UHFFFAOYSA-N 436.306 2.347 10 20 IECD COC(=O)COc1ccccc1[C@@H](C)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753660834 BOTAKBXDRMKNRG-QGZVFWFLSA-N 432.542 2.324 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@]4(CCc5ccccc54)C3)CC2)cc1 754071347 PXXVEVWZNOGTKT-BVAGGSTKSA-N 437.584 2.352 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](C)S(=O)(=O)CC3)cc2F)C[C@@H](C)O1 758399888 PLEFUEGWKGSYGJ-XHSDSOJGSA-N 427.542 2.158 10 20 IECD O=C1[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCN1Cc1ccccn1 761732678 BEXHGTDZDIGXIA-KRWDZBQOSA-N 428.876 2.396 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(CN2CCOC2=O)cc1 765926659 OQXQJTZOEDUQSK-UHFFFAOYSA-N 448.273 2.362 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 765977903 KJHDNZFGYYKNNX-RDPSFJRHSA-N 443.613 2.301 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@]3(CO)CCc4ccccc43)cc2F)C[C@@H](C)O1 766249177 HOOMNSSATNQHRQ-GAKIBJFNSA-N 441.547 2.479 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 774210588 ACMNHZMXWPAZLX-JTQLQIEISA-N 441.893 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](c3cccs3)N(C)C)CC2)cc1 778226461 SCWHBBXFUIVESS-JPMGXVIASA-N 442.585 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@@H](C)C3CCN(C)CC3)CC2)cc1 778411419 RSYRMUAOWWHRMK-VJIACCKLSA-N 428.577 2.089 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CO)c3c(F)cccc3F)CC2)cc1 778423726 VUMQSCQORPHGML-SQUSKLHYSA-N 445.466 2.028 10 20 IECD CC[C@@]1(CO)CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 784474309 HQOUEZPDMKXFRP-QHCPKHFHSA-N 442.539 2.389 10 20 IECD CC(C)Oc1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1C(N)=O 789554057 REYJNCYWHHYAPA-UHFFFAOYSA-N 425.485 2.412 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CN1CCCCC1 789828273 WUQWRKBCOOBHKS-GBESFXJTSA-N 448.583 2.294 10 20 IECD CCCN(CCCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789835025 MXTXXJSLPNVQEV-ROUUACIJSA-N 436.572 2.246 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCO[C@@]2(CCSC2)C1 789862933 YSJVKAKJCWTPSL-UWJYYQICSA-N 435.615 2.027 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C)c(Br)s2)ccc1O 790406080 BWDGSEKTXFQBHX-UHFFFAOYSA-N 441.350 2.234 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1 793936650 LLYSJMUKWIWYQN-INIZCTEOSA-N 447.557 2.306 10 20 IECD CCOC(=O)[C@]1(COC)CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 799158905 AWKFCJQRSLGYJG-XMMPIXPASA-N 448.560 2.219 10 20 IECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 799252598 CIXZJOHZUQFERD-UHFFFAOYSA-N 428.445 2.085 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 803242629 YLDIOWSVKCZZDT-HNNXBMFYSA-N 443.013 2.369 10 20 IECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)n2C 803299074 ICRQCKGNFIQDJS-QGZVFWFLSA-N 435.528 2.212 10 20 IECD CC(C)(O)[C@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450820 SAQOWHWEWWSJFC-QGZVFWFLSA-N 425.476 2.135 10 20 IECD COCCn1cc(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cn1 803677952 VVDQEACDAHONRI-UHFFFAOYSA-N 427.549 2.231 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1F 803704071 RMIRSDITCLJBBE-UHFFFAOYSA-N 449.548 2.149 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)c3cc(C)cc(C)c3)CC2)cc1 803753477 ZLSDCNPFKZKTBF-FQEVSTJZSA-N 438.572 2.428 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccsc3)CC2)cc(OC)c1OC 804078466 JHVQKHIOOGCZRV-CQSZACIVSA-N 433.530 2.300 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3csc([C@H](C)OC)n3)CC2)cc1 804317105 RYODHNGGTXBWRU-AWEZNQCLSA-N 432.546 2.261 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccccc2F)C1=O 806215499 CTXCSKLAXHPIDE-IBGZPJMESA-N 426.492 2.162 10 20 IECD C[C@@](O)(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 807498062 VZOOJEJRWDTPAP-GBXCKJPGSA-N 426.513 2.314 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ncccc3N(C)C)CC2)cc(OC)c1OC 811934248 ZMSQWJSQCJZGGP-UHFFFAOYSA-N 429.521 2.205 10 20 IECD C[C@@H]1CCCN(c2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccn2)C1 812476423 BUCDDGKTUSYPFP-GOSISDBHSA-N 442.585 2.483 10 20 IECD COCC(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918205252 KHGVQVXBVZPPER-UHFFFAOYSA-N 430.480 2.247 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284563 JKTKOXTZZJRRSH-UHFFFAOYSA-N 429.448 2.012 10 20 IECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1C[C@@H](C)C[C@@H](C)C1 920636304 QRTUKXXGTGPUNG-IYOUNJFTSA-N 426.535 2.450 10 20 IECD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cccs1 1782473659 READKNMVTJGITP-UZSYQUHHSA-N 445.541 2.486 10 20 IECD Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991223 OCKPSYYJKMCUNS-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993511 IZZDCFRVDYUWEA-DJUHHCJWSA-N 426.448 2.100 10 20 IECD CCOCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1816881744 FPDDSJZIGAITRM-GOSISDBHSA-N 438.488 2.231 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cscn2)CC1 1827125746 VOUQDTIYFORJCI-QGZVFWFLSA-N 430.530 2.425 10 20 IECD CO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717570 NHAYURQYPNCLLL-DYESRHJHSA-N 440.544 2.434 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CC[C@@H]2CNc3ccccc3C2)C1 1842955010 ABAZUQYQSIBNPI-INIZCTEOSA-N 436.512 2.374 10 20 IECD CCOc1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 729785463 HXQGMXHYIWPZHR-UHFFFAOYSA-N 431.464 2.325 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(S(=O)(=O)N(CC)CC)CC2)cc1F 731364483 OLKZCNWHSRTFGS-UHFFFAOYSA-N 443.589 2.086 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCCc4ccccc43)cc2)C1 731403165 DYXFTVAIAVMGTN-NBGIEHNGSA-N 436.556 2.412 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 735189720 CGAAGZANCCUOSY-HKBQPEDESA-N 443.569 2.437 10 20 IECD CN(CC(=O)N1CCN(Cc2ccsc2)CC1)Cc1ccc(N2CCOCC2)cc1 738297727 AHHMUUFOFSGLPJ-UHFFFAOYSA-N 428.602 2.361 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738888490 OVIQDYOIGMCMDV-UHFFFAOYSA-N 446.529 2.210 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 742244550 IIAPKLLPJQQOFM-UHFFFAOYSA-N 445.541 2.058 10 20 IECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 749255712 FNZLFEUSBSGTTD-GOSISDBHSA-N 445.541 2.044 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(c4ncccc4F)C3)cc2)C1 755309184 UDXMGXAOABAACZ-ZWKOTPCHSA-N 440.523 2.001 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 761055900 AXCFRSMGQFXWQO-UHFFFAOYSA-N 436.512 2.355 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCSC[C@@H]3c3nccs3)CC2)cc1 770710904 NLKPJHRZNQJJND-AZUAARDMSA-N 434.631 2.425 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccccc3)CC2)cc(OC)c1OC 774316663 DADAFPVARLKFPR-MRXNPFEDSA-N 427.501 2.238 10 20 IECD CCOC(=O)C[C@](C)(NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 776003670 XYGDZBGZFYJTGC-LCJITAHGSA-N 445.560 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(C(N)=O)c(Cl)c3)CC2)cc1 778269598 WJYJBEGRBIRGCI-CMDGGOBGSA-N 442.903 2.291 10 20 IECD O=S(=O)([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCc2ccccc21 779869313 MARAQXYKJIJRQJ-UTKZUKDTSA-N 430.526 2.175 10 20 IECD Cc1nc2c(s1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCC2 789800861 VXKDVFRBVSXDIF-KRWDZBQOSA-N 432.521 2.237 10 20 IECD CN(C)C[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789862478 TYQRSFNAIWCBIJ-OAQYLSRUSA-N 440.613 2.145 10 20 IECD CCC[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793730937 DMPWGRUMCDVJNR-CYFREDJKSA-N 428.577 2.433 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)cc2F)cc1 797431620 UMUGWXIUJUSRLB-UHFFFAOYSA-N 438.300 2.265 10 20 IECD O=C(NCCCOC(F)F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 800999919 IRDMMCXEOAHNPG-UHFFFAOYSA-N 438.454 2.371 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)cc2)CC1 805024668 LDQSUBGDSSTCRJ-PMACEKPBSA-N 428.577 2.302 10 20 IECD O=C(Nc1cccc2c1CNC2=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806919480 RFLOFRALEWNBMO-CYBMUJFWSA-N 444.438 2.255 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)CCCOCc3ccccc3)cc2)C1 809810608 FVQALIGSWFNZRV-OAQYLSRUSA-N 445.585 2.415 10 20 IECD CC(C)S(=O)(=O)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919601672 WVHDGIHDOZALQA-ZDUSSCGKSA-N 443.477 2.155 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1F)NCc1ccc(N2CCC(CO)CC2)cc1 919969464 YUHCOPXEOFZYKI-UHFFFAOYSA-N 449.548 2.019 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cc(OCC(F)F)ccn3)CC2)cc1 1116566120 PRHMRGFIEFHIJF-UHFFFAOYSA-N 449.502 2.356 10 20 IECD Nc1nc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)ccc2s1 1796107318 PBZBFNKNJLUNHP-BTTYYORXSA-N 439.497 2.250 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994397 WCDHDUKQBLEPSI-XHDPSFHLSA-N 442.369 2.108 10 20 IECD C/C=C/C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808470902 ZVHHUYLAUMCENW-DUDWFQMESA-N 431.496 2.456 10 20 IECD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccn1 1827067400 VKBJTOGQBFKEGV-YPMHNXCESA-N 439.497 2.374 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccno1)CC2 1828194895 ARWQBFUFIIMIPZ-SZHMKSFOSA-N 442.453 2.187 10 20 IECD Cn1cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898576 QCUIJWJUFHIVJX-MRXNPFEDSA-N 448.614 2.119 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)COc2ccc(Cl)c(F)c2)C1 1841566916 SSBBVOHQRJQOQP-UHFFFAOYSA-N 435.839 2.181 10 20 IECD O=C(c1sccc1F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441099 MKGGVORHTXDYAH-UHFFFAOYSA-N 426.473 2.497 10 20 IECD O=C(c1c(F)ccc(O)c1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039500 WZDIQEFQRYVFDT-XVNBXDOJSA-N 446.406 2.318 10 20 IECD COc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 18953531 HMYGALDROCOANC-UHFFFAOYSA-N 431.445 2.493 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCN([C@@H]4CCS(=O)(=O)C4)CC3)c2C)cc1 216004928 YUVYRSPLCDBSQW-OAQYLSRUSA-N 429.586 2.390 10 20 IECD CC(=O)N(CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1ccccc1 726143449 CXCVLCWJIHTONF-JOCHJYFZSA-N 436.556 2.443 10 20 IECD Cc1noc([C@@H](C)NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 726235471 CIISLNFSSKKZEN-CQSZACIVSA-N 440.483 2.194 10 20 IECD CNC(=O)C1(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCC1 730047996 RHBZZLMGIXHWCQ-CYBMUJFWSA-N 434.448 2.249 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CCCO)CC(F)(F)F)cc2F)C[C@@H](C)O1 731214013 OMTFHPJGFVBUGC-HUUCEWRRSA-N 435.462 2.302 10 20 IECD CN(CC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1)Cc1ccccc1O 731843419 FADJKBKMIJLGDQ-UHFFFAOYSA-N 431.558 2.315 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 734403095 VWCUCGXQMCDNDR-UHFFFAOYSA-N 445.585 2.331 10 20 IECD NS(=O)(=O)c1ccc(F)c(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 734526842 VWBMFVRRZMQFHQ-UHFFFAOYSA-N 438.550 2.026 10 20 IECD CN(c1ccc(CNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1)C1CCCCC1 742591114 YFOZXQQVIZOHBK-CZAYHTPWSA-N 425.529 2.234 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](CNC(=O)OC(C)(C)C)C3)CC2)cc1 754026768 YAMKNAIEXZDCGO-FPOVZHCZSA-N 448.608 2.025 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C(=O)NC(C)C)cc3)CC2)cc1F 754214130 ZCPXVQGDHRFQFD-UHFFFAOYSA-N 442.491 2.260 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(Cc1ccccc1O)C1CCCC1 759706702 QPAWKJPAUPVRTL-UHFFFAOYSA-N 433.530 2.432 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](NC(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 760658688 VWBGEMFNIUZEBZ-RVKKMQEKSA-N 433.528 2.185 10 20 IECD COc1cc(Cl)cc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 761207864 VIMNDKODFFMUPT-KRWDZBQOSA-N 433.940 2.439 10 20 IECD COc1cc(Cl)cc(CNc2cc(C(N)=O)ccc2CN2C(=O)CN(C)C2=O)c1O 761215865 MTVOWZJRAHZHDA-UHFFFAOYSA-N 432.864 2.159 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2cccc(Br)c2O)cc1 765737257 SOCAGXYQIMNNES-UHFFFAOYSA-N 429.292 2.267 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2 767772421 HTWJPFFHJBLYEM-INIZCTEOSA-N 427.457 2.224 10 20 IECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)c3cc(OC)ccc3OC)CC2)c1 768200622 OVCTWOJFBQUSFP-UHFFFAOYSA-N 436.530 2.315 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cnc(C2CC2)nc1 769024697 POSKSJHZIQVANP-UHFFFAOYSA-N 434.544 2.141 10 20 IECD COc1ccccc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nccn1C 769647855 RTIVUJFTJDOFFI-GOSISDBHSA-N 430.486 2.025 10 20 IECD COCC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccco1 781041631 KENBTEJGMSGYIN-GDCKJWNLSA-N 427.501 2.387 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cn(C)nc3C(F)(F)F)CC2)cc1 782808123 YNVJHBLZOLAILL-UHFFFAOYSA-N 426.443 2.391 10 20 IECD C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309210 CWWQNGSLLDIIEL-NMEJYPJZSA-N 443.569 2.096 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1CCC(O)(c2ccccc2)CC1 788317922 BCDVVZZCNCWCHS-UHFFFAOYSA-N 437.540 2.086 10 20 IECD COC[C@H](Cc1ccccc1)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 789456205 OHODQZJWBGDWQL-NRFANRHFSA-N 429.536 2.468 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 789811726 GONNFJKWOUALNY-OAQYLSRUSA-N 445.466 2.018 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)CN3CCCC3)cc2F)C[C@H](C)O1 789819455 MZQQAEMTHZFMQP-ROUUACIJSA-N 448.583 2.294 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](OCC4CC4)C3)cc2F)C[C@@H](C)O1 789837552 ZMKVXEQJKGXIEM-HLIPFELVSA-N 447.551 2.473 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCc2ccccn2)Cc2ccncc2)c1 798091671 PYCMXRFFJYHURU-UHFFFAOYSA-N 426.498 2.439 10 20 IECD CN1CCC(CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803449501 ZPASAWARQSOKJA-UHFFFAOYSA-N 438.519 2.173 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3CCN(CC(F)(F)F)CC3)ccc21 803687219 YBTWEHGYVLAISI-UHFFFAOYSA-N 426.483 2.076 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C(=O)NC(C)(C)C)CC3)cc2)CC1 805025467 SCAOJHNPDPQGLK-UHFFFAOYSA-N 443.592 2.191 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cc(Cl)ccc1N1CCOCC1 807103540 RPRBWQKKUGJDTP-UHFFFAOYSA-N 444.963 2.484 10 20 IECD CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 807121343 CNKODNAJZVQDMI-SFTDATJTSA-N 429.517 2.185 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1 808344520 XBYWSJAXGOASEK-XZOQPEGZSA-N 442.604 2.129 10 20 IECD CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)c1cc(NS(C)(=O)=O)ccc1O 816866773 XGEZDDHYEJUPEH-MRXNPFEDSA-N 439.534 2.283 10 20 IECD COc1ccc(N2CCN(CC(=O)N3CCC(C(=O)N4CCC[C@H](C)C4)CC3)CC2)cc1 916984922 SDHPCYCZHCKODW-FQEVSTJZSA-N 442.604 2.314 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917911546 FYKIDTGSBJTXNI-UHFFFAOYSA-N 426.585 2.122 10 20 IECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1NC(C)=O 918309529 AETDDOZWTGHSBH-UHFFFAOYSA-N 440.500 2.087 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 1320365655 NVNYGFQTROCFQG-UHFFFAOYSA-N 432.565 2.287 10 20 IECD CC(C)n1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782007662 VWTJLOMAHXCFJX-OAQYLSRUSA-N 448.907 2.286 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2SC=C[C@H]21)C1=NN(c2ccccc2)C(=O)C1 1801321386 YWZNDUDMUKLKKK-LYWMGSQXSA-N 436.537 2.293 10 20 IECD CC(C)n1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827427127 GTEQTZKVKVPORT-QGZVFWFLSA-N 442.520 2.212 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(N2CCOCC2)nc1 9736669 UREADDLKTJXSKA-UHFFFAOYSA-N 425.533 2.096 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@@H](C)NC(=O)C3CCCC3)CC2)cc1 727099916 JSVREQQVQHNYCI-LJQANCHMSA-N 430.593 2.409 10 20 IECD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 728207845 VMMJIPYHONBRMP-MRXNPFEDSA-N 435.528 2.206 10 20 IECD CCc1ccc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1S(=O)(=O)N1CCOCC1 728979196 ZNVQXIGISZWRJS-HNNXBMFYSA-N 448.541 2.475 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)cc2F)CC1 730194583 MDXCRKLWDKXIPH-OALUTQOASA-N 444.551 2.149 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)o1 730932802 PLRGTHXLPPSJOU-UHFFFAOYSA-N 442.496 2.394 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2cc(OC)ccc2O)(c2ccccc2)CC1 734015217 AWNMMAXQSOBSCG-UHFFFAOYSA-N 432.542 2.401 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 734654522 ACYRRIAWJVRZON-UHFFFAOYSA-N 449.533 2.284 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1C 745937197 FSCAIXUTIUMAEL-KBPBESRZSA-N 439.509 2.043 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)C[C@H](C)O1 747011734 JSZAIMGNOOYZBC-GJZGRUSLSA-N 429.496 2.155 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 751384191 AFPGPLLIBVBJCY-WOJBJXKFSA-N 430.593 2.218 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)N(CC)Cc2ccc(N(C)C)cc2)cc1 752656153 BWSWXLWNTYYHQD-UHFFFAOYSA-N 447.557 2.256 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NC(=O)Nc1ccc2c(c1)OCCCO2 759596962 XLFFDQCVTINAFD-CLTKARDFSA-N 428.397 2.164 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccc(Cl)cn3)cc2)C1 760831094 KSPXCTAHWDJFBW-INIZCTEOSA-N 431.924 2.315 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1C(=O)c2ccccc2C1=O 769894172 MSNGMHCAYMUDHH-QGZVFWFLSA-N 448.523 2.079 10 20 IECD CN(C)C1CCN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2F)CC1 774362616 NUIZFKVOXDATFG-UHFFFAOYSA-N 444.507 2.065 10 20 IECD C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)C[C@H](C)O1 774362872 GPZQPRNBQXKDJX-HOTGVXAUSA-N 427.501 2.004 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2cc(Br)cc(C)c2O)CC1 775675816 DVAMEIQJXWXREM-OAHLLOKOSA-N 428.371 2.122 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccc3)C[C@H](C)O)CC2)cc1 778288464 DOAZKMHTLAFOMJ-CBUFDYBVSA-N 437.540 2.310 10 20 IECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 786311582 HSBUOLWXYIUSMI-UHFFFAOYSA-N 427.505 2.088 10 20 IECD CCO[C@@H](C)c1nc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788317969 BSCGJBQCBOGSLK-INIZCTEOSA-N 446.573 2.352 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1 788974216 AYVNGFNAMOJGPN-UXHICEINSA-N 428.577 2.446 10 20 IECD CON(C)C(=O)c1cc(F)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 789681372 GWOZQEWPQYFTSC-UHFFFAOYSA-N 448.470 2.163 10 20 IECD CC(C)CCN1CCC(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789810531 AVCWAXKYOOJEGG-UHFFFAOYSA-N 448.583 2.153 10 20 IECD CCC(O)(CC)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950768 QFCWZCDWMPHZHT-UHFFFAOYSA-N 445.482 2.216 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H](CO)CC1CCC1 792842828 VBMHZEFUIJACGO-IBGZPJMESA-N 442.539 2.293 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3(S(C)(=O)=O)CC3)c2C)cc1 795872478 NSPAFVZAYUORIB-UHFFFAOYSA-N 433.482 2.184 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(N)=O)n3)cc2Cl)C1 800636031 DMTKEWYZQNFOJA-ZDUSSCGKSA-N 429.908 2.325 10 20 IECD COCCO[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 801968269 XRHXQOOEPNFLKM-JOCHJYFZSA-N 434.581 2.044 10 20 IECD CN(C)c1ncc(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1C 803678173 ZWFSEXJWBRAFFP-UHFFFAOYSA-N 426.565 2.188 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C)c3nc(C)cs3)cc2F)CC1 805007214 HSCYAHIKYOMPCS-HNNXBMFYSA-N 447.580 2.269 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(c4ncccc4F)CC3)cc2)CC1 805023688 KFSCQSQGCSFKJA-UHFFFAOYSA-N 439.535 2.422 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 806288726 UVKOEOOAPARDJI-JTHBVZDNSA-N 437.540 2.376 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 807102889 IPGGSDCPODPWOV-QHCPKHFHSA-N 438.572 2.085 10 20 IECD O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1 810193652 VETKYRQMIGSICI-UHFFFAOYSA-N 439.537 2.271 10 20 IECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)c2nonc12 814380117 UBFMWSVFLQUZRD-UHFFFAOYSA-N 426.857 2.330 10 20 IECD CCOC(=O)N[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 916196564 MEONVWYWHRGYCD-LJQANCHMSA-N 447.580 2.127 10 20 IECD CCCC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919620520 WSUBMMWTRRPUBY-HXUWFJFHSA-N 449.523 2.003 10 20 IECD Cc1cnc(O)n1-c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 919985459 FCZFVDYUVSKUDS-UHFFFAOYSA-N 440.525 2.051 10 20 IECD CS(=O)(=O)c1ccc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc1 1326377501 KLTWEWGELBCIED-UHFFFAOYSA-N 442.520 2.353 10 20 IECD Cc1cccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)[nH]c12 1778451315 XSAKIXAJKJPRTM-QHCPKHFHSA-N 436.468 2.040 10 20 IECD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)n1cccc1C=O 1809994192 RRFFTCWGWDEVAI-INIZCTEOSA-N 440.500 2.213 10 20 IECD O=C(/C=C/c1ccco1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722146 SOCXFWUEHTUMBJ-FUEXJSSKSA-N 426.454 2.482 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3[nH]ncc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845348 KTTZATMFDWDZRM-HNNXBMFYSA-N 448.443 2.107 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@H]1F)CC2 1828197728 HJHKAYAOSSJVFX-YCNNUGCDSA-N 433.461 2.243 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(F)F)C3)C2)cc1 1839348612 ZCYJCVBVRRNSNU-QHCPKHFHSA-N 447.482 2.429 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3cc(F)c(F)cc3[nH]2)C1 1844011228 MBPMDAPZSLIJSW-UHFFFAOYSA-N 428.395 2.383 10 20 IECD COc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccc1O 1847038371 OVMVMWSKVWSOOF-VMPITWQZSA-N 440.452 2.048 10 20 IECD CCc1cc(N2CCC(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)ncn1 566934772 SFAGOQBIPUSGBA-UHFFFAOYSA-N 434.544 2.241 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(C)c1 726728548 VCTRKWMLAYRRPD-UHFFFAOYSA-N 438.528 2.477 10 20 IECD COC(=O)Cn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)cnc21 731565923 KWSNYOOQNPQSJL-UHFFFAOYSA-N 433.468 2.365 10 20 IECD C[C@@H]1CN(Cc2ccccc2)CCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 732214105 MPMDIPLRCXNGKJ-HXUWFJFHSA-N 440.563 2.485 10 20 IECD C[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)N1CCN(C)CC1 742749124 CVQGIDPDVHQYCW-FXAWDEMLSA-N 433.597 2.071 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 747555670 YKWCVLYVUWELHB-IBGZPJMESA-N 436.512 2.392 10 20 IECD CCn1c(N)c(C(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)c(O)nc1=O 747595116 ZRAHBINLEQDIFG-UHFFFAOYSA-N 442.497 2.273 10 20 IECD COC(=O)c1cccc(CS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751228461 RPGVGNNPYYLKMC-UHFFFAOYSA-N 436.505 2.193 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCCCC(=O)O)c(F)c2)cc1 751269824 JIXSVCHVKNFFQA-UHFFFAOYSA-N 446.478 2.242 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(Cn2cc(Br)cn2)on1 751692392 LJYPKEOGLKCNFF-UHFFFAOYSA-N 446.305 2.449 10 20 IECD NC(=O)CS(=O)(=O)c1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 754421649 XWSHVSRVVKIGTN-UHFFFAOYSA-N 428.466 2.087 10 20 IECD CCCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 756084999 TUQAOFLXMKWHLC-OAHLLOKOSA-N 429.546 2.052 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1 756411914 RAPYMVDRRKRNPD-INIZCTEOSA-N 448.541 2.192 10 20 IECD CS(=O)(=O)c1cccc(Cl)c1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 758309342 BLRGFHQUUPRWLD-UHFFFAOYSA-N 442.990 2.268 10 20 IECD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 768213884 VTOSJEVFBXEQJD-BGYRXZFFSA-N 432.584 2.284 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)COCC(=O)NCc1cccnc1 769290280 IZGBWTSNCFNTPH-UHFFFAOYSA-N 436.306 2.231 10 20 IECD C[C@@H](O)C[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770088393 IHYYAYZFAZRBIL-HIFRSBDPSA-N 449.485 2.477 10 20 IECD COc1ccc(NC(C)=O)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772904269 OXSPTZJWWHFEKZ-UHFFFAOYSA-N 430.480 2.358 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C(N)=O)n(-c2ccccc2)n1 777828261 LPBOVCJCYOBOAY-UHFFFAOYSA-N 442.859 2.146 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3nc4ccccc4n3C)CC2)cc1 778268742 IBXSJZYUDUQQLU-SEYXRHQNSA-N 447.539 2.445 10 20 IECD C[C@H](NC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(N2CCOCC2)cc1 779503482 QBPAHCOZQYHRTF-KPOBHBOGSA-N 427.526 2.405 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@]2(C)CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 781287022 BAKWXHWIEMTCHZ-NRFANRHFSA-N 434.514 2.284 10 20 IECD O=C(COC(=O)c1ccc2ncc(I)n2c1)c1ccc(O)c(O)c1 783998306 OJMJACKYNCEYPY-UHFFFAOYSA-N 438.177 2.390 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@@H](C)C4(CCC4)C3)CC2)cc1 785529070 UUCVIHYJPGQVJC-HXUWFJFHSA-N 442.604 2.362 10 20 IECD CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 785758320 CUWULBNNHJKJQZ-UHFFFAOYSA-N 443.475 2.402 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)c1ccc(N2CCOCC2)cc1 787639430 OWHFURHBYNKHKY-VGOFRKELSA-N 442.535 2.259 10 20 IECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(=O)(=O)CC)cc1OC 790410896 FKTXBOIKYCNNRS-UHFFFAOYSA-N 430.504 2.362 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)N3CCC[C@@H](C)C3)CC2)cc1 793909181 LTMIPGHIZSRRQB-GOSISDBHSA-N 430.593 2.407 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@]2(CCc3ccccc32)C1)c1ccc(N2CCOCC2)cc1 803301160 NFBSZRWMTCMUSC-AFMDSPMNSA-N 449.551 2.401 10 20 IECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449010 LEBPIVBUAIHXAN-HNAYVOBHSA-N 439.503 2.383 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@H]1CN(C)CCO1 807956709 ROKOOEUSAJRFGY-GQIGUUNPSA-N 436.984 2.028 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1NC(=O)C1CC1 815065691 LJUOBYSXJCEPHD-UHFFFAOYSA-N 427.526 2.200 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CC)CC(=O)Nc3ccccc3OC)nc12 917015082 LUTODQZKDGZNMR-UHFFFAOYSA-N 427.461 2.081 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccc(I)cc2)C(=O)NC1=S 920974514 ONGYGCJNLMIUKF-KPKJPENVSA-N 429.283 2.486 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1n[nH]cc1I 1321255832 XEQRKAIYSWPZHQ-UHFFFAOYSA-N 426.258 2.123 10 20 IECD O=C(Nc1c(Cl)ccc2nonc12)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 1324856540 CJPIEFJXZSQDNF-UHFFFAOYSA-N 440.840 2.289 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1C[C@@]1(F)Cl 1796935111 WPELSKYJBYISPQ-UOYAZOMKSA-N 432.883 2.342 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cc[nH]n1 1815372192 QKMRPVIERTZROI-GOSISDBHSA-N 446.471 2.232 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3c(F)cncc3F)sc2C1)c1cc(O)nc(O)c1 1820793481 MCRCPAJYXSRFJT-VIFPVBQESA-N 447.423 2.162 10 20 IECD Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1824297402 ZMYFJPHCOHBXNP-LJQANCHMSA-N 441.532 2.011 10 20 IECD CO[C@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccc1 1842790180 ONIWOADRAMXAOM-CRWWQRIJSA-N 438.480 2.408 10 20 IECD Cn1ncc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1Cl 1845501679 PHKMTQUMNQGETJ-UHFFFAOYSA-N 425.272 2.269 10 20 IECD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056282 ZOFQFKXBYXACJI-CQSZACIVSA-N 449.573 2.068 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 727170409 OVANQXQDVRTPFQ-UHFFFAOYSA-N 434.514 2.271 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@@H](NC(N)=O)c3ccccc3)cc2F)CC1 730235635 JMEZVWZVBWYJLF-HXUWFJFHSA-N 427.524 2.384 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc1F 746975343 DIHNPNLFDCGOBO-UHFFFAOYSA-N 428.464 2.288 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)CCn2cc(S(N)(=O)=O)cn2)c1C 749326667 XCZWWBJKHJCHSD-UHFFFAOYSA-N 444.513 2.063 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 749652777 GRWGKJJRJCXLSK-UHFFFAOYSA-N 442.541 2.469 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1F 755158290 OSQAPBGKXTYOBP-FVCZOJIISA-N 428.508 2.278 10 20 IECD CCc1nccn1CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 756923594 WYKZLORWAYDPOS-MHWRWJLKSA-N 444.538 2.192 10 20 IECD Cc1c(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)cnn1C 757438954 SRAUXKGJJKFTNV-UHFFFAOYSA-N 431.430 2.395 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3Cc4ccccc4C(=O)O3)CC2)cc(OC)c1OC 759240486 YCAXIWMBQUGRGZ-HXUWFJFHSA-N 426.469 2.143 10 20 IECD C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@@]1=O 760661386 QZNJMUFOBCNIAT-QDXKXIGTSA-N 428.557 2.238 10 20 IECD CCC[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCN1CCOC 766772347 QBBSIVNVPDSBEK-UNMCSNQZSA-N 445.608 2.031 10 20 IECD COc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OCC(N)=O 768911106 BZGYEOPJASVILR-QGZVFWFLSA-N 447.919 2.313 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OC)c(OC)c1 773844866 DCWNPGKDKNFGGX-CYBMUJFWSA-N 429.473 2.372 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOCC4(CCCC4)C3)CC2)cc1 775431419 YCMMUMWAFGTTOW-CMDGGOBGSA-N 427.545 2.319 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](O)(c4ccc(F)cc4)C3)cc2)C1 777720087 DQAYCFLPFFQSRM-HOYKHHGWSA-N 440.519 2.331 10 20 IECD CCc1ccc([C@H](COC)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 789833546 GRKYPSACGBQBNR-IBGZPJMESA-N 447.507 2.062 10 20 IECD Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842219 BVEKAQHYRVTWPO-HXUWFJFHSA-N 443.523 2.107 10 20 IECD COc1ccccc1CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843371 JQDDZIACRHPPKO-UHFFFAOYSA-N 429.492 2.070 10 20 IECD CCS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793716316 BZDQWBSMHQBINS-WSTZPKSXSA-N 446.617 2.185 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N2CCOCC2)cc1 793743775 RQLODLGYHMBZSR-HSZRJFAPSA-N 438.572 2.209 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 803302085 GWKVVUYAVHPTGG-KRWDZBQOSA-N 441.528 2.376 10 20 IECD COc1ccccc1N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803422989 BYWKXRAFDSUGHU-UHFFFAOYSA-N 428.508 2.302 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(N2CCOCC2)c1 803685148 AIYMPDVTRALCKH-UHFFFAOYSA-N 436.556 2.147 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)Oc3cccc(OC)c3)CC2)cc1 804318872 UVZKPBUIFANFML-QGZVFWFLSA-N 441.528 2.373 10 20 IECD CCN1CCO[C@@H](C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 805473114 KGIKSJXYCWPLDA-JLTOFOAXSA-N 436.464 2.053 10 20 IECD CCN1CCN(S(=O)(=O)c2cccc(NCc3cc(OC)c(OC)cc3O)c2)CC1 809682296 KHPYODIBEDJHEY-UHFFFAOYSA-N 435.546 2.348 10 20 IECD C[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 810109718 FKVICUIVNPKWSO-QLFBSQMISA-N 440.521 2.296 10 20 IECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 916645014 LFLVFEIYQCPNIK-LJQANCHMSA-N 445.585 2.210 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 920881989 UGDCCFKYSUIMGZ-GKVSMKOHSA-N 448.523 2.094 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)C1CCCCC1)CCO2 1785509187 UTCYFRNNEWRCQQ-WCYCAPIHSA-N 430.501 2.227 10 20 IECD CN(C)C(=O)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3O)cc2)CCC1 1792301576 RAVOKODKRDOEMI-VZUCSPMQSA-N 439.468 2.039 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1CCCCO1 1794023825 UCPNBUAEESEETP-XNZHWBCHSA-N 430.501 2.414 10 20 IECD CCc1[nH]nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816256093 IPPNABYSVIAGLR-ZDUSSCGKSA-N 443.439 2.260 10 20 IECD Nc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)s1 1826993783 BXLYNFZIFJLKIP-AWEZNQCLSA-N 431.518 2.079 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)s1 1842019157 AXLKSTRZWQBSAX-UHFFFAOYSA-N 437.612 2.053 10 20 IECD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502211 AJBQOYGGPGOZJX-GJZGRUSLSA-N 448.903 2.324 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc3ccoc3cn2)C1 1845579054 CCNNGLDMZXBFOU-UHFFFAOYSA-N 443.463 2.438 10 20 IECD CC(C)(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cn1 1847050850 KDCGGIRZFJUILL-UHFFFAOYSA-N 446.598 2.056 10 20 IECD COc1cccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1848154956 BAZXCQUDVTVWLH-HOTGVXAUSA-N 431.876 2.213 10 20 IECD CN(C)c1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1 15134367 CUTYPSZCKKJWHO-UHFFFAOYSA-N 437.949 2.357 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2Br)cc1 327319108 ZBRHMRSSWREOPA-UHFFFAOYSA-N 449.304 2.320 10 20 IECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 525239012 OONMUSLSWCMCKC-NSHDSACASA-N 434.499 2.174 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(NC(C)=O)ccc3OC)CC2)cc1 726726922 XMZISIXPKOFUEG-UHFFFAOYSA-N 440.500 2.386 10 20 IECD C[C@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NC(=O)C1CCCCC1 727371306 IBKILBGNEWZCOH-QGZVFWFLSA-N 435.590 2.013 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 729793507 QYNRCXCORLKFHQ-FUHWJXTLSA-N 448.541 2.294 10 20 IECD COCCNC(=O)Cn1cc(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cn1 741738075 SQKGBMHTEPCEEK-UHFFFAOYSA-N 425.489 2.314 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nnn(-c4cccc(C)c4)c3C)CC2)cc1 742917228 UKAZBMXVJIIOEL-UHFFFAOYSA-N 434.544 2.445 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](N2CCNC2=O)C1 744200477 KRYIVGFPVQMRHW-HOTGVXAUSA-N 446.507 2.279 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 745141318 PUHMPGXRHSWPMB-UHFFFAOYSA-N 447.557 2.007 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\c3cc(OC)c(O)c(OC)c3)nc12 745509991 CPKKUIKYILGEPO-WAYWQWQTSA-N 443.412 2.091 10 20 IECD COC(=O)c1c(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[nH]c(C(C)=O)c1C 746011454 XFHGGNZTZQKDIC-UHFFFAOYSA-N 445.491 2.271 10 20 IECD CC(C)(CCO)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 746290767 RRRKNXUCHLQSTR-UHFFFAOYSA-N 437.474 2.240 10 20 IECD Cc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 746355467 YMAIDJPEEUDHCQ-UHFFFAOYSA-N 441.463 2.063 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3c(C)nc(O)nc3SC)CC2)cc1 747350250 OWCCEQUORSIEJB-UHFFFAOYSA-N 431.562 2.163 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 749655576 SLKZPGNHZIJMGY-UHFFFAOYSA-N 442.541 2.469 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC(F)(F)F)C3)cc2F)C[C@@H](C)O1 753078050 KYUHWDJQGDGLSF-CHWSQXEVSA-N 432.418 2.313 10 20 IECD CN(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc2c(c1)CCCN2C 753596603 KMNZPQAZQJXKMO-QFIPXVFZSA-N 437.588 2.157 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2cc3c(cc2Br)OCCO3)ccc1O 757653656 CEMYRNQRRJGVGX-UHFFFAOYSA-N 430.232 2.425 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C)c(=O)c4ccccc34)CC2)cc1 757873041 GMBLJQGWVMRDDP-UHFFFAOYSA-N 434.540 2.489 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccccc2Cn2cncn2)cc1 758412155 UDIHHHOXINOMQA-UHFFFAOYSA-N 437.529 2.438 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(F)c3F)CC2)cc(OC)c1OC 759410048 OIHWESNRAJGJGY-UHFFFAOYSA-N 435.427 2.278 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2O)c(OC)c1 761287763 DCTHRLCZFYBNOU-UHFFFAOYSA-N 428.532 2.373 10 20 IECD CNC(=O)c1cccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 768521892 KZFKRVXNKUCCTL-IYBDPMFKSA-N 429.492 2.494 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4c[nH]c5ncccc45)n3)CC2)cc1 771067759 OSYIYZHDCWRCDN-UHFFFAOYSA-N 432.484 2.437 10 20 IECD COC(=O)c1cncc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 773592461 JPMUJTIMHYHYFZ-UHFFFAOYSA-N 444.399 2.439 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Oc4ncccc4F)CC3)CC2)cc1 773984007 NEVWTRYUAFNEBP-HXUWFJFHSA-N 444.551 2.256 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3ccc(OCCO)c(OC)c3)CC2)cc1 775190619 ARJZVZFFKSJLPN-SFHVURJKSA-N 443.544 2.074 10 20 IECD COC(=O)C1(c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)CC1 776302392 NGKPRJMHUWPXTO-UHFFFAOYSA-N 448.516 2.345 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1 776865071 NLVLFWHFVUETGL-UHFFFAOYSA-N 428.484 2.061 10 20 IECD Cc1nc(O)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1Br 778542973 NCARWFFHEWAKJB-AWEZNQCLSA-N 447.333 2.490 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)c2)CC1 781048539 XWUPPNBONHNBDQ-UHFFFAOYSA-N 444.557 2.294 10 20 IECD O=C(C1CCCC1)N1CCC[C@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 781523654 ONXPRQGXKNFSBA-NRFANRHFSA-N 435.590 2.124 10 20 IECD CN1CCN(C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c2ccccc2)CC1 787737271 ONIVQCXPPHPFRT-XMMPIXPASA-N 449.599 2.008 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnc1Br 788434122 MKGGUUSMEODPPO-AWEZNQCLSA-N 447.333 2.484 10 20 IECD COc1ccc(O)c(CNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1 789013174 MOMFQQNFBIRGGV-GOSISDBHSA-N 445.491 2.057 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H](c2ccsc2)O1 789813316 SXIPRUYFHCZKIN-FOIQADDNSA-N 447.532 2.329 10 20 IECD O=C(NCC[C@H]1CCCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950339 OKGDFYFCENQQLP-QGZVFWFLSA-N 443.466 2.234 10 20 IECD C[C@@H](COc1ccc(F)cc1F)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793798790 LUUGLKMWEAXADL-INIZCTEOSA-N 447.482 2.344 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)c1ccc(N2CCOCC2)cc1 803296780 HEKHKRGERGBHGL-VGSWGCGISA-N 442.535 2.259 10 20 IECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308093 AFEXDSHRDPAGGH-IERDGZPVSA-N 439.512 2.349 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1Oc1ccccc1 803665216 ZCPAALYRTHBTHL-TYPHKJRUSA-N 429.492 2.249 10 20 IECD CCCN(Cc1ccccc1)C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803751017 PWNIXUHSCLXTEC-UHFFFAOYSA-N 438.572 2.372 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805166839 PZBIXEYBDUGNAN-HNNXBMFYSA-N 436.459 2.337 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@@H]3c3nc(C)no3)CC2)cc1 806620347 TWXDWLMJGLYTPO-HXUWFJFHSA-N 428.537 2.445 10 20 IECD COCCn1cc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cn1 807954571 VXUAHRJGHGHWCG-INIZCTEOSA-N 447.967 2.352 10 20 IECD C[C@@H](OC(=O)c1cc2n(n1)CCO2)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 811350033 DHJSAILMTRFHPZ-GFCCVEGCSA-N 431.404 2.235 10 20 IECD CCC[C@H](C)C(=O)NCCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 814431331 JOFIGXUTZDDXQQ-INIZCTEOSA-N 436.553 2.096 10 20 IECD O=C(COC(=O)c1cnn2cccnc12)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 883992855 LRRXZKMUUVMKPU-UHFFFAOYSA-N 426.388 2.300 10 20 IECD COc1cc(CNCc2ccc(N3CCSCC3)cc2)cc(OC)c1OCC(N)=O 916835754 YIHQGEOIOKYRER-UHFFFAOYSA-N 431.558 2.411 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)CC1 917618780 GNOQPLRLSNKORI-MRXNPFEDSA-N 447.532 2.412 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)s2)cc1OC 917758153 JZTRVUDJCUPOPI-UHFFFAOYSA-N 434.517 2.106 10 20 IECD CCN1CCN(CCCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 918208201 MPUGNGJVWZEBDZ-UHFFFAOYSA-N 431.625 2.112 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 918437512 ITSOACNJKPDLQA-UHFFFAOYSA-N 436.541 2.384 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1C[C@H]1C1CC1 1783946162 YFXHLQKXLULPAC-AFFGTUGMSA-N 434.920 2.391 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccc(F)cn1 1786215929 XYMQSXSCMXDYJX-MIUNTBIASA-N 449.866 2.192 10 20 IECD CCN(C)[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791020231 KCQMFRVXSHZHTD-CQSZACIVSA-N 448.614 2.321 10 20 IECD CSCC[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1802365957 JNJKKJXHBOLSON-XFMPKHEZSA-N 428.938 2.117 10 20 IECD CC1(C(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)COC1 1805028183 OGLFRPHRIYBWSZ-UHFFFAOYSA-N 438.528 2.047 10 20 IECD Cc1nccn1CCCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846574942 DUKVNHXFPZVGPH-SOFGYWHQSA-N 440.500 2.005 10 20 IECD C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N(C)C1CC1 727860614 OBPAGFFJNACGKA-ZDUSSCGKSA-N 448.501 2.314 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 729324898 KTEHDTHDPLCTDC-VXGBXAGGSA-N 427.523 2.078 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)Nc1ccc2c(c1)OCO2 731844174 AJJKIDOUTFWWCD-KRWDZBQOSA-N 427.457 2.450 10 20 IECD CCN1CCN(c2ccc(CNC(=O)COc3cc(OC)ccc3C=O)cc2F)CC1 734435424 QJCQGHPJPLBHFF-UHFFFAOYSA-N 429.492 2.484 10 20 IECD O=C(Cc1ccc(NC(=O)C2CC2)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742561559 UWDPLBKCTOKUCW-UHFFFAOYSA-N 441.553 2.129 10 20 IECD CCCOc1ccccc1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743433166 XTUITPZFQWFVPR-UHFFFAOYSA-N 440.544 2.361 10 20 IECD COc1ccc(N(CC(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)CC(C)C)cc1 744395725 WNYXEXLUAROUAI-PZJWPPBQSA-N 438.590 2.352 10 20 IECD CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405961 LPIWSNVSTTXMOA-HSZRJFAPSA-N 425.504 2.376 10 20 IECD NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 752285614 CIEDHLCZVDUPNG-UHFFFAOYSA-N 445.875 2.032 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccn(CC(F)F)n3)cc2F)C[C@H](C)O1 754924098 VNONMZOCEINRHH-STQMWFEESA-N 439.438 2.156 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)c1O 759009757 MMXOGGJEGIWODT-UHFFFAOYSA-N 446.467 2.086 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 761065271 JXHYRJNBFUOKIW-UHFFFAOYSA-N 446.507 2.357 10 20 IECD C[C@@H](CCN1CCN(C)CC1)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 770345643 QVLQUEFUAMIFFO-GBESFXJTSA-N 435.588 2.265 10 20 IECD C[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1C(=O)NC2(CCCC2)C1=O 771055737 DDZPGBPYYVZSIB-PBHICJAKSA-N 448.951 2.379 10 20 IECD CN1CCN(c2ccc(CN3CCN(C(=O)COc4ccc(F)cc4)CC3)cc2)CC1 775649063 JRVSPTPSASXSQC-UHFFFAOYSA-N 426.536 2.301 10 20 IECD COc1cc(OC)cc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)c1 775650014 WYDGWHBNVYDQMB-UHFFFAOYSA-N 438.572 2.414 10 20 IECD CC(C)(O)C(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 777444996 DFOJXMVJJVSARR-UHFFFAOYSA-N 437.474 2.381 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)Nc1nc(-c2ccc(CNC(C)=O)o2)cs1 777666505 HMRMIEHYVYXKLT-UHFFFAOYSA-N 442.500 2.083 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](C4CCOCC4)C3)CC2)cc1 778396260 XQYZTZRXJNZGST-PXDRNWIDSA-N 427.545 2.175 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@@H](C)C3)cc2)CC1 787320161 SJPZHSFCVSQQJU-YDHSSHFGSA-N 430.593 2.105 10 20 IECD C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787905050 VGCBMVFUIVAAPD-GOSISDBHSA-N 448.583 2.174 10 20 IECD C[C@@H]1COc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797694 CVEZYRYNXJRDAI-MRXNPFEDSA-N 427.476 2.088 10 20 IECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789820967 RIIOKGGIDATESW-XEYPJELSSA-N 446.567 2.141 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@H](N2CCCC2=O)C1 790205297 ZOYMSSGSVDYTRC-KRWDZBQOSA-N 440.466 2.448 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 802610445 ADCIEYWXECSOMT-GOSISDBHSA-N 437.496 2.365 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308528 GKEGPAPKXPIDRF-DLBZAZTESA-N 448.564 2.072 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@@H]([C@H]3CCCO3)C2)cc1)C1CCCCC1 803677355 NEHHDJURRXYNRW-FGZHOGPDSA-N 429.561 2.478 10 20 IECD Cc1noc(C)c1CO[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686617 OJXKIEIPKCIHCS-LJQANCHMSA-N 426.517 2.108 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(c4nnc5n4CCCC5)CC3)ccc21 803687195 XCIOVTMCJDSFMW-UHFFFAOYSA-N 436.560 2.019 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)OC4(CCOCC4)C3)cc2)CC1 805024282 RBFDDKLFAPDKEC-LJQANCHMSA-N 429.561 2.336 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccnc3OCC(F)F)CC2)cc1 809633654 QRXALECLEPCGLK-UHFFFAOYSA-N 448.470 2.089 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cncn3Cc3ccccc3)nc12 811327410 UGFAMRFJPGQRNP-UHFFFAOYSA-N 435.440 2.142 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1N(C)C 918465272 JXVFAJLDMLHSGY-SFHVURJKSA-N 437.544 2.018 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1341962093 COZCERHHWYHWBV-QFIPXVFZSA-N 426.517 2.145 10 20 IECD O=C(COc1cccnn1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429645 QTELALIUDSXERH-UHFFFAOYSA-N 435.440 2.110 10 20 IECD Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604276 YJYVXXZQCZZZKN-MUJYYYPQSA-N 439.447 2.154 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)c3ccsc3)C2)CC1 1808109098 RGKVTMDYZNHIJW-UHFFFAOYSA-N 437.612 2.453 10 20 IECD C[C@@H](Nc1cccnc1)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809781057 ZJELVADPWPYPKW-MRXNPFEDSA-N 439.516 2.233 10 20 IECD Cn1ncnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816303630 YVUDZCDEFRTLNG-CYBMUJFWSA-N 445.867 2.223 10 20 IECD O=C1CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)N1 1816970238 BUCCZLJUJNVUCM-JSGCOSHPSA-N 447.879 2.059 10 20 IECD Cc1nc(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)o1 1817846218 KYYCOOMBZWOWOP-CQSZACIVSA-N 426.433 2.440 10 20 IECD O=C1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)N1 1821293466 LWWSHJXJWHIJHW-OCCSQVGLSA-N 447.879 2.059 10 20 IECD Cc1nnc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)s1 1827150485 XTTNYVUUWQKPJW-INIZCTEOSA-N 445.545 2.129 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1827428489 RAQYIRFSRSNUBX-GHTZIAJQSA-N 447.532 2.314 10 20 IECD CCC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717336 BAVJPBILDLIRLL-FQEVSTJZSA-N 438.528 2.378 10 20 IECD O=C(c1ncc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877105 VAUWMKXLAILXJY-UABRLCRWSA-N 440.500 2.473 10 20 IECD O=C(c1ccc2cccnc2n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037083 BXSXKSJDMSTJCF-RMKNXTFCSA-N 446.463 2.277 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 108427527 GAMKKCYIOUWFMT-UHFFFAOYSA-N 431.558 2.275 10 20 IECD COC(=O)CNC(=O)Cc1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 542923832 JZTUWZOGYJZEFL-UHFFFAOYSA-N 426.473 2.015 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(CC(C)(C)O)CC1 728054614 UDTCEIDPNUEMCD-MRXNPFEDSA-N 435.524 2.178 10 20 IECD C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 729601070 ZPVQVNMRTCMQEN-OYRHEFFESA-N 429.609 2.223 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1F 731408089 FALJWXILZQHXMV-UHFFFAOYSA-N 443.458 2.350 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1N1CCOC1=O 743900096 AMKVMIURHCJJFK-UHFFFAOYSA-N 438.484 2.289 10 20 IECD Cc1cc(C(=O)CN(CCO)Cc2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 746409672 KKZQVZBTQUABDS-UHFFFAOYSA-N 441.553 2.419 10 20 IECD C[C@@H](N1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1)C(F)(F)F 749555581 QGEWFWWFAGHGSF-WBVHZDCISA-N 441.498 2.166 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)C2 752302546 MQLBAVHURDURFA-OAHLLOKOSA-N 431.492 2.391 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCCC[C@H]3N3CCOCC3)cc2F)CC1 763658721 XMKPCKNYIJFQMT-JTHBVZDNSA-N 447.599 2.410 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765928320 XQIPCMHQDSJOBV-UHFFFAOYSA-N 425.210 2.335 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(F)c(S(C)(=O)=O)c3)c2)CC1 769848221 MTSLCTCQGYSUMG-UHFFFAOYSA-N 441.550 2.172 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)CCNC(=O)OCc1ccccc1 771720455 BCKMTCSRAOLHOC-UHFFFAOYSA-N 447.557 2.211 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 773744419 RHRFVBCHLVTWSL-LFPIHBKWSA-N 435.480 2.287 10 20 IECD CCO[C@H](C)c1noc(CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)n1 775725351 MRDGMNUKSVPHHL-LJQANCHMSA-N 428.581 2.237 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(Cn4cncn4)cc3)CC2)cc1 778229820 AUHQWPSOOWKMHM-ZHACJKMWSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3CCN(CC(C)C)CC3)CC2)cc1 778250084 PGNFFKOHDJIJSS-CMDGGOBGSA-N 428.577 2.137 10 20 IECD O=C(CN1CCCN(C(=O)C2CC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781932298 OCCUQZDDMBTEOS-UHFFFAOYSA-N 431.492 2.345 10 20 IECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2cncn2)cc1 785398759 ONKWZNGIONSWFT-UWJYYQICSA-N 449.511 2.358 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccsc1)N(C)C)c1ccc(N2CCOCC2)cc1 787655242 QXTQJJMRBZJCFR-OXJNMPFZSA-N 430.574 2.181 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 787734241 APOWUEJEWCILOJ-INIZCTEOSA-N 432.571 2.221 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](c3ccnn3C)C(C)C)CC2)cc1 788539728 VOUVKVVQGZBEDF-LCCNJJIFSA-N 439.560 2.190 10 20 IECD Cc1nccn1CCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822935 BRHJPUNGUFSREK-CALCHBBNSA-N 445.539 2.157 10 20 IECD C[C@@H](OC(=O)COCc1ccnn1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792486638 BGJOQTBOPQADLF-CQSZACIVSA-N 447.447 2.283 10 20 IECD COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 797535673 NDYSCSFQUAGAJE-UHFFFAOYSA-N 427.240 2.489 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1OC 799119260 CCZWNTJZNXNKCD-UHFFFAOYSA-N 448.906 2.308 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C(C)(C)N3CCCC3)cc2F)C[C@@H](C)O1 805608909 JXLNPNKGIADYTA-CALCHBBNSA-N 435.540 2.473 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F 810351776 UGMHMYNGUMLKMQ-UHFFFAOYSA-N 434.443 2.093 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC[C@@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc1 813562632 AEHKLBPUOVDGDE-MZLICYQSSA-N 430.593 2.448 10 20 IECD CN(C)CCn1nccc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 818937237 GZTHFBUMMRYMGE-UHFFFAOYSA-N 435.531 2.265 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(F)c(N(C)C)cc2F)C1=O 864043927 QMUDRYPKKWOPGC-UHFFFAOYSA-N 431.443 2.136 10 20 IECD CCN(C(=O)[C@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 914613211 KZJOZDZGYOYBGK-DLBZAZTESA-N 433.530 2.070 10 20 IECD CN(C)c1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)cc1 915828235 PZDMYYIGENNVCR-UHFFFAOYSA-N 445.541 2.168 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc4c(c3)OCCO4)CC2)cc1 915894043 AOHSFFWGXFUNGO-UHFFFAOYSA-N 440.544 2.478 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)OCC(=O)NCc3ccc(S(C)(=O)=O)cc3)sc2n1 918993178 VUHDZFRVRXWWLS-UHFFFAOYSA-N 447.538 2.372 10 20 IECD CC[S@@](=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919033610 RNVSVBAWWOIXOX-WJOKGBTCSA-N 448.516 2.263 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(CCN2CCCC2)cc1 920194600 AVXZVSYCMQZUCA-UHFFFAOYSA-N 436.556 2.416 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1(O)Cc2ccccc2C1 1339771633 LIYSVZMAVFORBW-UHFFFAOYSA-N 447.514 2.088 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=COCCC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246325 XFRMFUWGNMZVQA-QITLCBANSA-N 436.892 2.039 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1C[C@@]1(F)Cl 1791372599 BJTWNWXCTJNGQS-FBBNDSKNSA-N 447.290 2.269 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1C(F)(F)F)c1cc(O)nc(O)c1 1798913468 IXGMTEMRNHCYNH-CLLJXQQHSA-N 436.390 2.472 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccccn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994118 RODSMMVMHJZTAG-GAJHUEQPSA-N 447.495 2.235 10 20 IECD Cc1ccc(O)c(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1843442349 CTEIHNHTKVQURT-UHFFFAOYSA-N 432.480 2.311 10 20 IECD CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1Cl 1847038569 DMMDLWGPGPMJGS-FNORWQNLSA-N 446.891 2.273 10 20 IECD COc1ccc(N2CCCN(CC(=O)N(CCC(N)=O)c3ccc(F)cc3)CC2)cc1 108092350 HAIWSHCDJHYVAM-UHFFFAOYSA-N 428.508 2.255 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)nc21 726567385 JVBKGIDWSPWKIE-UHFFFAOYSA-N 446.458 2.388 10 20 IECD O=C1OCc2c1cccc2S(=O)(=O)Nc1nc(-c2cccc(-n3cnnn3)c2)cs1 727251203 OVBAJHVSAXCCEB-UHFFFAOYSA-N 440.466 2.257 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 732061469 LEICRCGISPHRTA-KRWDZBQOSA-N 444.513 2.414 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)c1 734073323 FZBIIYFWIZBETG-GFCCVEGCSA-N 426.429 2.487 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(C(=O)NC2CC2)c1 738889929 XOYDPTQDSLAJJA-UHFFFAOYSA-N 442.541 2.135 10 20 IECD O=C1CCc2cc(OC[C@H](O)CNC(=O)NCc3ccc(N4CC=CC4)cc3)ccc2N1 741090964 SOLLXBDCVKMOPR-HXUWFJFHSA-N 436.512 2.187 10 20 IECD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCN1C 743638602 RXTCWYODOKZLNO-KGLIPLIRSA-N 448.501 2.314 10 20 IECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743719404 WZSUTKVGCSXLOP-UHFFFAOYSA-N 430.526 2.063 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c(OC)c(OC)c1 743906210 KGPLODDPHAIGLI-NSHDSACASA-N 432.429 2.021 10 20 IECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)c(OCC(=O)N(C)C)c1 749730056 HRSPQNPYMQOCDN-UHFFFAOYSA-N 436.559 2.156 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 749730387 NZHVBGYTGUPXGH-UHFFFAOYSA-N 448.570 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1F 753740008 XSPUQRULUNADBE-KRWDZBQOSA-N 425.460 2.002 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3c(C)nn(CC)c3C)cc2F)CC1 754490666 OGNFIGZNLRIWOW-UHFFFAOYSA-N 430.528 2.056 10 20 IECD CCc1cnc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 756153770 KOOXTZCXCPHYTC-UHFFFAOYSA-N 434.518 2.019 10 20 IECD Cc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)ncn1 757921453 XCIULPDWJJCGRI-UHFFFAOYSA-N 443.441 2.130 10 20 IECD CCCC1(CCC)NC(=O)N(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1=O 758198284 NQIZLZMUQFLVAX-IBGZPJMESA-N 432.565 2.069 10 20 IECD O=C1CCc2cc(OC[C@H](O)CNC(=O)NCCCSc3nccs3)ccc2N1 759589707 FWJCKPNZWSIJMW-CQSZACIVSA-N 436.559 2.249 10 20 IECD CN(C)c1ccc(CN(C(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)C2CC2)cc1 759699693 CNMKDQGPFRSMGG-UHFFFAOYSA-N 429.542 2.252 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 761569328 OLIRYENTSXZIJR-UHFFFAOYSA-N 448.516 2.361 10 20 IECD CCc1ncc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 763601494 RMEMOAGMERACGS-UHFFFAOYSA-N 427.548 2.242 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)Nc1ccc(O)cc1C(C)=O 766047343 LUTAVZODKJMHPX-UHFFFAOYSA-N 428.488 2.166 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@@H]2CCC[C@H]2O)CC1 769157651 XZBBIITVJYLISC-DHIUTWEWSA-N 430.593 2.072 10 20 IECD CN(Cc1nccn1C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 775419110 FXMIXMIGRKLLMP-UHFFFAOYSA-N 438.511 2.017 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1 776056972 RAYWGLGPKHGANQ-UHFFFAOYSA-N 431.342 2.069 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnc(OCC(F)(F)F)c1 776491550 BEHBMQPGGAYLRK-UHFFFAOYSA-N 438.406 2.114 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)n1nnc(-c2ccccc2)n1 777829410 WNZNWGWDCMPMJM-CYBMUJFWSA-N 429.864 2.462 10 20 IECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781453825 PIKJRHPOWNDFDN-UHFFFAOYSA-N 429.448 2.094 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(OC)c1 782105459 SHUUODSUMUQROI-QGZVFWFLSA-N 442.468 2.334 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1F 782984317 TWILLNQZTDOHKB-MRXNPFEDSA-N 435.521 2.323 10 20 IECD COc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 787869385 DBDRFEMJEQZJRT-GOSISDBHSA-N 425.529 2.286 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cc(Br)cs1 788312228 DXLACEVGPDOMTG-UHFFFAOYSA-N 438.347 2.280 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCN2CCCC[C@@H]12 790293087 SVCNVBMDBRJUGA-OALUTQOASA-N 436.503 2.116 10 20 IECD CN(C)c1noc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 793853524 QWEATCRBZZXFIR-XFXZXTDPSA-N 437.572 2.495 10 20 IECD COc1ccccc1C1(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 804117897 IBMATOMCSGWHEU-UHFFFAOYSA-N 437.540 2.338 10 20 IECD COC(=O)C[C@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 805819578 UVWHVBAARQVCBG-IBGZPJMESA-N 428.485 2.327 10 20 IECD CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 806501963 NEILDFCFEICHPX-XYJFISCASA-N 438.519 2.362 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3c(C)cc(C)nc3OC)CC2)cc1 806642585 RVWTZSDVZWHBMD-SSEXGKCCSA-N 431.558 2.313 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(C(=O)CCC2CCCC2)CC1 807290959 QWBZJXYJASSVEK-UHFFFAOYSA-N 438.572 2.320 10 20 IECD CC[C@@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1c(C)nn(C)c1C 807770473 PPNVZUXDNBKCAN-HXUWFJFHSA-N 427.549 2.352 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN4c5ccccc5C[C@@H]4C3)CC2)cc1 810050678 LLHWNUBBKZUNKF-DNQXCXABSA-N 436.600 2.315 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(C)nn(C)c4c3)CC2)cc1F 812972839 PCJDUPBXRUFKEW-UHFFFAOYSA-N 425.464 2.317 10 20 IECD CCN(CC)c1ccc(CNC(=O)N(C)CCOc2ccc(S(N)(=O)=O)cc2)cc1 814283106 BDBFHQJEWVPDCN-UHFFFAOYSA-N 434.562 2.401 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1 916234832 TWSZWWKUQBIPIY-UHFFFAOYSA-N 437.588 2.345 10 20 IECD CCc1cc2c(=O)n(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc2s1 917195851 RRRKZDCGDWRGOA-UHFFFAOYSA-N 430.505 2.313 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 918309959 HVGXUCRRPNANJF-UHFFFAOYSA-N 434.500 2.009 10 20 IECD O=C(CCc1cccnc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002015 PVCUNXJDIZCBJC-JOCHJYFZSA-N 445.903 2.223 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2 1782007825 QGLHTOTVKKNLJA-KXBFYZLASA-N 426.922 2.090 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1795004019 VIVKRUBGERIZTN-FNLKRUPLSA-N 431.496 2.435 10 20 IECD C[Si](C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)co1 1798413775 CVRCSOVWIIKGHD-MUJYYYPQSA-N 429.549 2.197 10 20 IECD Cc1cc(F)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804335701 FQFQQSMKZCPHSD-MUJYYYPQSA-N 435.546 2.246 10 20 IECD CC(=O)O[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C(C)C 1817845919 BYTZNKGEOKNAQD-DNVCBOLYSA-N 445.476 2.110 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cn2ccccc2n1 1818495628 KTLGEVIKVGIWBK-MRXNPFEDSA-N 447.455 2.483 10 20 IECD Cn1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)n1 1825745279 QKQWQAVLXSPCAA-MRXNPFEDSA-N 447.923 2.427 10 20 IECD Cc1csc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1833565128 PFPAATHABICOFY-UHFFFAOYSA-N 444.557 2.362 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)NC(=O)c3cccs3)CC2)cc1 28839854 BSBPPBACKCEGGU-KRWDZBQOSA-N 430.574 2.204 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 726566370 WTIZNQTVUHQERF-OAHLLOKOSA-N 445.532 2.435 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)cc1 727613994 GADMMXQXDSVQMU-UHFFFAOYSA-N 439.484 2.469 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ccc([N+](=O)[O-])cc3)CC2)cc1 731682049 PUAZMERFTYKGCY-UHFFFAOYSA-N 443.504 2.104 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C3)nc12 740880061 SDIJOGJVEOXOKO-CJNGLKHVSA-N 433.509 2.347 10 20 IECD O=S(=O)(NC[C@H]1CCCO1)c1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1 742710675 NYMTYQDLPHGLLH-JOCHJYFZSA-N 445.585 2.270 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCn4c(nnc4-c4ccccc4)C3)CC2)cc1 743875571 OGGKJKUQKFXHQD-UHFFFAOYSA-N 432.528 2.118 10 20 IECD CCN1CCCC[C@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 745084060 FPMGLYDXUBRVQK-FVJLSDCUSA-N 435.540 2.473 10 20 IECD COC(=O)c1ccsc1N1CC[C@@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)C1=O 746779391 HYGRGUQPLPTXBW-XHDPSFHLSA-N 433.486 2.415 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1S(=O)(=O)N1CCCCC1 748485274 FVBOHLCSLQRVRY-UHFFFAOYSA-N 431.514 2.130 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)Nc3nnc([C@H]4CCCO4)o3)cs2)cc1 751931514 QTPDMCRUIFOXIH-CQSZACIVSA-N 429.458 2.346 10 20 IECD COc1ccccc1N1CC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 757284001 BNFNBSDFFSEANJ-FQEVSTJZSA-N 438.528 2.479 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](c3ccccc3)c3nccn3C)CC2)cc1 758200485 ZGLVYPAYDUYBRP-ISKFKSNPSA-N 435.572 2.291 10 20 IECD CCC[C@H](C)N1C[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1=O 759222828 XRJAESGIQCPWPD-DLBZAZTESA-N 433.549 2.398 10 20 IECD CS(=O)(=O)c1ccc2ncnc(NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2c1 764786108 ZIULUMPARKPPQL-INIZCTEOSA-N 439.541 2.347 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC4(CCOCC4)CC3)cc2F)C[C@@H](C)O1 769229664 KLRREQWZZVWBRM-RTBURBONSA-N 449.567 2.327 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc([N+](=O)[O-])c1F 771734194 NWPXYJMUVZOUHO-UHFFFAOYSA-N 427.429 2.497 10 20 IECD COc1cc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1C 772634966 TVSYSBCCKFMGKR-GFCCVEGCSA-N 433.420 2.388 10 20 IECD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1C 772634967 TVSYSBCCKFMGKR-LBPRGKRZSA-N 433.420 2.388 10 20 IECD C[C@@H](NC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(N(C)C)cc1 773987534 FABJELYIDGGXIC-MRXNPFEDSA-N 447.557 2.460 10 20 IECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775259998 MIWCJVHHTGEGKS-FDDCHVKYSA-N 437.540 2.300 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)c1 777508305 XFCDJLMIAOPNQQ-OAHLLOKOSA-N 441.868 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCC(=O)OC(C)(C)C)CC2)cc1 778295875 WYUKLLJBWJRSMO-QXMHVHEDSA-N 431.533 2.138 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1 779648822 PPTJVQOWNUHPCB-IAGOWNOFSA-N 434.290 2.474 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3cnc4c(Cl)cccc4c3=O)CC2)cc1 781858331 VVDNQKQVDWPCQD-KRWDZBQOSA-N 428.920 2.242 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCNC(=O)c3ccsc3)cc2)CC1 786257125 XNFXKKREDIAYGS-UHFFFAOYSA-N 428.558 2.243 10 20 IECD O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1ccc(N2CCSCC2)cc1 787621786 ITYQQWIWPZVDDU-UHFFFAOYSA-N 438.597 2.031 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C2CCCCC2)CC1 788331218 HPSAEAPKDBJHMS-UHFFFAOYSA-N 428.577 2.053 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3CCC(NC(=O)C4CC4)CC3)cc2)C1 793133013 QRMVVXAGIFENOK-SYYJFZTOSA-N 426.561 2.090 10 20 IECD CN1C(=O)COc2cc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 799246154 PRTJNOWUOVTYHL-MRXNPFEDSA-N 437.500 2.065 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN3CCCc4ccccc43)CC2)cc1 804001587 XRVAFCXHCIIERR-UHFFFAOYSA-N 436.556 2.349 10 20 IECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 806181568 YEDMGARGCKSUAP-AEFFLSMTSA-N 427.501 2.277 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3c(C)cc(C)nc3OC)CC2)cc1 806642584 RVWTZSDVZWHBMD-PMERELPUSA-N 431.558 2.313 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2c(c1)C(=O)OC2 808934142 UDAQMEGHMRJVNS-UHFFFAOYSA-N 448.523 2.144 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 917365107 UZDFPKZFTPFPRP-IBGZPJMESA-N 432.542 2.495 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)N4CCCC4)CC3)cc2F)C[C@@H](C)O1 918223351 ZXHYBWUZZQHIGB-QZTJIDSGSA-N 447.555 2.482 10 20 IECD Cc1cc(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 918567887 IAPOXLMRZWFPMH-INIZCTEOSA-N 437.949 2.171 10 20 IECD O=C(COC(=O)[C@H]1COc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 918909896 IURGRCWXTBJCII-GOSISDBHSA-N 428.460 2.073 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)nn(Cc2ccccc2)c1N 1322082720 MZQBKENBCOGHPX-KRWDZBQOSA-N 438.484 2.137 10 20 IECD CC(=O)NCC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425419 OFVNJIRUNFXMBA-UHFFFAOYSA-N 440.500 2.403 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1C[C@]1(F)Cl 1796935108 WPELSKYJBYISPQ-GORYUYKASA-N 432.883 2.342 10 20 IECD CC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811797956 XNWHCMSWQFTGTD-RPVQJOFSSA-N 433.892 2.237 10 20 IECD O=C1CC(C(=O)N2CC[C@H](CNC(=O)C3(F)CC3)[C@@H]2c2cccnc2)=NN1c1ccccc1 1812457385 VTLDQDUHGSHNRC-UTKZUKDTSA-N 449.486 2.382 10 20 IECD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N(C)C)cc2)c1 28669536 XQNNABCZWQRXCM-UHFFFAOYSA-N 425.938 2.261 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1 728979119 YFJLQBZRZAIUCC-WFASDCNBSA-N 436.534 2.019 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)NCC1CCN(S(=O)(=O)C(F)F)CC1 732993856 QZNLKXMVSDJDKJ-UHFFFAOYSA-N 430.521 2.350 10 20 IECD O=C(CN(CCO)[C@H]1CCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 733995181 CQHAIYVNLZJKRH-QFIPXVFZSA-N 427.520 2.260 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c[nH]1 742334288 JEMLRPZMRNXMDO-LBPRGKRZSA-N 429.445 2.350 10 20 IECD O=C(CCc1nc(-c2nc[nH]n2)no1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799154 HMDFTNJMCXOXRC-GFCCVEGCSA-N 433.419 2.174 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 743363974 ZCGBGWIKPCTWAR-UHFFFAOYSA-N 443.504 2.233 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1nc2ccccc2n1C 751484724 ZXWMDTDALFSPHO-UHFFFAOYSA-N 425.508 2.297 10 20 IECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 753106770 JCJRKWLXQHPSCI-PVMFMXGYSA-N 445.589 2.316 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)Nc3cccc(C)c3)CC2)cc(OC)c1OC 759402627 REFAEQWLCJUWMK-UHFFFAOYSA-N 442.516 2.491 10 20 IECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)NCc1ccc(CN2CCOCC2)cc1 759588021 GZKIZKDBOGDRHP-UGAXZCSASA-N 440.496 2.191 10 20 IECD COC(=O)C1CCC(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 760110648 SUOYVBOOPZQGOD-UHFFFAOYSA-N 435.521 2.276 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 762441606 PNRDHGAFYQXVFJ-CYBMUJFWSA-N 425.411 2.098 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 767797635 WXIUIQWIBHDSBU-MRXNPFEDSA-N 437.949 2.396 10 20 IECD COc1ccc2c(c1)OC[C@H](NC(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 768049710 WCUJZZKNJYXVRK-RTBURBONSA-N 438.528 2.200 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)CC4(CCCC4)C3=O)cc2F)C[C@H](C)O1 768521260 GKSBQVJLWXRZRU-HOTGVXAUSA-N 431.508 2.375 10 20 IECD Cn1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C(C)(C)C)n1 768958370 GWZYUTQGTGTJGX-UHFFFAOYSA-N 432.496 2.167 10 20 IECD C[C@@H](NC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 772999147 ZOOYEHQKGJZSQL-PBHICJAKSA-N 428.455 2.437 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 781444219 UIYTULHBJOQEKT-UHFFFAOYSA-N 429.448 2.046 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1S(=O)(=O)N(C)C 786083724 TWUHNGNJQFEJJH-UHFFFAOYSA-N 447.557 2.088 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1 788320873 QLNUYNAWNAWVON-IBGZPJMESA-N 442.947 2.188 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC(c2cccnc2)CC1 789844211 QLBQJTHFFJXTBP-UHFFFAOYSA-N 440.519 2.204 10 20 IECD CC(C)[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1O)C(=O)N(C)Cc1nnc2n1CCC2 793247795 SWSGDHVNCLSCSJ-QGZVFWFLSA-N 436.900 2.264 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3nc(-c4cccs4)no3)CC2)cc1 796100071 PNILMBHZWJRDOD-GOSISDBHSA-N 443.573 2.422 10 20 IECD CC(C)N[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807768720 AKLYBORLSOLOFP-SJORKVTESA-N 438.519 2.362 10 20 IECD C[C@@H](c1cccnc1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854379 WLCDJGBERBNAOB-IBGZPJMESA-N 435.572 2.449 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 914804157 SIJJGNGKMSXOMA-SFHVURJKSA-N 443.544 2.068 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N4CCCCC4)cn3C)CC2)cc1 914838818 LEMLLXPSCLVIBJ-UHFFFAOYSA-N 446.573 2.171 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 916668024 ADFFTSUAFBBIRK-UHFFFAOYSA-N 446.573 2.467 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 918140381 MJLXHGHUYVOMMR-GASCZTMLSA-N 443.475 2.214 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1 918309966 IDBYQCXSCJTFSD-UHFFFAOYSA-N 436.512 2.247 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(N2CCNC2=O)c1 918438433 OLQVUFYCZNBZDX-UHFFFAOYSA-N 439.541 2.024 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919909973 DJUOOFXUCAEZPU-UHFFFAOYSA-N 444.557 2.080 10 20 IECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCCc1c[nH]c2ccccc12 920638079 RKFQQRMGOQJODW-ZDUSSCGKSA-N 445.497 2.149 10 20 IECD CC(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1780763159 JGSZJRGNXYZIEA-HSZRJFAPSA-N 425.485 2.374 10 20 IECD CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1)c1ccccc1 1787291522 GXJKUBSTGJTDPF-RNQOJCNYSA-N 439.512 2.280 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC1(c2ccc(NC(=O)Cn3nccn3)cc2)CCC1 1790580466 AOUNHYZIMRJFAH-YCRREMRBSA-N 449.467 2.242 10 20 IECD O=C(CCN1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827430066 AQCLCYYFXGDSMA-IBGZPJMESA-N 430.549 2.212 10 20 IECD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)o1 1836953747 VJKHYMGGNLGSGO-UHFFFAOYSA-N 429.473 2.320 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 1847607466 RIMAPZAIKOGCAO-DACLVMHWSA-N 429.423 2.390 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 12068981 DPCGQDRGPHOFRU-UHFFFAOYSA-N 434.518 2.094 10 20 IECD NC(=O)[C@@H]1Cc2ccccc2CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 15028118 TZUSIIXKGJJNCX-NRFANRHFSA-N 439.471 2.313 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 105177231 PVVVPSCKLHLTPK-UHFFFAOYSA-N 431.558 2.436 10 20 IECD COC(=O)CCNC(=O)c1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 541065646 RUJKJWBSCTVKDB-UHFFFAOYSA-N 426.473 2.476 10 20 IECD CC1(C)NC(=O)N(CCCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 726565133 BXBOQHPYOWJBDZ-UHFFFAOYSA-N 438.475 2.484 10 20 IECD COc1cccc2c1OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 728396754 YESKKMFXVLPLEN-MOPGFXCFSA-N 438.528 2.200 10 20 IECD Cc1c[nH]ccc1=NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 730593013 FVCWBDUWJFYZSY-UHFFFAOYSA-N 428.426 2.479 10 20 IECD COc1ccc(O)c(CNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c1 734019042 RQJBLQJUDYIOGI-UHFFFAOYSA-N 428.304 2.395 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3c(F)cccc3F)cc2)C1 734659904 IQQVLLFEYYUWFI-KXBFYZLASA-N 432.471 2.199 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN([C@@H]4CCCN(C)C4)CC3)cc2F)C[C@@H](C)O1 734660022 JMNKMWKDWQEFHR-SVFBPWRDSA-N 447.599 2.361 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 737118340 SERCUACDSQOZLN-UHFFFAOYSA-N 429.448 2.046 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(Cc2ccccc2)C1=O 744878213 SDJRPSWSBWXSAI-FQEVSTJZSA-N 426.492 2.263 10 20 IECD COC(=O)c1ccsc1N1CC[C@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)C1=O 746779378 HYGRGUQPLPTXBW-ABAIWWIYSA-N 433.486 2.415 10 20 IECD C[C@@](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)(C(N)=O)c1ccccc1 749395288 BYVZQTAXQQUYFB-VWLOTQADSA-N 427.460 2.391 10 20 IECD CCCN(CC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)Cc1ccccc1O 750872571 SFHWXIUNHCZBAI-UHFFFAOYSA-N 449.548 2.276 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1 752689276 QLDRGQAOBZEEAH-JTQLQIEISA-N 433.939 2.454 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc(Cl)cc4c3OCC4)nc12 755089365 GKOSHPHVLJLGCE-UHFFFAOYSA-N 431.832 2.486 10 20 IECD CCn1nc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C1CC1 759025354 FHAAECYYWVKHHT-UHFFFAOYSA-N 429.496 2.136 10 20 IECD COc1cc(N2CCN(CN3C(=O)N[C@](C)(C(C)(C)C)C3=O)CC2)cc(OC)c1OC 773322904 SUKXIKFWYHMNDU-QFIPXVFZSA-N 434.537 2.149 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(N2CCCCC2)CCCCC1 774809394 IKJQRSWFBAZMPC-UHFFFAOYSA-N 442.604 2.444 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)N[C@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 775656159 YAFOXANXHBUOPO-BRWVUGGUSA-N 428.537 2.468 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cccc(N4CCCC4=O)c3)cc2)CC1 785033408 YSHIEWQTPGLSCB-UHFFFAOYSA-N 434.540 2.341 10 20 IECD CCN(CCCN1CCCC1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 788552058 WFFJWSSXYIWDLF-QXMHVHEDSA-N 428.577 2.234 10 20 IECD CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800120 LNABWIACFXWBGG-FXAWDEMLSA-N 435.540 2.236 10 20 IECD CC(C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccn1 789854570 BVFXRRNRENHNQL-UHFFFAOYSA-N 428.558 2.355 10 20 IECD O=C(CNCc1cc2c(cc1O)OCO2)Nc1ccc(I)cc1 790609817 PSXREOBFIWRKLB-UHFFFAOYSA-N 426.210 2.454 10 20 IECD COC(=O)c1cn(CCNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1 790855626 ZJJHKRKRSFKHLC-CQSZACIVSA-N 434.928 2.454 10 20 IECD C[C@@H]1OCC[C@@]12CN(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCO2 792542106 VJPVLIVYPXLRJY-ORAYPTAESA-N 438.527 2.275 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H](CO)CC1CCC1 792842832 VBMHZEFUIJACGO-LJQANCHMSA-N 442.539 2.293 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)CCc3cccc(Cl)c3)cc2)CC1 795822679 JZMICDIHOHRQTO-UHFFFAOYSA-N 442.990 2.237 10 20 IECD C[C@H](NC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 799383523 PUCKZBOOYXATGV-ZDUSSCGKSA-N 426.489 2.370 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 803399382 PHJKWRKCKLIVDQ-OAQYLSRUSA-N 443.519 2.460 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(Cc4cccs4)CC3)CC2)cc1 804315926 VRTRGWOKNPKMFC-UHFFFAOYSA-N 442.585 2.186 10 20 IECD C[C@@H](c1ccc(F)cc1)N1CC[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 815197865 SNNBEZKUZKIDDE-KPZWWZAWSA-N 436.461 2.422 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4ccc(OC)c(F)c4)CC3)nc12 917054390 HSIVTWHRIOCMLB-UHFFFAOYSA-N 443.479 2.077 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCC(=O)Nc3cc(C)ccc3OC)CC2)cc1 917208033 WUBPPXONWXXVQX-UHFFFAOYSA-N 440.544 2.279 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1N(C)C 918465271 JXVFAJLDMLHSGY-GOSISDBHSA-N 437.544 2.018 10 20 IECD COc1cc(OCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 921004847 OMHNLTOTJWYXKD-MRXNPFEDSA-N 442.472 2.000 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC(OCC(N)=O)CC3)c2C)cc1 1324185018 AJNNMADIKYDBMH-UHFFFAOYSA-N 427.501 2.030 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cc(C2CC2)on1 1802786815 YLELYKHETXWURM-QVKFZJNVSA-N 449.467 2.387 10 20 IECD O=C(NC[C@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469898 RAQKHBKXNJLOGK-TXXUCJGISA-N 449.486 2.238 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c(C)n1C 1811235644 BCAKGAJFSOEGCN-VGSWGCGISA-N 449.511 2.477 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnnc(Cl)c2)CC1 1825344004 RHWWZSPBBHNUMI-INIZCTEOSA-N 445.907 2.483 10 20 IECD CCOC(=O)O[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429565 MHNPVPMFGGZVNB-RHSMWYFYSA-N 449.504 2.288 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C[C@@H](C)O1 29402554 RGXUXSDTWXDASM-BETUJISGSA-N 435.458 2.351 10 20 IECD O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NCc1ccc(N2CCOCC2)cc1 726528520 ZMXWUFGFTXHWGP-UHFFFAOYSA-N 449.486 2.312 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 741097858 ZKEXHSWMDNNPGS-NRFANRHFSA-N 434.496 2.435 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCn3c(C)nc4ccccc43)CC2)cc1 743320258 UASCTPJYLPLWRD-UHFFFAOYSA-N 436.560 2.475 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C)O[C@@H](C(F)(F)F)C3)CC2)cc1 745784511 WHWZXMJFLKSURK-MAUKXSAKSA-N 430.471 2.178 10 20 IECD CCC[C@@H](C)NC(=O)[C@@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 747835692 RSDCTCGTNHKRJC-WOJBJXKFSA-N 430.593 2.361 10 20 IECD C[C@](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)(C(N)=O)c1ccccc1 749395287 BYVZQTAXQQUYFB-RUZDIDTESA-N 427.460 2.391 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1 749730372 NWCNPGHCYAPTPK-UHFFFAOYSA-N 447.521 2.372 10 20 IECD CN(C)[C@@]1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCSC1 751070281 IOFBGDBGYSRXOU-GOSISDBHSA-N 441.600 2.422 10 20 IECD COc1cc2ccn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(=O)c2cc1F 754778746 NEOVQYZCNJLJPA-UHFFFAOYSA-N 443.450 2.441 10 20 IECD CCS(=O)(=O)c1ccccc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759220893 MPBJFWIIVGXBQS-UHFFFAOYSA-N 448.541 2.468 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(C(C)=O)cc3)CC2)cc(OC)c1OC 759408570 DSSJZKIDMHDBSG-UHFFFAOYSA-N 441.484 2.202 10 20 IECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NCc1cccc(Br)c1O 765751235 BMDGNLMVKQRKOL-UHFFFAOYSA-N 436.218 2.105 10 20 IECD C[C@@H](C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)N1CCOc2cc(N(C)C)ccc21 774753785 ONHGEMVZTWYUIB-HNNXBMFYSA-N 432.546 2.229 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCn3cnc4ccccc43)CC2)cc1 778220046 PQQLAEILNAZIBV-VAWYXSNFSA-N 447.539 2.456 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(O)(c4c(F)cccc4F)CC3)nc12 778235567 STYIHDMRQGGWCB-UHFFFAOYSA-N 432.427 2.373 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C4CCCCC4)CC3)CC2)cc1 778382189 PXDLOKDZCZAQTL-VAWYXSNFSA-N 440.588 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 778412052 WTDHHLBHFKECQT-ZBTGYSDGSA-N 426.521 2.019 10 20 IECD CC(=O)Nc1nnc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 779233471 CYJHYCFKKBAOSE-UHFFFAOYSA-N 433.515 2.331 10 20 IECD COc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)nc1I 784488301 IZICHAKFYUCUIJ-UHFFFAOYSA-N 429.166 2.146 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCC[C@@H](SC)C3)CC2)cc1 785527031 IVHWEXYMPYIWOB-GHTZIAJQSA-N 448.633 2.114 10 20 IECD NS(=O)(=O)[C@@H]1CCCN(Cc2cc(Br)cc(Br)c2O)C1 785978913 KKMXZPMGNZSXIM-SNVBAGLBSA-N 428.146 2.170 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)Cc3ccccc3)cc2)CC1 786656131 KUGKYMGTPNCAAT-XMMPIXPASA-N 448.567 2.205 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 788331723 KHYBMBGJMPMADP-UHFFFAOYSA-N 438.484 2.239 10 20 IECD COc1ccc([C@@H](CO)N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789860205 JUORZJRTHDHJIN-OAQYLSRUSA-N 443.569 2.057 10 20 IECD COc1cc(CC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1O 790024601 UBPQLLUTMKVBPU-UHFFFAOYSA-N 446.500 2.327 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 803134864 MXQXCMHWAFXUFJ-OAQYLSRUSA-N 438.528 2.111 10 20 IECD C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803305779 OXXJBGJGRHNPGT-GFZDYNDISA-N 443.588 2.489 10 20 IECD O=C(Nc1cccc2c1CNC2=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806919481 RFLOFRALEWNBMO-ZDUSSCGKSA-N 444.438 2.255 10 20 IECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)NCCCSc1nccs1)C2 806961257 NTFHSKBDDPCXSX-UHFFFAOYSA-N 426.589 2.301 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cs1 807675662 ZMSXZJRMYYYSJV-MRXNPFEDSA-N 429.590 2.293 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1F 808586972 QQGQNGILXZOJDJ-QGZVFWFLSA-N 432.883 2.083 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cn4ccsc4n3)CC2)cc1 916197430 ZLGKKWNRGHWRHD-UHFFFAOYSA-N 428.562 2.416 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 918308564 MFHMLOAGXZBTAS-UHFFFAOYSA-N 434.496 2.500 10 20 IECD CCOc1ccc(CN2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 919811042 AHJITMNNEDENNX-UHFFFAOYSA-N 433.530 2.120 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(Oc2cnccn2)c1 920194880 KOOAJSWPEYIMHW-UHFFFAOYSA-N 433.468 2.360 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccccc3S(=O)(=O)CCN(C)C)CC2)cc1 1319665834 ZAUJHGSSRFWUMM-UHFFFAOYSA-N 445.585 2.383 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cnc[nH]3)CCC2)cc1 1792313868 DXYGJQCKVRJTBY-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2cncc12 1798189696 INSDZVCXDSVLCA-BJKLQHCMSA-N 448.479 2.416 10 20 IECD Cn1ccc(=O)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1799225682 CFFOLFKMEKUSDQ-BTTYYORXSA-N 431.876 2.016 10 20 IECD Cc1[nH]ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818318865 QMZWBAAASATRFH-CQSZACIVSA-N 446.558 2.212 10 20 IECD Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)o1 1827082264 HVINAYVOWXCJHE-GFCCVEGCSA-N 428.470 2.319 10 20 IECD CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1827428455 QOTQECWAVMJVDU-SFHVURJKSA-N 441.532 2.336 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429568 MHNPVPMFGGZVNB-WMLDXEAASA-N 449.504 2.288 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC(N3CCC(NC(=O)CN)CC3)CC2)cc1 1834670697 SIACSEYAKOWKGY-UHFFFAOYSA-N 437.588 2.238 10 20 IECD CN1CCN([C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2)CC1 728469166 NLHLNYBGDUHFBU-QHCPKHFHSA-N 426.536 2.267 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 728761733 VLUGLDOFTHWIIP-UHFFFAOYSA-N 443.475 2.137 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)c(F)c3)cc2)C1 730174849 MLZMDKKTXKYINN-IBGZPJMESA-N 440.519 2.294 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 736986787 WLCYGOBYAMUBLM-UHFFFAOYSA-N 436.509 2.201 10 20 IECD CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NCc3cc(OC)ccc3O)ccc21 737208131 WANHSQYNSGINOM-UHFFFAOYSA-N 425.441 2.174 10 20 IECD Nc1ccc(CC(=O)N2CCN(S(=O)(=O)c3ccccc3C(F)(F)F)CC2)cc1 746403772 CNNPUZACGBRPOT-UHFFFAOYSA-N 427.448 2.363 10 20 IECD O=S(=O)(NCCNCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)s1 752103247 QTYAOTCDRXFAGV-UHFFFAOYSA-N 433.958 2.445 10 20 IECD Cc1cc(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c(C)n1-c1cccc(Cl)c1 753680905 ZPTZUACPDOOMJG-UHFFFAOYSA-N 448.936 2.012 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 754050698 QRXMENCNWVDNDI-NHCUHLMSSA-N 448.608 2.119 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4nc(C)c(C)s4)CC3)CC2)cc1 754068426 AUWDJDJVJTVEJZ-NRFANRHFSA-N 445.633 2.074 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3c(=O)c4ccccc4n4nc(C)cc34)CC2)cc1 758196567 IMASJLMVRGPPIJ-FQEVSTJZSA-N 447.539 2.149 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](c4cc(F)ccc4F)C3=O)CC2)cc1 761184343 LHBQLGJUNXREKS-FQEVSTJZSA-N 430.455 2.389 10 20 IECD COCCNc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 762652999 BXLRMCONTWWNBL-FQEVSTJZSA-N 439.560 2.446 10 20 IECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NCc1cccc(Br)c1O 765746282 FHUJOLZVGWQZDV-UHFFFAOYSA-N 429.274 2.467 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)cn1C 766745321 XBSXEKONFWFBIZ-UHFFFAOYSA-N 447.586 2.344 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 768062549 MGQMNTWJEDZYLX-OAHLLOKOSA-N 442.491 2.180 10 20 IECD CC[C@@H]1CCCCN1CCNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778276413 QXJLQCBEYNBWMF-YVNCXZRQSA-N 428.577 2.281 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-c4cc[nH]n4)cc3)cc2)C1 780045863 AZVVSQZXUVUXIF-SFHVURJKSA-N 446.511 2.033 10 20 IECD COC(=O)C1(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCOCC1 781796553 LUOHXBKIFIXQCQ-IYBDPMFKSA-N 437.512 2.208 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(I)c1 785298536 VQRBWPPKEXWMMI-JTQLQIEISA-N 440.237 2.388 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccsc1 787649575 BINWGVHQNJOXSG-IBGZPJMESA-N 432.615 2.337 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C[C@H]3CCOC3)C3CC3)cc2F)C[C@@H](C)O1 789812548 MGJYGYIIKJKUHN-JFIYKMOQSA-N 433.524 2.083 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12 789867508 HANBWIMFADHZKO-KURKYZTESA-N 437.656 2.352 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1)c1ccc(N2CCOCC2)cc1 792968977 CLQYQMRMCFPOPD-INIZCTEOSA-N 434.496 2.191 10 20 IECD CCN1CCC(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 793814180 MKXJQVGFWMWHMO-QGZVFWFLSA-N 438.519 2.221 10 20 IECD CC(C)(C)OC(=O)N1CC=C(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 794183075 ZFBSTFFXTDRDFR-UHFFFAOYSA-N 439.534 2.451 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1 801113874 XXJKNRCIHPYPGK-UHFFFAOYSA-N 435.521 2.185 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)cc1F 803663472 PLFWOEKDBZPUJI-INIZCTEOSA-N 436.528 2.414 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)CCC2CCCC2)CC1 807101171 QNZAOQCELJJMHU-UHFFFAOYSA-N 428.577 2.318 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C(=O)OC)c3ccc(OC)c(Cl)c3)nc12 809564066 VOVWQSWWIZMPEE-QGZVFWFLSA-N 448.863 2.278 10 20 IECD O=C(CN1CCCC[C@@H]1COC(=O)NC1CC1)NCc1ccc(N2CCOCC2)c(F)c1 810037827 VZDRNONXQXCVAF-LJQANCHMSA-N 448.539 2.022 10 20 IECD CCN1C[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1=O 914910276 CORCXFPFVDGRRO-MRXNPFEDSA-N 426.469 2.460 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(Cc4ccco4)CC3)cc2F)C[C@@H](C)O1 917020177 DNAXPEFSUZRGQQ-KDURUIRLSA-N 444.551 2.466 10 20 IECD CCCc1cc(=O)n2nc(NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)sc2n1 917391284 PUZWWMYXCCZVIE-OAHLLOKOSA-N 426.546 2.417 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccsc2C(=O)OC)cc1OC 917758237 MMYWMZXWWWMDCO-UHFFFAOYSA-N 434.517 2.106 10 20 IECD C[C@@H](NC(=O)NCc1ccccc1S(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 920868710 KEKGEVIFUDXLMK-QGZVFWFLSA-N 446.573 2.334 10 20 IECD CS(=O)(=O)Nc1ccccc1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1317976957 WSSHWBDMIVQFLN-UHFFFAOYSA-N 436.509 2.033 10 20 IECD CCCN(C(=O)[C@H](C)N1CCN(c2ccc(OCC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 1319847909 QMALKMDYXQTMDP-ICSRJNTNSA-N 437.606 2.022 10 20 IECD COc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600843 ITDSZEGAOZISHP-BCDXTJNWSA-N 425.485 2.386 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1S)CC2)c1cc(O)nc(O)c1 1816720560 YIJPZWREZLDZOJ-JTQLQIEISA-N 443.510 2.173 10 20 IECD CCCc1[nH]nc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-] 303336947 CNLFCRXCEVUVHH-UHFFFAOYSA-N 430.509 2.221 10 20 IECD Cc1ccc(C(=O)O[C@@H](C)C(=O)NCc2ccc(CN3CCOCC3)cc2)c(O)c1O 727005054 DVQLBEODJHLRNP-INIZCTEOSA-N 428.485 2.100 10 20 IECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 729784444 LFVCCYYWZHHPSH-UHFFFAOYSA-N 438.553 2.404 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(OCCOC)nc3)cc2F)CC1 730116816 SJVHWIWQQVJLEF-UHFFFAOYSA-N 445.539 2.387 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1 737116289 AOFDTRJVSAMARZ-UHFFFAOYSA-N 432.546 2.086 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4ccccc4F)CC3)CC2)cc1 742948535 XEPNULZEWDIWGP-UHFFFAOYSA-N 441.551 2.488 10 20 IECD O=C(COC(=O)[C@@H]1OCCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 750051126 HOXGCWUWGJGGGY-JOCHJYFZSA-N 428.460 2.136 10 20 IECD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(Br)cc(Cl)c1O 756535429 PYIUOSNTEIBZFO-NSHDSACASA-N 440.791 2.036 10 20 IECD COc1cc(N2CCN(Cn3nc(CO)n(C4CC4)c3=S)CC2)cc(OC)c1OC 758966516 WYCYGKNHBFIISK-UHFFFAOYSA-N 435.550 2.047 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCN(C(=O)C2CCCC2)C1 762092797 XFFFJCLHQVXDTH-NRFANRHFSA-N 428.577 2.486 10 20 IECD C[C@H](NCc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 765283704 XVLWFUTTZWQQAD-IBGZPJMESA-N 445.585 2.395 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)CC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 768521262 GKSBQVJLWXRZRU-HZPDHXFCSA-N 431.508 2.375 10 20 IECD COCCNC(=O)c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1Cl 769713100 ONJAFXZTEJUGQA-UHFFFAOYSA-N 441.893 2.046 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 770021285 WIAMRARZBKYPHE-GFCCVEGCSA-N 441.531 2.093 10 20 IECD C[C@H](NC(=O)c1cnn(CC(=O)NC2CCCC2)c1)c1ccc(N2CCOCC2)cc1 772071356 YKIOIYZQIRBFLY-KRWDZBQOSA-N 425.533 2.270 10 20 IECD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)n(C)c2)C1 773761548 SLEVUABCYGQIMZ-GJZGRUSLSA-N 435.546 2.218 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4nccn4)cc3)CC2)cc1 778232950 KICRXXUCMAGJKH-KHPPLWFESA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(-c4ccccn4)c3)CC2)cc1 778287130 FQRRWZUNYFSENM-KTKRTIGZSA-N 432.484 2.119 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)F)CC3)cc2F)C[C@@H](C)O1 778310898 JSTKCZRAXGXLPT-HUUCEWRRSA-N 429.483 2.148 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)c(C)n1-c1ccccn1 780624807 PTGZSTNXZPELQO-UHFFFAOYSA-N 426.498 2.310 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@H](O)c3ccc(F)cc3)CC2)cc1 787254278 UYASWLOKSPNBDR-FYYLOGMGSA-N 440.519 2.296 10 20 IECD Cc1ccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789799626 NFGTVZCRJAWGLO-KRWDZBQOSA-N 429.492 2.171 10 20 IECD CN(CCCOc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789835154 ORKKOSBYOBDTGK-UHFFFAOYSA-N 443.519 2.331 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H](c1cccnc1)C1CC1 789841282 WOYBTBKQUATXGT-OAQYLSRUSA-N 426.492 2.066 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1 793733226 LUPMABRNJKCTTN-LPHOPBHVSA-N 440.519 2.064 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795913574 FOXKDCABOXBHIY-INIZCTEOSA-N 434.514 2.284 10 20 IECD C[C@H](Sc1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1)C(N)=O 800861669 ZJHJZYQQZFDJMI-AWEZNQCLSA-N 433.555 2.140 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1F 803661598 HHCDMUZPPDRZME-CVEARBPZSA-N 436.528 2.460 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661861 BYFKHZMLIDFDSG-WMLDXEAASA-N 436.528 2.270 10 20 IECD O=C(NC1CCN(C[C@@H]2CCOC2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807103169 KDMMQACJCCIBKM-SFHVURJKSA-N 441.528 2.131 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290804 AAYFWKVFUNAIEE-MJGOQNOKSA-N 442.560 2.441 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](c2nc(O)n[nH]2)C1 816541782 UNCRZJBTZNBVTJ-NSHDSACASA-N 449.514 2.098 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccnc(-n4cccn4)c3)CC2)cc1 916197113 UIXQRFJGMGUPJT-UHFFFAOYSA-N 449.559 2.287 10 20 IECD COc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 918278072 QVRGFGTVUYWRSV-UHFFFAOYSA-N 438.406 2.201 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2NC1=O 918439208 UWFMLFOWNKWEEY-CQSZACIVSA-N 440.525 2.214 10 20 IECD Cc1cc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n([C@H]2CCS(=O)(=O)C2)n1 920873022 WIZMLCURXWEVRA-APWZRJJASA-N 447.561 2.270 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(CCCC[C@@H]4C)C3=O)CC2)cc1 1253854350 XKNWEXMTQJYUTR-SBUREZEXSA-N 428.533 2.235 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2 1782004308 BHCXRWMBCVGYRK-NRFANRHFSA-N 447.875 2.374 10 20 IECD Cc1noc(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004369 VUPDYDOMGGDDDB-OAQYLSRUSA-N 449.891 2.042 10 20 IECD CC[C@@H](C)[C@H](N)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314042 YKZWYFFVCVYKMG-ACJLOTCBSA-N 448.614 2.354 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccc(F)s1 1794221992 REGWQRUJWRRAJJ-CULMDFNYSA-N 440.880 2.469 10 20 IECD CC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CCCCC1 1800934261 CTEKSPGRXUHBJI-WVBGYWIOSA-N 444.528 2.377 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cccc(F)n2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994223 DTGFNPATYBHZBV-JLTOFOAXSA-N 437.431 2.055 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807996134 YRDWHYNNETZAGU-IIMJZQEZSA-N 428.489 2.021 10 20 IECD Cc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824709744 XMTRVBGITOPFKC-GOSISDBHSA-N 427.505 2.082 10 20 IECD CCCC(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132820 QQIFYSODRBJVFK-UHFFFAOYSA-N 439.560 2.151 10 20 IECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1848185565 VUKKXAFREHPARW-VXKWHMMOSA-N 445.523 2.317 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 731454043 LSUJOAXBVWNWGV-UHFFFAOYSA-N 436.472 2.314 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCN(C(=O)c2ccncc2)C1 743312736 GTNYBPJHZJKJTF-IBGZPJMESA-N 440.519 2.350 10 20 IECD Cc1ccccc1CC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 749932080 HQZWAKNQHGDZGV-UHFFFAOYSA-N 436.556 2.428 10 20 IECD COCCOC[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751069531 OHNLPMZQFMVJPY-CQSZACIVSA-N 440.543 2.380 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)CC(C)(C)O)CC2)cc1 754226125 OMNHXIQTSVYBIC-QHCPKHFHSA-N 427.589 2.451 10 20 IECD COc1cc(N2CCN(C(=O)C[C@H](C)NC(=O)C3CCCC3)CC2)cc(OC)c1OC 760083168 BYUMXLXKKOIVOY-INIZCTEOSA-N 433.549 2.446 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CN(Cc2ccccc2)CCO1 761608016 JREGAIFDEZRBRU-TZIWHRDSSA-N 447.557 2.173 10 20 IECD Cc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)c1 766880158 KBWHNGKKDGJLJE-HXUWFJFHSA-N 436.560 2.124 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn(-c4ccccc4F)c3)CC2)cc1F 768735952 XCCYODZOQGABAY-UHFFFAOYSA-N 441.438 2.446 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cccc(OC)c2O)cc1F 769651801 KCJVNCHKPJELGF-UHFFFAOYSA-N 432.495 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CN4Cc5ccccc5C4=O)n3)CC2)cc1 771066869 LAYIEQVUVALDGP-UHFFFAOYSA-N 447.495 2.126 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccn(Cc4ccccc4)n3)CC2)cc1 772458783 UETSYQXRSMEXNR-UHFFFAOYSA-N 434.496 2.446 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc(F)c(OC)c([N+](=O)[O-])c3)CC2)cc1F 778000568 WMEVWKMAVMTAAU-UHFFFAOYSA-N 443.428 2.401 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC3(c4noc(C)n4)CCCCC3)CC2)cc1 779222526 PWAIQOFHQGCCND-HXUWFJFHSA-N 429.565 2.319 10 20 IECD COC(=O)[C@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 781343551 CKBBWUBPYQNYLU-LLGFUMIMSA-N 435.540 2.473 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 781517513 KYYDUWCWXFBURY-UHFFFAOYSA-N 429.473 2.120 10 20 IECD COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1cc(OC)ccc1O 781518518 LLBLHGWUABLCNF-UHFFFAOYSA-N 426.347 2.461 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C(C)C)N3CCOCC3)cc2)CC1 786458677 NJGQCFIWQXDNNZ-JOCHJYFZSA-N 430.593 2.012 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC3CCN(C4CCCC4)CC3)CC2)cc1 787193892 VDUDXDAPEVQHAC-UHFFFAOYSA-N 428.577 2.303 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccsc1Br 788318636 GKHXYNTVJQTAKI-UHFFFAOYSA-N 438.347 2.280 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4ncccc4Cl)C3)ccc21 803685885 NWUWGSAMVROUDE-KRWDZBQOSA-N 427.936 2.129 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@@H]1NC(=O)OC(C)(C)C 803686989 SLDUTVPJBDYEJW-APWZRJJASA-N 444.576 2.447 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2NC1=O 807386964 SFKWIAQZEYVHQM-SECBINFHSA-N 434.246 2.129 10 20 IECD O=C(CN[C@H](C1CC1)[C@]1(CO)CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815289055 WHGRSEJDGRJLAT-JWQCQUIFSA-N 434.492 2.310 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)cc2)CC1 857494620 SDVXYJZEESVQMX-HSZRJFAPSA-N 437.540 2.382 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O 916760125 IZPCZCATBCJNOQ-UHFFFAOYSA-N 445.541 2.206 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccccn4)CC3)cc2F)C[C@@H](C)O1 916981681 LVVUYUKLFRUSEQ-KDURUIRLSA-N 441.551 2.273 10 20 IECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)cc1 918549292 GEVLJVKLEDSNDO-SFHVURJKSA-N 443.525 2.006 10 20 IECD Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 918746779 WVEHABIJFCCQNB-QGZVFWFLSA-N 446.529 2.392 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)Cc3ccccc3)cc2)C1 920222469 UTVPOEOMTJMEHW-FYYLOGMGSA-N 448.567 2.238 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 1320514330 UKGALXVUIREEHH-HOCLYGCPSA-N 446.887 2.395 10 20 IECD CC1(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CCC1 1802427632 XLBSTKFGHWKZFK-YJBOKZPZSA-N 446.598 2.138 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@H]1CCCO1 1819701905 SNYPQYGHWJYXCP-PRLJZHDASA-N 442.472 2.411 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCO2)[nH]n1 1823474806 FYXKTBTUZHEMTP-KYZJMWGYSA-N 442.472 2.411 10 20 IECD O=C(Cc1cc[nH]n1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1824734598 BRTHQOXYFKQVID-SNVBAGLBSA-N 447.904 2.399 10 20 IECD O=C(c1ccncc1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898206 GFOGJWFWEMONMZ-QGZVFWFLSA-N 446.598 2.175 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3n[nH]cc3c2)C1 1843256489 GEMFVUSEMLIWQT-QPJJXVBHSA-N 434.452 2.210 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCO[C@@H](c3nnc(C(C)C)o3)C2)n(C)c2ccccc12 576779953 GNQWNJMMFSEZRJ-GOSISDBHSA-N 425.489 2.209 10 20 IECD CC(C)C(=O)N1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 727930933 BZSPQBOWPYIOOB-OALUTQOASA-N 448.583 2.246 10 20 IECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC12CC3CC(CC(C3)C1)C2 728729543 PHTYFUHVZXGYTP-CSNVJCEJSA-N 436.530 2.394 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1 734405342 CFWZMIITBUTKOS-UHFFFAOYSA-N 434.562 2.383 10 20 IECD COc1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc2ccccc12 742346394 IOLNJDMKHNKGBT-UHFFFAOYSA-N 425.510 2.408 10 20 IECD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751370897 DFOWMJZFCUEOIO-CQSZACIVSA-N 426.882 2.292 10 20 IECD CC(C)[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCC[C@H](C(N)=O)C1 751931877 UUBPZVPJILEGIE-HNAYVOBHSA-N 444.557 2.221 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3cccc(NS(C)(=O)=O)c3)CC2)cc1F 753825149 HSNLHXZVCJKJOD-UHFFFAOYSA-N 436.509 2.238 10 20 IECD CNC(=O)c1cccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759928464 NPGBUJHFQFQYBD-UHFFFAOYSA-N 428.489 2.426 10 20 IECD CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 760888824 MPARLGGKMSUPNW-HNNXBMFYSA-N 433.530 2.207 10 20 IECD O=S1(=O)CC[C@@H](c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)C1 761626014 KINQAXHUMOCKAR-SNVBAGLBSA-N 441.512 2.207 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-c4n[nH]c(CC)n4)cc3)nc12 770156157 YBILPSFMIUXXLJ-UHFFFAOYSA-N 436.428 2.316 10 20 IECD C[C@H]1CN(C)[C@H](C)CN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770165822 STEQFDKUGGEWTN-KGLIPLIRSA-N 448.501 2.266 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cc(S(C)(=O)=O)sc2Cl)cc1F 770668889 CIYYWEWEEDKRBY-UHFFFAOYSA-N 426.944 2.489 10 20 IECD CC(C)[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS1(=O)=O 772700743 XDDKGUMHYLMTHR-YJBOKZPZSA-N 445.532 2.433 10 20 IECD COC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 784071493 QFKXTBHJBJXZRQ-PBHICJAKSA-N 431.455 2.487 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1 784558451 NOHWESUCNLOIJO-UHFFFAOYSA-N 427.501 2.146 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cc1 784562273 VUWLNCAKUZMDKH-UHFFFAOYSA-N 440.905 2.370 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(N2CCNC2=O)cc1 786842068 WSQATCDMZHJZHE-KRWDZBQOSA-N 428.558 2.302 10 20 IECD COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931364 DTYMAACIXFGUNA-UHFFFAOYSA-N 439.512 2.307 10 20 IECD CCC(CC)(CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)SC 789845924 WUZFJTIQJGCNLY-UHFFFAOYSA-N 425.570 2.441 10 20 IECD CC[C@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716671 DSRSZTJJLLHTMH-YADHBBJMSA-N 448.567 2.368 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 793808974 CRAYYKJYIGYAFS-HOYKHHGWSA-N 430.593 2.407 10 20 IECD O=C1C[C@@H](NCc2ccc3c(c2)CCN3Cc2ccccc2)CN1CCN1CCOCC1 796308467 CHZVUJLJBBFZKT-XMMPIXPASA-N 434.584 2.272 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c1 797533217 GHHOPKWOQQOCHT-UHFFFAOYSA-N 433.892 2.141 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)c3ccccn3)cc2F)CC1 805006974 BNKPDUUEBFGERD-KRWDZBQOSA-N 427.524 2.198 10 20 IECD CC[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 805771843 BIDIGIIIXANYSH-HOCLYGCPSA-N 440.521 2.298 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1nccn1CCc1ccccc1 807290996 RRYBQQDGRDUJGO-UHFFFAOYSA-N 429.524 2.435 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 807292489 RBWUEIFXPNEJPN-UHFFFAOYSA-N 439.947 2.072 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1 807372646 LCYGBQPUJKUFMT-SFHVURJKSA-N 445.585 2.388 10 20 IECD CC(C)CN1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807769538 HFRCFWYAGHFNNW-QGZVFWFLSA-N 438.519 2.173 10 20 IECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(F)cc1[N+](=O)[O-] 821172878 HQJFUFCFQQKNTQ-UHFFFAOYSA-N 443.478 2.078 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(C(=O)N4CCC[C@@H](C)C4)CC3)CC2)cc1 915694373 HKEFOTXYNQQKRB-HXUWFJFHSA-N 442.604 2.314 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)COc1ccc(F)cc1 919908291 WWXOYVPVBIKCIJ-SFHVURJKSA-N 435.471 2.165 10 20 IECD C[C@H](NC(=O)C[C@](O)(c1nccn1C)C(F)(F)F)c1ccc(N2CCOCC2)cc1 920890049 IHWWJPLGFJUYII-LIRRHRJNSA-N 426.439 2.274 10 20 IECD C[C@@H](NC(=O)NC[C@@]1(N2CCOCC2)CCSC1)c1ccc(N2CCOCC2)cc1 920920902 QPPQMQCXLCQRBD-GCJKJVERSA-N 434.606 2.091 10 20 IECD COCCN1C(=O)/C(=C/Nc2nc(-c3ccc(OC)cc3)c(C)s2)C(=O)NC1=S 920977738 JILKWTRHKDLEBN-GXDHUFHOSA-N 432.527 2.313 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnn(-c4ccccc4)c3)cc2)C1 921064238 JNDLBUPVDMSKQB-SFHVURJKSA-N 439.541 2.053 10 20 IECD CN1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)N[C@@H]3CCOC3)cc2F)CC1 1261181804 DNSLOLCVJYDOIA-WOJBJXKFSA-N 434.556 2.447 10 20 IECD Cc1ccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)ccc2n1 1777907237 ZYLCSWAEDZNAJU-DEOSSOPVSA-N 448.479 2.107 10 20 IECD Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)c1 1780394530 XTZHMWMBIAHPSQ-WZONZLPQSA-N 425.485 2.243 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H]2[C@H]4COC[C@H]42)CCO3)cc1 1781755683 OZRLGFPPEFCNHK-JTKRFKOTSA-N 449.551 2.430 10 20 IECD C[C@@]1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CC1(F)F 1782007082 BAEOHUWDQFGNLP-ZWKOTPCHSA-N 430.835 2.240 10 20 IECD COCCCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1805339824 KNJGGVCSCXGIPK-UHFFFAOYSA-N 440.544 2.437 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808467656 JFSAAOJNFFDKKJ-DNVCBOLYSA-N 441.438 2.145 10 20 IECD CC[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)N(CC)CC 1841673698 IXNJHBGCXVCHGZ-FQEVSTJZSA-N 439.560 2.103 10 20 IECD O=C(CCc1cc(F)ccn1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033865 MEOAUTILYPJPBM-ZZXKWVIFSA-N 441.459 2.187 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 523334049 UKNZLPMNFCIWAY-UHFFFAOYSA-N 429.523 2.405 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1F 731409694 YHZUJGFPRORGFK-UHFFFAOYSA-N 425.468 2.211 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)N1CCC(C(=O)N2CCCC2)CC1 731845015 UBWNYRSVUBGGOT-OAQYLSRUSA-N 429.561 2.234 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)c(F)cc2F)cc1 732046765 SYEQXOLOSBSKSK-UHFFFAOYSA-N 434.442 2.314 10 20 IECD CCn1nc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc1=O 732370613 PKIKRZCWEJHXMR-ZDUSSCGKSA-N 445.431 2.223 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CCn3c(C)c(C)sc3=O)CC2)cc1 734315825 ADXUUJFEAATUMF-UHFFFAOYSA-N 432.590 2.254 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1csc(Nc2ccccn2)n1 736070441 WUQWOWPDAQRUCH-UHFFFAOYSA-N 443.554 2.447 10 20 IECD O=C(c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c[nH]1)N1CCCC1 751136417 IPGMQIWCNMXFHD-KRWDZBQOSA-N 433.530 2.326 10 20 IECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccc(N(C)C)cc4)C3=O)CC2)cc1F 753978747 UTUBXTIMHUGTJO-HXUWFJFHSA-N 426.492 2.354 10 20 IECD C[C@@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)S(C)(=O)=O 754234613 CKQRJLFVCJQEFL-KWJWQAOWSA-N 432.614 2.279 10 20 IECD COCCOCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 754739814 PMNUSXVMFLSKKF-UHFFFAOYSA-N 428.532 2.201 10 20 IECD O=C(NCCCO[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 757424373 GIMKXBCVVOWJOT-AWEZNQCLSA-N 426.516 2.180 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(Br)o3)CC2)cc1 759027887 ZQYIXQDTOFXYEH-UHFFFAOYSA-N 444.351 2.151 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccc([S@](C)=O)cc3)CC2)cc(OC)c1OC 760129204 WTEWFTYFSQFBBD-HKBQPEDESA-N 447.557 2.482 10 20 IECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C[C@@]1(N2CCOCC2)CCSC1 761151501 YXIMNTPIJAEPEG-IBGZPJMESA-N 425.938 2.018 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c1 765418360 PVMKIYIMCUNKHL-OAHLLOKOSA-N 441.868 2.092 10 20 IECD CN(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)cc1F 765878253 DJQULGJHSAGQNE-HXUWFJFHSA-N 428.508 2.161 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)[C@@H]3CCCC[C@H]3C(=O)OC)cc2F)CC1 772648424 CWNKCBJDIMZCRC-YLJYHZDGSA-N 441.569 2.119 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccs1 774862201 WGTWASNSQBZEAQ-MSOLQXFVSA-N 431.558 2.380 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](c4n[nH]c(C)n4)C3)cc2F)CC1 776135527 OFSCIICGHAHCHB-GOSISDBHSA-N 429.544 2.483 10 20 IECD CC[C@H]1C(=O)N(CC)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 778236849 XXDJITYEXWHART-KRWDZBQOSA-N 435.436 2.453 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)C2CN(C(=O)c3cccc(Cl)c3)C2)cc1F 781524585 ZDGCVQMZXIJESO-UHFFFAOYSA-N 425.913 2.489 10 20 IECD C[C@@H](c1ccccc1)N(C(=O)C(=O)Nc1cnn(CC(=O)NC2CC2)c1)c1ccc(N)cc1 783487228 VWEFNQCFJZMXEN-INIZCTEOSA-N 446.511 2.477 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1 785440343 YQFWNDDKFGGONS-UHFFFAOYSA-N 431.496 2.333 10 20 IECD CN1CCC(n2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)n2)CC1 786708103 VGBNHSVQRUALQJ-SFHVURJKSA-N 439.564 2.173 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN1CCC[C@H](C)C1 787676852 RWGREJSQCUFUNM-AWEZNQCLSA-N 426.355 2.351 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1 787964729 XQDNLARHCWVQQG-HXUWFJFHSA-N 438.528 2.202 10 20 IECD CC(C)CC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC1 793717583 HSSYXOSXRDPSCW-LJQANCHMSA-N 428.577 2.337 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)cc1F 793742328 JDDCFBGYUSOQGO-UHFFFAOYSA-N 449.486 2.472 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCSC[C@H]1c1nccs1)c1ccc(N2CCOCC2)cc1 803298721 DTGZWMAODGIGQN-QAPCUYQASA-N 446.598 2.474 10 20 IECD C[C@H](NC(=O)C(=O)NCCc1nc2c(s1)CCCC2)c1ccc(N2CCOCC2)cc1 803304720 CWDYYWBLUSRXCS-INIZCTEOSA-N 442.585 2.395 10 20 IECD Cc1cc(N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)nc(C(C)C)n1 803663024 RFZKIXVMMDRQPR-UHFFFAOYSA-N 442.539 2.079 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1F 804852515 JNIODBGWLFBILK-SFHVURJKSA-N 434.556 2.299 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccnn1Cc1ccccn1 807386755 HSCNQPVFXQYCRE-UHFFFAOYSA-N 430.262 2.049 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccn(Cc2ccccn2)n1 807387019 VETNJZGDPINCFQ-UHFFFAOYSA-N 430.262 2.049 10 20 IECD Cc1c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cccc1[N+](=O)[O-] 807810245 QLJAOBQEBNKFLR-GOSISDBHSA-N 427.457 2.433 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 808568115 DYNCJLBGSYJZQC-LJQANCHMSA-N 444.482 2.301 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4nccs4)n3)cc2F)C[C@H](C)O1 810014860 RASZTQVJEHVUAB-KBPBESRZSA-N 430.509 2.471 10 20 IECD COc1cc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1OCC(N)=O 916640913 OSCHAUAPOMCIGF-GOSISDBHSA-N 443.500 2.156 10 20 IECD O=C(CN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917080421 KQPFEKHEUMFSBA-NHCUHLMSSA-N 438.547 2.347 10 20 IECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 918078689 ABUUUCKRXOAOLU-QGZVFWFLSA-N 448.317 2.360 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1CCN(C(=O)N2CCCC2)CC1 919970139 QOTLUZGWPINXOX-UHFFFAOYSA-N 428.577 2.439 10 20 IECD CNC(=O)c1ccc(C)c(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 920255281 ULRXFJFYXRYQEZ-ZHACJKMWSA-N 436.512 2.207 10 20 IECD C[C@H](NC(=O)NC[C@@]1(N2CCOCC2)CCSC1)c1ccc(N2CCOCC2)cc1 920920901 QPPQMQCXLCQRBD-AVRDEDQJSA-N 434.606 2.091 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3cc(C(F)(F)F)ccc3=O)cc2F)CC1 1116008537 XAMXSSVFZKDAQT-UHFFFAOYSA-N 440.441 2.465 10 20 IECD CN1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)N[C@H]3CCOC3)cc2F)CC1 1261181803 DNSLOLCVJYDOIA-VQTJNVASSA-N 434.556 2.447 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cnc4c(cnn4C)c3)cc2F)C[C@@H](C)O1 1320440749 PUNIKCDXFRWMHU-ZIAGYGMSSA-N 433.509 2.200 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790245200 WTXXFRXYLWPJFV-SDCOAXJVSA-N 440.924 2.158 10 20 IECD COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1C 1796598947 OXSJVLZURAEQLK-BCDXTJNWSA-N 425.485 2.304 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccnn2C)C3)cc1 1799620531 QYDPYJKNCUULSN-JHDGKUDLSA-N 447.539 2.345 10 20 IECD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)n1cccc1 1813311400 MQDYTSZORRURQT-CEQIKUNHSA-N 435.484 2.270 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(O)O)CC3)cc1 1823437584 ISOIHLAHGNYJAK-OAHLLOKOSA-N 440.525 2.087 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2cccnc2Cl)C1 1841968420 MGSVGLVMOPAFFP-FNORWQNLSA-N 443.887 2.311 10 20 IECD O=C1C[C@@H](N(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C2CC2)C(=O)N1 726942365 DYPLKSBMGHADQE-CKXDQPNJSA-N 449.579 2.136 10 20 IECD O=[N+]([O-])c1cccc(-c2csc(NS(=O)(=O)c3cccc(-n4cnnn4)c3)n2)c1 727241965 OKVWPRLZPKIZQV-UHFFFAOYSA-N 429.443 2.495 10 20 IECD COC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 728656945 PZMSUFFALZWYMJ-UHFFFAOYSA-N 445.447 2.314 10 20 IECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NCc2ccc(N3CCCC3)cc2)C1 728949165 OBYMXHXRXHTKMG-LJQANCHMSA-N 430.549 2.230 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1 729231113 URLMOBINFRUIAN-AWEZNQCLSA-N 427.505 2.058 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1F 731356394 FNEMOPXDRSGEGA-UHFFFAOYSA-N 443.566 2.401 10 20 IECD Cc1cc(C(=O)CN2CCN(C(C)(C)CO)CC2)c(C)n1-c1ccc2c(c1)OCCO2 735869574 BWJCFTWBRVPFAD-UHFFFAOYSA-N 427.545 2.437 10 20 IECD CC(=O)N(C)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1 742026965 MQOXEEFZBBEHKI-UHFFFAOYSA-N 431.923 2.495 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 743958446 XQTVHYYOJDGXLO-UHFFFAOYSA-N 432.480 2.182 10 20 IECD Cc1ccc(N2CC[C@H](NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1 745692249 SVYSFTNAPKVLLW-UGKGYDQZSA-N 449.555 2.301 10 20 IECD C[C@@H](CS(C)(=O)=O)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747074783 HTPJVOHKZSQXCM-QWHCGFSZSA-N 443.477 2.013 10 20 IECD Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1S(N)(=O)=O 761983483 SBAMELBMVHZFEX-QGZVFWFLSA-N 437.949 2.396 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2NC1=O 765926702 PLOCEZGVVIYXSI-VIFPVBQESA-N 434.246 2.129 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4oc(N(C)C)nc4c3)CC2)cc1F 766518529 RXCXPCJRQFEXNO-UHFFFAOYSA-N 441.463 2.329 10 20 IECD COc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)ccc1OCC(N)=O 767382646 RKTHVYVRWBWLOG-UHFFFAOYSA-N 426.517 2.342 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN3CCCC(C)(C)C3)CC2)cc1 769708796 YOWRQYAWBYXOSD-MDZDMXLPSA-N 428.577 2.138 10 20 IECD C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NCc2ccccc2O)C1=O 771558450 DWDZXLSOLMFGBT-IBGZPJMESA-N 432.274 2.238 10 20 IECD Cn1cnc(-c2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)n1 771777038 JJJAXSQCCXJVKO-UHFFFAOYSA-N 440.529 2.039 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)cc1 774147152 YEDXDSDTRYLWNB-UHFFFAOYSA-N 432.546 2.468 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](c1cccs1)N1CCOCC1 774812590 YLSVZPNKKRRQDG-SFHVURJKSA-N 431.558 2.382 10 20 IECD CCCc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 777127680 HKXLJOXISPYLNW-INIZCTEOSA-N 443.573 2.361 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1 784027293 GFTXHCVEFOZQHZ-UHFFFAOYSA-N 425.485 2.242 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCc2nnc3n2CCCCC3)cc1 785917431 OXYAQZPIMJRYRJ-UHFFFAOYSA-N 426.565 2.168 10 20 IECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)n1 787500277 MNCMMKFKAVBQIR-UHFFFAOYSA-N 430.512 2.193 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)c1 787614438 VADUNLZWMLMMTD-WMZHIEFXSA-N 438.572 2.428 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 788333283 RHVWDSFBXOUNPI-GMAHTHKFSA-N 437.540 2.424 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C2CC2)O1 789821569 TYCRBXJHEVYXHW-YUWJWYLASA-N 433.524 2.081 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1OC 796697289 CUFRWVGEKJAMHG-UHFFFAOYSA-N 443.525 2.290 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](CO)CC3CCCC3)CC2)cc1 799052818 LAZFILLHBWPYPN-CFGKVWFZSA-N 429.561 2.205 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 799254192 SXDWBJKBMLJOCS-HXUWFJFHSA-N 442.491 2.065 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(c3nccs3)CC2)C2CC2)cc1 803175023 VNLNFBYEIWEMED-UHFFFAOYSA-N 427.574 2.485 10 20 IECD Cc1nnc([C@H](C)NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 803448632 DELSDWALJHOMKV-NSHDSACASA-N 439.488 2.410 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803448649 DICDIVCFBZXGIQ-UHFFFAOYSA-N 439.503 2.384 10 20 IECD CC1(C)[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H]2CCO[C@H]21 803451551 OSYVRNYGMWFVDI-KZNAEPCWSA-N 437.487 2.303 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@H](SC)C3)cc2F)CC1 805007005 CKUSFECFXHALSF-ROUUACIJSA-N 436.597 2.374 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cc2)CC1 805025395 OGKFIRZSAXSHAV-FQEVSTJZSA-N 442.604 2.251 10 20 IECD CNC(=O)c1cccc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 807359335 YHPIBLMSRXEDEP-UHFFFAOYSA-N 436.556 2.354 10 20 IECD CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807952182 FXNHBTPUTBIZNR-OAHLLOKOSA-N 432.956 2.370 10 20 IECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)c1 835065069 KMAXVQYXDQXWHK-UHFFFAOYSA-N 443.525 2.464 10 20 IECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 915554708 IIDUHYULMJCLSW-UHFFFAOYSA-N 425.478 2.329 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cccc(C(=O)NC4CC4)c3)cc2)C1 918123262 SCIXJRJDXLYIKO-FQEVSTJZSA-N 449.555 2.280 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(C(=O)N(C)C)ccc3C)CC2)cc1 918461640 JLBOQMLFPLMYAL-UHFFFAOYSA-N 438.528 2.383 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CSCCS3)cc2F)C[C@@H](C)O1 918985615 DKWUYPXWNQNLNO-LBTNJELSSA-N 442.578 2.447 10 20 IECD Cc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 919771343 WKTFVOTYGWBCCO-UHFFFAOYSA-N 432.546 2.404 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCCOC1 919782052 BUYBHEICTPJNBY-GOSISDBHSA-N 428.512 2.168 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(C[C@@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 1319624330 GXKNQAILJQMQOD-MRSFGVLCSA-N 442.560 2.481 10 20 IECD CN(C)CCNC(=O)c1ccc(CNCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1319866826 MDMCKBQZMUVKOP-UHFFFAOYSA-N 427.568 2.159 10 20 IECD CC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753010 YZZJONLPTBLDNP-URXFXBBRSA-N 425.529 2.309 10 20 IECD CC(C)n1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769541 WTHRINHGYPWAED-ZSBFGKGUSA-N 448.907 2.046 10 20 IECD CCN1CCC(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1 1810550117 YGSVLZWGDXDUCD-UHFFFAOYSA-N 430.549 2.070 10 20 IECD O=C(c1ccc(CO)c(F)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550124 ZAPWXHPWDLKEAV-UHFFFAOYSA-N 443.475 2.283 10 20 IECD CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429262 QXKFQOHEPWRKDO-RTBURBONSA-N 446.548 2.031 10 20 IECD Cc1cc(Cl)ccc1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847050553 CDBADDHQCFLMEK-UHFFFAOYSA-N 437.974 2.326 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(C(C)C)C3=O)c2C)cc1 10601769 QLKXPEVIMDMFGO-UHFFFAOYSA-N 425.441 2.263 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@H](CCS(C)(=O)=O)C3=O)c2C)c1 16573914 BOYXKAYESPGISX-IBGZPJMESA-N 445.541 2.249 10 20 IECD COc1ccc(O)c(CNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)c1 734015286 GMWRJKGOLUGDCT-UHFFFAOYSA-N 428.304 2.395 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1 734073468 OLMRZLKBTYYXIJ-UHFFFAOYSA-N 436.468 2.041 10 20 IECD CC1CCC(N2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 734488761 MCVJQICALBGWDE-UHFFFAOYSA-N 432.584 2.475 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 741097013 IQNHXKPURHDBSI-UHFFFAOYSA-N 435.452 2.314 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(CC(=O)N(C)C)cc3)CC2)cc1 743294634 REMKLHJNLNYHFY-UHFFFAOYSA-N 439.560 2.270 10 20 IECD CC(C)(C)OC(=O)N1CC(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 746146307 DXBTWKCNQNRKPL-SFHVURJKSA-N 430.549 2.262 10 20 IECD Cc1nc(C(C)(C)C)nc(O)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 747368009 WMVJYTSBAGGLOH-INIZCTEOSA-N 425.533 2.420 10 20 IECD C[C@@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 747390708 WIIWIQTVMNPCFL-IEBWSBKVSA-N 442.539 2.245 10 20 IECD COC(=O)CC1(CS(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 751373092 RMYAKHCXFYMWQA-INIZCTEOSA-N 430.954 2.273 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@]3(C)CCC(=O)N3)cc2F)C[C@@H](C)O1 751523341 XOBQLKFBDUWMAF-PXAQALGRSA-N 449.523 2.048 10 20 IECD COc1ccc(C(=O)NC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)cc1 751930429 FFIUGXVTNCTRNO-UHFFFAOYSA-N 425.466 2.438 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](NC(=O)OC(C)(C)C)C3)CC2)cc1 754011135 BKWIMMHXZYRZOH-CTNGQTDRSA-N 448.608 2.167 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(c2ccccc2)C(=O)C1 765879337 WMOIHTUAFMZWML-UHFFFAOYSA-N 426.492 2.345 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1 765884665 QDJTVRDMNILCFJ-HSZRJFAPSA-N 434.540 2.332 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])CC2)cc1 771240252 HTBPHHYDVJJUJG-UHFFFAOYSA-N 430.509 2.392 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@]3(O)CCCc4ccccc43)CC2)cc1 778296223 VPGOHVXGZQVBFV-NIFVDBSRSA-N 449.551 2.240 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@@H](C)O)cc1 779501498 AJBSCADHHYMXGF-GCJKJVERSA-N 445.585 2.329 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3cccc(C(N)=O)n3)c2C)cc1 781724038 PHYIRRKTGCHPQX-UHFFFAOYSA-N 435.436 2.414 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)cc1 784566154 SFKIVTPGLNGLRM-UHFFFAOYSA-N 445.560 2.362 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCCC3(C)C)CC2)cc1 785531370 VFIXPUFZTIRUMS-NRFANRHFSA-N 430.593 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)CCc3ccc(C)cc3)cc2)CC1 786260659 ZPKNLNJKVWSPEI-UHFFFAOYSA-N 436.556 2.029 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3cccc(OC)c3)cc2F)CC1 786765266 BEZPCIQQCDAEJD-QGZVFWFLSA-N 442.535 2.470 10 20 IECD CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788071667 YXUDSVFYOLDDDD-HXUWFJFHSA-N 440.544 2.103 10 20 IECD Cc1cnc(C2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)s1 788312036 AZYBBPMFBMETKY-UHFFFAOYSA-N 428.558 2.311 10 20 IECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)NCc1ccc(N3CC=CC3)cc1)C2 790732657 STCBXKYRLJZSLH-UHFFFAOYSA-N 426.542 2.239 10 20 IECD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792238304 OSFRTBCEBMTUDA-PGRDOPGGSA-N 433.936 2.048 10 20 IECD CN(C[C@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1)S(C)(=O)=O 795654342 NYXVJMOIINWFLK-MRXNPFEDSA-N 432.542 2.432 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 796732108 KTQWEVYJHRNXCQ-HNNXBMFYSA-N 441.484 2.134 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCN(C4CC4)CC3)cc2F)C[C@@H](C)O1 801874553 GJTVHZAHPTYCTC-CALCHBBNSA-N 447.551 2.473 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(n3c(O)nc4ccccc43)CC2)cc1F 803661175 SBPXWUVNGQLAKI-UHFFFAOYSA-N 439.491 2.427 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCO[C@@H](C(C)(C)C)C3)cc2F)CC1 805008277 IOICRNYMZMXZRP-GHTZIAJQSA-N 448.583 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)NCCCN3C(=O)c4ccccc4C3=O)CC2)cc1F 805820244 IOCDLRORKAFLFY-UHFFFAOYSA-N 440.475 2.352 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cn4cccc(C)c4n3)CC2)cc1 806536225 INVZLEOTUVUEMF-UHFFFAOYSA-N 435.528 2.049 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC[C@H]1NC(=O)OC(C)(C)C 807291175 GYYIOAULHJQRIH-YLJYHZDGSA-N 442.560 2.441 10 20 IECD COC(=O)Cc1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 810049535 RDESDBDAXCATIW-UHFFFAOYSA-N 432.542 2.089 10 20 IECD COc1ccc(N2CCN(CN3C(=O)N[C@@](C)(c4ccc([N+](=O)[O-])cc4)C3=O)CC2)cc1 915796082 VHNHSHMTUDLNPK-QFIPXVFZSA-N 439.472 2.150 10 20 IECD CN1CCN(c2ccc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cn2)CC1 916245529 GKTMTUFQRPPTKL-UHFFFAOYSA-N 438.576 2.012 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 917714948 XCSOIEKVMXFVBR-IYBDPMFKSA-N 441.569 2.117 10 20 IECD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)nn1 1789959775 CKFOGACNLFRZDD-UHFFFAOYSA-N 435.440 2.353 10 20 IECD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1804283657 JTLQRUFDWDRQQA-ASYHBGTLSA-N 437.496 2.401 10 20 IECD CCN(CC)C[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810553989 BWMXIQPGAVCVAQ-KRWDZBQOSA-N 432.565 2.316 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccnc(F)c1 1815422002 RDUKSFODROABOD-AWEZNQCLSA-N 426.408 2.370 10 20 IECD Cc1cnn([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827429312 SPXBKEPUKNPSLK-APWZRJJASA-N 441.532 2.492 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(O)c(F)c2)C1 1845350395 LXJPQAGETLBAMD-UHFFFAOYSA-N 436.443 2.141 10 20 IECD Cc1ccc([C@@H](C)C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847055698 OSQNBHUJRAYUEV-OAHLLOKOSA-N 431.583 2.162 10 20 IECD C[C@H](C1CC1)N(C)S(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 727452667 RDMWPIBFZVUJTK-MRXNPFEDSA-N 448.568 2.007 10 20 IECD COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)c1 743798842 QVYNPZKXBDKWRX-LLVKDONJSA-N 432.458 2.313 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1C 746786387 GKEXAYPXQSDYBG-UHFFFAOYSA-N 443.475 2.137 10 20 IECD Cc1cc(C(=O)COC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1 746944478 KGQOCDLFASFSEX-UHFFFAOYSA-N 446.463 2.079 10 20 IECD C[C@@H](NC(=O)OCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 747301924 OBRKXVWINIYGAB-YLJYHZDGSA-N 438.528 2.319 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(Cc4cccs4)CC3)CC2)cc1 754008869 IEPLEYNFOBKBHH-NRFANRHFSA-N 430.618 2.057 10 20 IECD CC[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 755994437 HBCZSSRPPLTNHH-YFEUJDIGSA-N 447.582 2.465 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCc4n[nH]cc4C3)cc2F)C[C@@H](C)O1 757819945 QAGVNTKDKGBICB-BFYDXBDKSA-N 444.507 2.127 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](C)S(=O)(=O)CC3)cc2F)C[C@@H](C)O1 758399886 PLEFUEGWKGSYGJ-OWCLPIDISA-N 427.542 2.158 10 20 IECD COc1cc(N2CCN(CN3C(=O)C(=O)c4cccc(F)c43)CC2)cc(OC)c1OC 758964008 KUAPSGSLYMRNMJ-UHFFFAOYSA-N 429.448 2.161 10 20 IECD CNC(=O)COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 772057049 IYUSCWIHVSTYIY-CALCHBBNSA-N 443.519 2.423 10 20 IECD C[C@@H](NC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 772999157 ZOOYEHQKGJZSQL-RHSMWYFYSA-N 428.455 2.437 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H](c3ccco3)N(C)C)cc2F)C[C@@H](C)O1 774840952 GWFCZGBCKQSRCU-JXXFODFXSA-N 446.523 2.068 10 20 IECD COC(=O)c1cc(Br)c(S(=O)(=O)NCc2cccc(OC)c2O)s1 777965219 QLTBDXBODQDPIJ-UHFFFAOYSA-N 436.305 2.490 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C)c4ccccc4C3)CC2)cc1 778256650 LKDSQKDGHKGZLW-VAWYXSNFSA-N 434.540 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3c3ncon3)CC2)cc1 778287354 ODXMOFVYEXHSBU-ZBTAVZRMSA-N 425.489 2.037 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCOC2(CCCCC2)C1 789833545 GRERWXAGVCSVFK-SFHVURJKSA-N 447.551 2.401 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1cncc(F)c1 799250767 RSWUCYWCMVDYPG-UHFFFAOYSA-N 426.370 2.331 10 20 IECD COc1ccc(N2CCN(c3nnc(-c4cccc(S(C)(=O)=O)c4)n3C)CC2)cc1F 800727577 YZLOWWWVVXOZQC-UHFFFAOYSA-N 445.520 2.360 10 20 IECD CC(C)c1nc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cs1 804034311 ZTVHLDPRTUOCJB-UHFFFAOYSA-N 430.574 2.420 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)CCc3cccn3C)cc2F)CC1 805008036 YKEPBYUKVOFQEU-SFHVURJKSA-N 443.567 2.060 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C)c3c(C)noc3C)cc2F)CC1 805008087 ZPYDTHXSIAHTQI-HNNXBMFYSA-N 445.539 2.109 10 20 IECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COCCN1CC(F)(F)F 807108388 WCUAZTQZIVCRBY-JKSUJKDBSA-N 435.874 2.389 10 20 IECD CCN(C)C[C@@H]1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770922 PNULVYHGPJQBPA-IRXDYDNUSA-N 438.519 2.173 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O 808158727 ABWYDKCPYXZZPX-HXUWFJFHSA-N 438.528 2.223 10 20 IECD NC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 917911340 FBFRDFNWFAJRMV-UHFFFAOYSA-N 443.447 2.119 10 20 IECD CCCNC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920927639 ZUQJMTFYAYTOHS-KRWDZBQOSA-N 438.528 2.479 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 1320225665 BVYOSXQFJPXERX-UHFFFAOYSA-N 440.500 2.327 10 20 IECD CC(C)C1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CCC1 1801610805 FTHKPZQAERKKGJ-YRNKJSLSSA-N 444.528 2.233 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccn4ccnc34)CC2)C1 1810547445 XATSEXKKYGXIHU-UHFFFAOYSA-N 435.484 2.299 10 20 IECD Cc1nc(C)c(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1810870046 QIBQFQVPJSBFKE-KXBFYZLASA-N 437.456 2.126 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cccnn2c1 1821495861 WKKBJZVYOJQKRH-KRWDZBQOSA-N 447.455 2.483 10 20 IECD Cc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1 1847056478 OBDYDOFBPQNRAQ-UHFFFAOYSA-N 437.974 2.326 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)n(C)c2ccccc12 509553860 IATRIQRIJPJDDZ-LJQANCHMSA-N 447.583 2.430 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)nc3)CC2)cc1 726608809 DEFXDPYNAYRBJO-UHFFFAOYSA-N 425.533 2.395 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3C3OCCO3)cc2F)C[C@@H](C)O1 728172991 QENMDEBXXWZEEG-LLGFUMIMSA-N 435.540 2.283 10 20 IECD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729535289 PAFVMIUMXBETHQ-LBPRGKRZSA-N 442.921 2.470 10 20 IECD CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(CCN4CCOCC4)C3)cc2)CC1 734669033 OKUWQXYFJOCKJV-JOCHJYFZSA-N 429.609 2.129 10 20 IECD O=S(=O)(c1ccc(NC(=S)NNc2c(F)cccc2F)cc1)N1CCOCC1 735625487 IETODIPJDURLSE-UHFFFAOYSA-N 428.486 2.299 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741096748 FSIPTYYUECHWKY-UHFFFAOYSA-N 442.541 2.004 10 20 IECD CC(C)(C)OC(=O)NCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 742362634 VLKIWHGKZSHCQT-UHFFFAOYSA-N 444.511 2.083 10 20 IECD O=C(Nc1ccn(CCN2CCOCC2)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 743168790 MAXBFURYJOUYCR-IBGZPJMESA-N 429.521 2.134 10 20 IECD COC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 750538962 OWGLLTJTEXPVAW-KRWDZBQOSA-N 435.458 2.256 10 20 IECD O=C(NCc1cccc(Br)c1O)c1ccc(S(=O)(=O)N2CCCC2)o1 765767475 ZZDBILUGKLJJMK-UHFFFAOYSA-N 429.292 2.462 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cn4c(n3)SCC4)CC2)cc1 767942315 QRKYEAPTTVSKCK-UHFFFAOYSA-N 444.605 2.051 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1 771291922 YGUCPYZJCRVUPP-HXUWFJFHSA-N 446.573 2.219 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)c4ncccc43)cc2F)C[C@@H](C)O1 777714187 PJFAQHBJEZOCPS-CALCHBBNSA-N 427.524 2.407 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1 779709565 WLDYJPVAEOXXCM-IZKUIKQZSA-N 435.524 2.446 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)on1 781277683 TYRLHNDBLNTQNR-UHFFFAOYSA-N 434.360 2.032 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 781451080 YAVMMFLITOMZTN-UHFFFAOYSA-N 443.475 2.076 10 20 IECD O=C(CN1C(=O)c2ccccc2C(F)(F)C1=O)NCc1ccc(N2CCOCC2)c(F)c1 782579221 GMIZAUNEQGQJBR-UHFFFAOYSA-N 447.413 2.053 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCn3c(C)nc4ccccc43)CC2)cc1 785496394 LNZBRAHONDFXPB-UHFFFAOYSA-N 435.528 2.255 10 20 IECD O=C(COC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(O)c(O)c1 785977298 LLBAYHFOQNJFIQ-HNNXBMFYSA-N 442.424 2.291 10 20 IECD CCO[C@@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 788783806 VMMJVHUIXYIWQU-OFNKIYASSA-N 436.572 2.333 10 20 IECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 789845950 XLBLJTYJUQAISK-FQEVSTJZSA-N 430.480 2.063 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)N1CCCSCC1 789948399 ACTAEXXAPXFDKG-UHFFFAOYSA-N 431.480 2.124 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 790226088 SWPBKDWAGBYKCW-SUQGKYDKSA-N 428.460 2.084 10 20 IECD Cc1nc2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)cc2s1 793387186 BSYSIPDHDJMZNJ-UHFFFAOYSA-N 441.512 2.475 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3ccc(F)cc3F)cc2F)CC1 793823743 QMFNVAPWXOCURG-UHFFFAOYSA-N 448.489 2.221 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@H](C)O3)cc1 797431760 XUDNORDZOJAMEB-JTQLQIEISA-N 431.923 2.340 10 20 IECD CN(CC1CCOCC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449057 MUMKOKDIGYTZAW-UHFFFAOYSA-N 425.476 2.258 10 20 IECD CCc1ccc([C@@H](O)CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 804149366 LRIJPALSFSZDEN-OTOIZHKDSA-N 437.540 2.312 10 20 IECD O=C(NC[C@H]1CSCCS1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806468019 RCGMYHYBJNMSON-BBRMVZONSA-N 445.557 2.338 10 20 IECD C[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855847 KGHZKTIMQAENOV-LJQANCHMSA-N 435.572 2.449 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CCCN(C)CCN(C)C)cc2F)C[C@H](C)O1 812009020 LJVVGGYGEKOUND-OALUTQOASA-N 437.604 2.464 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(=O)n(Cc2ccccc2)n1 919970690 VHXYSCXDNLOGPL-UHFFFAOYSA-N 436.487 2.322 10 20 IECD Cc1nn(C)c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1[N+](=O)[O-] 920661425 QHFNPVLJVQQZGW-UHFFFAOYSA-N 448.391 2.208 10 20 IECD COc1ccc(CNC(=O)CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920866744 KSSQCGIOZQIVMT-KRWDZBQOSA-N 426.517 2.208 10 20 IECD C[C@H](OC[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 921006553 CYQSICVDAFTBII-HKUYNNGSSA-N 443.523 2.143 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c(C(F)(F)F)c3)cc2)C1 1343403736 FQJUZHGGWMKQSJ-ZDUSSCGKSA-N 430.452 2.214 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1 1785092488 MUFGTDSUNHGOPD-XMMPIXPASA-N 437.496 2.129 10 20 IECD C[C@]1(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC=CCC1 1785510704 YVGVSVARDMKJJN-RGXGMQNRSA-N 442.512 2.393 10 20 IECD O=C(Cc1ccccc1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289793 UGAKVKPCZPKSIG-GFPDGJBOSA-N 438.480 2.403 10 20 IECD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cs1 1807990192 GFRLYKDFWRWNIP-IFXJQAMLSA-N 439.497 2.286 10 20 IECD CCc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)co1 1816724975 FNOUZHURFCZWAE-JTQLQIEISA-N 429.458 2.039 10 20 IECD COCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146279 AWAFVVLQVDFYDM-SFHVURJKSA-N 438.488 2.231 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=COCC2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818147626 AQCMXABONSIHGT-LJQANCHMSA-N 448.483 2.499 10 20 IECD O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)c1ccco1 1825058702 JUVIIMNDVFIRJJ-MRXNPFEDSA-N 427.457 2.202 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)c2cnc[nH]2)CC1 1825883665 AKMNXMFROGEVCA-OAQYLSRUSA-N 448.527 2.436 10 20 IECD Cc1ccccc1OCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842747722 WBLOOKFMKBEXKV-CSKARUKUSA-N 438.480 2.407 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCCc3ccccc3[N+](=O)[O-])C=C2)cc1 466247941 KDXBTRXLWSPNCN-UHFFFAOYSA-N 425.466 2.297 10 20 IECD COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1 726701908 ASXUACFIYWGWOU-HNNXBMFYSA-N 432.546 2.372 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C(=O)N(CC)CC)cc3)nc12 729124249 PLXNQBKWANFWHN-UHFFFAOYSA-N 440.456 2.451 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1 729535081 JJHQIUWBVUWMDD-ZETCQYMHSA-N 435.321 2.363 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CSCC(=O)N3CCCCC3)cc2F)CC1 730235053 KVGLNNVULAGQDJ-UHFFFAOYSA-N 436.597 2.330 10 20 IECD CCN(CC)c1ccc(CNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)cc1F 731346595 YEBMPPRZDMURFG-UHFFFAOYSA-N 426.500 2.037 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 734491697 NHBMEWURSMFWTI-MRXNPFEDSA-N 432.502 2.083 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(N2CCOC2=O)cc1 738902724 HDLHKWYZGFXIRW-UHFFFAOYSA-N 444.513 2.200 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 740491890 OWRGPLVECGZHHU-IBGZPJMESA-N 443.475 2.085 10 20 IECD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)C1 746979897 YBOHLLSQXSDTPO-ROUUACIJSA-N 433.572 2.223 10 20 IECD COCCONC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 748771745 TVBVRSFRYUTDFT-XYOKQWHBSA-N 431.333 2.345 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@]3(O)CCc4ccccc43)CC2)cc1 752641270 NOQVLAGTFHDKSW-RUZDIDTESA-N 438.572 2.341 10 20 IECD COc1ccc(N2CCN(C(=O)C[C@](O)(c3nccn3C)C(F)(F)F)CC2)cc1F 753739896 WIFQKFNAWRAWSD-SFHVURJKSA-N 430.402 2.057 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CN(c5ccccc5)C[C@@H]4C3)CC2)cc1 754011503 LIWSSJIFTJHQHU-HWBMXIPRSA-N 436.600 2.246 10 20 IECD CC(=O)N1CCCC[C@H]1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 756232833 RSZPZRIPROIFAV-IBGZPJMESA-N 434.448 2.345 10 20 IECD COc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)cc1F 757851592 MYFARZAAIBVDIE-QFIPXVFZSA-N 428.464 2.245 10 20 IECD COCCO[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 760965381 JVNGPRPRQOFARX-QWFCFKBJSA-N 437.556 2.183 10 20 IECD CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 769000832 QMJJUQCUTDULRO-UHFFFAOYSA-N 447.438 2.233 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771056772 GQMLPUYRGWBNNW-SFHVURJKSA-N 437.949 2.229 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1 774804815 CFALLMVVPHQTOY-FQEVSTJZSA-N 444.601 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@@H](O)c3cccc(F)c3)CC2)cc1 778391864 YMNRFEBIBYUJGN-SAGJMLOXSA-N 441.503 2.277 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1 783316222 JYUOGIWCRRPGHY-UHFFFAOYSA-N 432.546 2.036 10 20 IECD CCN(CC)Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 787287189 ADBPDNGYFVWFIH-UHFFFAOYSA-N 438.572 2.298 10 20 IECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]1n1ccnc1 789855918 LMVSBCJAAIWBDZ-FXAWDEMLSA-N 427.574 2.162 10 20 IECD Cc1cc(-c2nnc(N3CCC(NS(C)(=O)=O)CC3)n2C)c(C)n1-c1ccccc1 800762580 LNNHHGIFAQNSPA-UHFFFAOYSA-N 428.562 2.408 10 20 IECD C[C@@H](NC(=O)C(=O)NCC[C@](C)(O)c1ccccc1)c1ccc(N2CCOCC2)cc1 803315491 JTLBBXBJUQSDFZ-KOSHJBKYSA-N 425.529 2.114 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 805013174 ZNGQHQLAVVIKOA-ZDUSSCGKSA-N 428.532 2.129 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCC[C@H]1N1CCOCC1 806088063 LTRJWJUMUVPKBY-FGZHOGPDSA-N 430.593 2.249 10 20 IECD CC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 807953846 ZCDVPKAAZDBXRR-MRXNPFEDSA-N 434.968 2.273 10 20 IECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807953892 ARERSJIECUXUBE-LESCRADOSA-N 434.968 2.223 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1 914456295 WTCZLMZDHCCDDD-UHFFFAOYSA-N 447.495 2.134 10 20 IECD COc1ccc(N2CCCN(CN3C(=O)C(=O)c4cc(OC)c(OC)cc43)CC2)cc1 917485875 ULSHTZLZYNOPGY-UHFFFAOYSA-N 425.485 2.412 10 20 IECD CN(Cc1ccccc1O)C(=O)NCc1cccc(NC(=O)CCN2CCOCC2)c1 918094503 ZOGZCSUKTPIDRI-UHFFFAOYSA-N 426.517 2.395 10 20 IECD CC(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918119198 YCRYHWRPPWMWML-FQEVSTJZSA-N 443.592 2.082 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(N2CCCC2)ncc1Cl 1320520482 ZTJXYAIPLYCPOU-AWEZNQCLSA-N 434.880 2.046 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 1324121775 VJVRWATWRBRKBS-YJBOKZPZSA-N 444.459 2.189 10 20 IECD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)no1 1779697380 DFOJRVNZFDAJGE-HXUWFJFHSA-N 435.864 2.059 10 20 IECD CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)N(CC)CC 1806170078 VVLOZLUAZFNBHZ-SFHVURJKSA-N 432.565 2.458 10 20 IECD CNCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807140920 ZKJDVRLYLIARSD-YWZLYKJASA-N 446.935 2.465 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992822 DJXKBAHFQOMDJR-OPAMFIHVSA-N 435.484 2.168 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995694 TUPZDXNLCYNBOE-KKSFZXQISA-N 435.484 2.168 10 20 IECD C[C@@H](CC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1815299197 MHZMJVVCEJXFJJ-IINYFYTJSA-N 449.895 2.292 10 20 IECD COC1(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CCC1 1816728121 JUPCDZJFLNWWCA-GFCCVEGCSA-N 432.502 2.134 10 20 IECD O=C(CC1CCC1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435320 GYGMZFJSKMVAPA-NRFANRHFSA-N 438.908 2.011 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CSc2ccc(F)cc2F)C1 1841563764 CLGZIAYGZSIFRR-UHFFFAOYSA-N 435.452 2.380 10 20 IECD Cc1ccc([C@H](C)C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847055695 OSQNBHUJRAYUEV-HNNXBMFYSA-N 431.583 2.162 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)CC2)cc1 110352553 CVLZAHKCZJGPQI-XMMPIXPASA-N 436.512 2.247 10 20 IECD COc1ccc(O)c(CNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1 734061038 HXJUFCRPYPVWBD-UHFFFAOYSA-N 442.516 2.396 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c[nH]1 742277824 FZPDSANAAHHQGM-BETUJISGSA-N 425.482 2.033 10 20 IECD Cc1ccc([C@H](C)[C@@H](O)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 745759505 TZBLYQIFHQANBM-GAJHUEQPSA-N 444.503 2.295 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(C(=O)N4CCOCC4)cc3)ccc21 746705201 HYYUTVOABUSKDP-UHFFFAOYSA-N 429.542 2.020 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCN1C[C@@H]3CC[C@H](C1)O3)c2[N+](=O)[O-] 753895277 JUCDBZIMGPZWBD-OKILXGFUSA-N 436.420 2.390 10 20 IECD COC(=O)c1ccc2c(c1)CN(C[C@@H](O)CN1CCN(c3ccc(OC)cc3)CC1)CC2 754096145 ANSKOLDBZWXKIU-QHCPKHFHSA-N 439.556 2.023 10 20 IECD O=C(NCCS(=O)(=O)CC1CC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 765679219 PXZOHFYORLNSFC-UHFFFAOYSA-N 449.495 2.166 10 20 IECD CNC(=O)Cn1nc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C 767965103 HRKOGFWKUQQBDU-GASCZTMLSA-N 432.500 2.012 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCOC4(CCOCC4)C3)CC2)cc1 769016180 KONWCYNXHJHWRJ-HXUWFJFHSA-N 446.592 2.235 10 20 IECD CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 769859917 UDBKBTFEXVKFOW-CYBMUJFWSA-N 438.531 2.374 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1 774865828 UYBRAWDUIXFASY-OAQYLSRUSA-N 443.519 2.460 10 20 IECD Cc1cc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)ccc1S(N)(=O)=O 775225090 NOGLCUNQKOHIGG-UHFFFAOYSA-N 434.587 2.195 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(NC(C)=O)cc3)CC2)cc1 778225416 XPQVCJRYXJNIOL-VAWYXSNFSA-N 436.512 2.175 10 20 IECD CSCC[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 782187650 RMLXYEMHNKIJAU-ZNMIVQPWSA-N 435.498 2.121 10 20 IECD COCCn1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 784309563 RENFWKYXMYVJKN-UHFFFAOYSA-N 433.420 2.100 10 20 IECD CC[C@]1(CO)CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 784474308 HQOUEZPDMKXFRP-HSZRJFAPSA-N 442.539 2.389 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1 785425477 ZXRBXRSLKNGLOQ-MRXNPFEDSA-N 443.935 2.295 10 20 IECD C[C@H]1CCCCN1C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321098 SKRUPCWVPWTJDB-UNMCSNQZSA-N 442.604 2.252 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N(C)Cc1ccccc1 789854248 GEDAVPUBRVKEPL-IBGZPJMESA-N 440.613 2.493 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C)c2Br)cc1 797431064 FNHBZYWOTDOYCB-UHFFFAOYSA-N 434.337 2.434 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc4c[nH]nc4c3)CC2)cc1 803562629 AZNLMUDPUTYQCJ-HJWRWDBZSA-N 433.512 2.135 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@@H](C)N1CCOCC1 804771789 NZLICGAXOZYQFB-RTBURBONSA-N 442.560 2.100 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C2CCN(C(=O)OC)CC2)cc1F 804852124 ZVHWVQHTBDOQNY-HNNXBMFYSA-N 436.528 2.271 10 20 IECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)c1 807100114 KCAHQYGOVFXUNG-UHFFFAOYSA-N 436.556 2.360 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)CC2)cc1 808059174 NGNUGTIYJBQVRA-XZOQPEGZSA-N 436.556 2.296 10 20 IECD CN(CCC1CCOCC1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855370 XNMCQGMFOUAZMB-UHFFFAOYSA-N 442.604 2.110 10 20 IECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1cccc2ncccc12 920637519 HSJNDAQGRSZUPW-LBPRGKRZSA-N 429.454 2.496 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(CO)c3)cc2F)C[C@H](C)O1 921224569 AWVCSZIFDCJROQ-HOTGVXAUSA-N 430.476 2.405 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 1321269195 ZDBXEYWHHSTUSE-IUODEOHRSA-N 434.518 2.284 10 20 IECD COC(=O)c1cc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)oc1C 1325499489 STHBYXASUKBIRR-UHFFFAOYSA-N 430.505 2.005 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C1CC(F)(F)C1 1783650096 WKGHBUSZUIWSOH-NKFCBESUSA-N 444.862 2.390 10 20 IECD Cc1c(Cl)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1783722155 ZYYPEAMKWQPFFT-OWQGQXMQSA-N 445.903 2.362 10 20 IECD CC(C)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1790835262 AXOXWTYKGMMXPP-CUWPLCDZSA-N 440.544 2.195 10 20 IECD CCc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795319146 IAVRRJQAMGPZLP-ACHSLPGTSA-N 435.484 2.282 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2C=CS[C@@H]12)C1=NN(c2ccccc2)C(=O)C1 1801321385 YWZNDUDMUKLKKK-KICUZLOKSA-N 436.537 2.293 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993346 IGBJNZBFHSDRBS-HTAPYJJXSA-N 440.500 2.024 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CCSCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000588 JROXFUUJMBCTFD-OXQOHEQNSA-N 442.541 2.351 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465172 RAQKHBKXNJLOGK-ZBPHCFQXSA-N 449.486 2.238 10 20 IECD COC(=O)CCCCCC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550504 MEAFYYBQTZOXDX-UHFFFAOYSA-N 447.532 2.461 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc[nH]n2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145949 NLLOUNJKKIZHJC-GOSISDBHSA-N 446.471 2.232 10 20 IECD CCC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1821904755 HNVAYSOMEXBGLM-KRWDZBQOSA-N 436.472 2.174 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428353 OWSCPNZORAUHAA-QGZVFWFLSA-N 427.505 2.380 10 20 IECD CC(C)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828249064 DNBHVRSNRKLEOE-GQOHGMTASA-N 438.600 2.128 10 20 IECD O=C(Cc1ccsc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837956455 DKGLSCLOWPWNDO-UHFFFAOYSA-N 445.541 2.409 10 20 IECD Cc1nc(C)c(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1842413941 JNBSFRROFZIFAV-UHFFFAOYSA-N 437.525 2.370 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)COCc2ccccc2)C1 1842815991 IBSVBWINPIDNSQ-UHFFFAOYSA-N 446.507 2.200 10 20 IECD O=C([C@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248977 XYECXGRNQLCYLA-GJZGRUSLSA-N 429.423 2.392 10 20 IECD CCN(CC)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ccccc1 1843250806 QCBCCQGIURLWDK-OAQYLSRUSA-N 438.528 2.393 10 20 IECD Cn1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c2cccnc21 1844152924 HMLMKPHKEDSKEK-SOFGYWHQSA-N 448.479 2.221 10 20 IECD C[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccn1 1846665083 URYFXAUYDRCKIW-KRWDZBQOSA-N 431.496 2.181 10 20 IECD COCC(=O)N1CCc2c(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)cccc21 472782339 DHBDJSMDKLFRBS-UHFFFAOYSA-N 434.496 2.277 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(c4nc(-c5ccccn5)no4)CC3)nc12 726865993 CDYSUBGSQIGXOW-UHFFFAOYSA-N 449.471 2.436 10 20 IECD CCOC(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 727032557 JPHOTZNONXPNKQ-SFHVURJKSA-N 445.564 2.151 10 20 IECD Cc1cnc2c(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)cccc2c1 728015212 LZQUSNTZYSDMTR-UHFFFAOYSA-N 435.483 2.414 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1F 731372463 UMEDVZMKLBWZEV-UHFFFAOYSA-N 437.537 2.215 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-c2ccco2)nc1O 743869199 KKHKQDZJVSYASJ-UHFFFAOYSA-N 427.482 2.212 10 20 IECD CO[C@H]1Cc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2C1 752991809 XYDBEMWQWJJMCM-NRFANRHFSA-N 429.542 2.357 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 754043287 KJBIIFAOIFPEMB-UNMCSNQZSA-N 446.636 2.052 10 20 IECD COc1cccc(OC)c1OC[C@@H](O)COc1ccc(N2CCN(C(C)=O)CC2)cc1 755302503 CYZKRROARLVTJA-IBGZPJMESA-N 430.501 2.191 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCC(=O)C[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760557244 BKMZMNKPZJYXKH-DJJJIMSYSA-N 446.525 2.473 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)CC2)cc1 764391578 ZFIYZSGNNZXCHU-XXBNENTESA-N 429.609 2.331 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 774147175 SOOPNANFIMGGEN-WJOKGBTCSA-N 447.532 2.027 10 20 IECD COC(=O)C1(c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CC1 776302105 HJDGMVSEYFTZAX-UHFFFAOYSA-N 430.526 2.206 10 20 IECD COc1c(F)cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 777860173 QYYHDDNVFLPVDB-UHFFFAOYSA-N 439.465 2.400 10 20 IECD COC(=O)c1ccc(F)c(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778223290 KYPDTCSINVVWMX-KTKRTIGZSA-N 441.459 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(NC(=O)C4CC4)nc3)CC2)cc1 778265374 FFDIKUWQFJHCTI-ZHACJKMWSA-N 449.511 2.282 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H](O)[C@H](O)c3nc4ccccc4[nH]3)cc2F)C[C@@H](C)O1 779607791 UFCABMNDBXRSAX-RINLGRHXSA-N 442.491 2.026 10 20 IECD C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(N2CCOCC2)cc1 784244687 DJDSRQFRLJPSFL-GCJKJVERSA-N 437.544 2.470 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)cc1 785432617 FSNIYJOKKFWQAQ-UHFFFAOYSA-N 436.343 2.419 10 20 IECD CC(C)Oc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 787239655 CXDODTIYRKERLS-UHFFFAOYSA-N 443.519 2.425 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1 787636210 GSXYSGIBRJKLEG-OAQYLSRUSA-N 444.576 2.414 10 20 IECD CC(C)(C)OC(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788911114 OTLQYFXVABDJPY-UHFFFAOYSA-N 430.549 2.419 10 20 IECD Cc1noc(C)c1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789825485 MHACKCQWJYQGAL-KBPBESRZSA-N 432.496 2.019 10 20 IECD CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@@H]1C 789950318 OCQVEXVXKSFTKO-KSSFIOAISA-N 443.466 2.042 10 20 IECD C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 790554290 IXYBMENHQWFSMV-QWHCGFSZSA-N 430.468 2.461 10 20 IECD C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793717139 HHSIQLGPVVOOSP-STZQEDGTSA-N 448.567 2.409 10 20 IECD CO[C@@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798775505 XNOPJJHBOPOFEV-JOCHJYFZSA-N 433.420 2.065 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803309181 QWBCOOAGABHHHX-CTNGQTDRSA-N 428.577 2.177 10 20 IECD C[C@H](NC(=O)C(=O)N(CCO)[C@H]1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803309859 DLVSMDZCUGGXFM-MBSDFSHPSA-N 437.540 2.209 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)cc1F 803661455 BSYUZHNWGZSLAU-UHFFFAOYSA-N 431.483 2.243 10 20 IECD C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662062 GNFOGUASKMLZGC-GOEBONIOSA-N 436.528 2.270 10 20 IECD O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 804007328 FRHFILAKHLRHDU-OAQYLSRUSA-N 447.491 2.431 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H]([S@](=O)CC)C2)cc1F 804851550 GFWFYMBQQIAFIM-RIYSCVPDSA-N 425.570 2.484 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N3CCCC[C@H]3C)cc2)CC1 805023785 AVTRDVIAGFAAJV-RTBURBONSA-N 428.577 2.445 10 20 IECD O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 806187232 MAMSLCQINAKGHL-MRXNPFEDSA-N 441.450 2.333 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 807096276 SMFYBVINDPPMKP-UHFFFAOYSA-N 436.556 2.346 10 20 IECD CCC1(O)CCC(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 809319877 BOEBXVOVAJKEGJ-MAHZMETKSA-N 435.540 2.255 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809443883 KVNDQDZVMYHDPJ-KRWDZBQOSA-N 428.533 2.075 10 20 IECD CN(Cc1ccccc1O)c1nnc(-c2ccc(-n3cnnn3)cc2)n1C[C@@H]1CCOC1 812388070 WBBBUZWPXPQEAY-INIZCTEOSA-N 432.488 2.299 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 921202865 IHUHZKSYAMTYCG-HFMPRLQTSA-N 446.636 2.457 10 20 IECD CCO[C@@H](C)c1noc(CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1324752717 RGPOSXLDUBBZLH-SFHVURJKSA-N 446.571 2.376 10 20 IECD Cc1nn(C)cc1CCC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1324801771 LKJVWQVOIWRMKD-HZPDHXFCSA-N 446.523 2.273 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243326 HZCLFORBCLRXTN-MIUNTBIASA-N 449.866 2.192 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1n[nH]c2cccc(F)c12 1796604284 ZARQRRYFZNZQSS-CLLJXQQHSA-N 425.420 2.074 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c(F)cccc12)c1cc(O)nc(O)c1 1798148791 UDGFYEPGDRTHOM-CLLJXQQHSA-N 425.420 2.074 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnn(C)c2)C3)cc1 1799620005 HQUFBSKSZYUDHL-IUTQVRIDSA-N 447.539 2.345 10 20 IECD Cc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1803268279 XEOICTONTMIOLC-HXOBKFHXSA-N 447.495 2.154 10 20 IECD Cc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1804282918 HHAJBBNFMYEYQK-QZJJICTCSA-N 437.496 2.401 10 20 IECD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)ccn1 1816725801 MCBQDFLRSIJGSQ-ZDUSSCGKSA-N 425.470 2.192 10 20 IECD O=C(c1ccncc1Cl)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038154 BOHHUENOEWISGQ-HWKANZROSA-N 429.860 2.382 10 20 IECD O=C(NCc1ccccc1O)c1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 109678915 CWBMRJBRTNPAJY-UHFFFAOYSA-N 438.465 2.293 10 20 IECD COC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 727611935 AYMRMZYOUDBKRC-UHFFFAOYSA-N 448.426 2.235 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)ccc21 728640838 ZMCYQXRVKHGMHU-AEFFLSMTSA-N 429.517 2.174 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)N[C@@H](C)c3cc(OC)ccc3O)C2=O)cc1 728980885 PJXOXUDRMYVEFN-WHEQGISXSA-N 427.457 2.054 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(OC)cc(OC)c3)cc2F)CC1 730391486 NZZHMNNABDAAPP-UHFFFAOYSA-N 444.507 2.240 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCN(c2ccc(F)cc2)CC1 731870804 XVWKZDBSFRKYLT-IBGZPJMESA-N 426.536 2.489 10 20 IECD COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(c4ccccc4C(N)=O)C3)CC2)cc1 732576141 PNGNKHNHIYQQKB-SFHVURJKSA-N 437.544 2.341 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3c(F)cccc3F)cc2)C1 741081118 LLYXIVGVVSFCTJ-BEFAXECRSA-N 432.471 2.199 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N(C)C)c(F)c2)cc1S(=O)(=O)N1CCOCC1 746797766 BFUIIXABBZMPJI-UHFFFAOYSA-N 435.521 2.151 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)CC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 749347608 ULIDJKDNFGBBBS-SFHVURJKSA-N 431.558 2.086 10 20 IECD C[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cnn(C)c1 750549705 CHZSKAKZMGIFOQ-OAGGEKHMSA-N 432.496 2.136 10 20 IECD NC(=O)[C@@H]1CC(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)=NN1c1ccccc1 751302737 QDQRQDMNRIPAMX-SFHVURJKSA-N 425.452 2.455 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(S(N)(=O)=O)c3)CC2)cc1F 753796382 XMNUFZJSHJSQBE-AWEZNQCLSA-N 436.509 2.075 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCN(CC(C)C)C3)CC2)cc1 756988095 KTILQSZTKSCPIK-NRFANRHFSA-N 431.625 2.484 10 20 IECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 762961931 DALCJCOFAQJYRC-UHFFFAOYSA-N 435.546 2.466 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3cc(C(F)(F)F)ccn3)CC2)c1 771597676 QNCMOBWKOBDAAT-UHFFFAOYSA-N 444.435 2.140 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 776855339 HHTKECMYCQLQSB-ZFDALGJYSA-N 439.528 2.059 10 20 IECD CNC(=O)[C@@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c2ccccc2O1 783317310 PISBELYKJIWRSV-NRFANRHFSA-N 438.528 2.030 10 20 IECD CC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 785506790 VPAXXCRZIWHBFN-OAHLLOKOSA-N 434.968 2.320 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 785527019 IMRUFPUTGCEUAR-NJDAHSKKSA-N 442.604 2.409 10 20 IECD C[C@H]1CN(c2ccccc2F)CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311784 ZYHJKDCGKTTWHQ-SFHVURJKSA-N 440.519 2.016 10 20 IECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789828791 YOFKAWNNQINOLE-XFAGBWLFSA-N 449.567 2.455 10 20 IECD C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686892 JMHYQMWSJFMQBM-FUHWJXTLSA-N 444.576 2.447 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)n3ccc4ccccc4c3=O)CC2)cc1 805631056 ZTESHYWQFPAVPQ-SFHVURJKSA-N 449.507 2.463 10 20 IECD CC[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 805773387 QLRXGSWRCKDIFR-LSDHHAIUSA-N 440.521 2.298 10 20 IECD CC(C)(C)[S@](=O)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806194909 MUDSBQFZSHILMQ-NGFNCXNUSA-N 445.532 2.036 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 807095489 BCBZNMWUAMLZDD-UHFFFAOYSA-N 437.588 2.238 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCc2c(cnn2-c2ccccc2)C1 807288903 CDWUKZUJKQWKIH-UHFFFAOYSA-N 427.508 2.450 10 20 IECD CN(CCc1ccncc1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769930 JTUFIHAOIJRTBD-KRWDZBQOSA-N 432.471 2.469 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC1 807826854 VQBYDISCMDAHFL-QGZVFWFLSA-N 432.565 2.474 10 20 IECD CC(C)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855264 VJLVKAWRLOSRSB-QHCPKHFHSA-N 442.604 2.108 10 20 IECD COc1ccc(O)c(CNc2ccc(S(=O)(=O)NCCCN(C)C)cc2[N+](=O)[O-])c1 811806046 IFUYTBXBRFZWHQ-UHFFFAOYSA-N 438.506 2.151 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(OC)c1C 815397126 JWYTYBSYOBJMDP-UHFFFAOYSA-N 445.491 2.367 10 20 IECD CN(C)C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 816591133 VYODFYGJMLEFRM-CQSZACIVSA-N 425.938 2.492 10 20 IECD CN1CCC(N(C[C@H](O)CC(C)(C)C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 857501092 FFORXKJBPNGGND-QGZVFWFLSA-N 441.594 2.097 10 20 IECD CN(C)S(=O)(=O)N1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 914575722 XYISAFBFYFVUFW-UHFFFAOYSA-N 430.534 2.465 10 20 IECD CCOC(=O)NCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 915027050 JBSBECHUCBVPOB-CYBMUJFWSA-N 438.436 2.468 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(-n4cncn4)nc3)cc2F)C[C@@H](C)O1 918204994 XIPSPBGERQHOBR-IYBDPMFKSA-N 439.495 2.414 10 20 IECD CCCNC(=O)[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc2O1 918306096 RINVNYCCGKIMOU-OAQYLSRUSA-N 438.528 2.031 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2ccccc2)CCOCC1 918644785 KOMPBALLAUDPDN-UHFFFAOYSA-N 428.554 2.286 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc1 919963568 DSLAHLJGILXXDE-UHFFFAOYSA-N 446.498 2.032 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@@H]3CCCO3)cc2)CCC1 1791417043 NMXPFGWINOFINI-HNNXBMFYSA-N 433.555 2.160 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@H]31)C2)c1cc(O)nc(O)c1 1796137774 PMKWQALWNXLYTE-FAMUGIINSA-N 443.544 2.303 10 20 IECD C[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1(F)F 1796935573 UOJRRXXATVDIPP-QRHKASNESA-N 430.455 2.463 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808470213 UJBJGJBFJXTKHC-DYESRHJHSA-N 449.486 2.382 10 20 IECD Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1808532504 CKPBSEVNACUQRE-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C3(Br)CC3)CC2)C1 1810547210 TXWYFDDUKNNFTG-UHFFFAOYSA-N 438.322 2.265 10 20 IECD CCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1826091908 WWIKRKCKUBREHG-GOSISDBHSA-N 427.505 2.256 10 20 IECD O=C(C1CCC(O)CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428750 HNCRFWRARTWDPQ-KVZIAJEVSA-N 431.533 2.277 10 20 IECD Cc1ccc(C(=O)OCC(=O)NCC(=O)Nc2ccccc2Br)c(O)c1O 110001460 VLZWXQLOEYCMDO-UHFFFAOYSA-N 437.246 2.080 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(S(N)(=O)=O)cc2)cc1 111208498 AVSGZLSIOLUZQY-HXUWFJFHSA-N 431.558 2.150 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 731051152 WNNFEAPJJKOSGJ-UHFFFAOYSA-N 446.891 2.473 10 20 IECD C[C@H](NC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1)c1ccc(N2CCOCC2)cc1 732571480 DSUFQGJORJMILL-HKUYNNGSSA-N 437.544 2.261 10 20 IECD C[C@H]1[C@@H](C)N(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCS1(=O)=O 736374631 CHEWHMKPSNUPCA-KGLIPLIRSA-N 449.495 2.259 10 20 IECD Cc1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737246602 ZUVUFWDPGKZWRJ-UHFFFAOYSA-N 435.933 2.138 10 20 IECD CC(C)COC(=O)N1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 749177646 CKVDYJGBDXPMKX-IBGZPJMESA-N 445.564 2.008 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1C 754216537 UHTWGPIUEPBBSS-UHFFFAOYSA-N 429.448 2.217 10 20 IECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NCC(=O)Nc1ccc(F)c(F)c1 756336577 OKICCVTXUFLVIF-KRWDZBQOSA-N 433.455 2.406 10 20 IECD COc1ccc(N2CCN(CCNc3cc(N4CCCC[C@H]4CO)ncn3)CC2)cc1 764799838 MAVMFIAOCXIREV-FQEVSTJZSA-N 426.565 2.071 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)CC2)cc1 765715814 LGRYSWBIGBDAAY-JOCHJYFZSA-N 443.592 2.050 10 20 IECD CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)o1 768053580 MALZEZAYXQFFDL-UHFFFAOYSA-N 426.452 2.263 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)Cc2cc(Br)cc(OC)c2O)C1 769301750 DMMZQBUQGRLGRF-ZDUSSCGKSA-N 443.338 2.397 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)[C@H]3CCCC[C@H]3C(=O)OC)cc2F)CC1 772648423 CWNKCBJDIMZCRC-XLIONFOSSA-N 441.569 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](C)[C@@H](n4ccnc4)C3)CC2)cc1 778327316 WOIRZWCXHWXEEP-CPVCZIGASA-N 437.544 2.206 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc([N+](=O)[O-])ccc3O)CC2)cc1 778403674 KWFSFWQPMAPELM-CMDGGOBGSA-N 426.429 2.153 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)nc12 778983486 QQIZYBCCFARVHT-ZIAGYGMSSA-N 433.509 2.347 10 20 IECD CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)c1ccc(O)c(O)c1)C2=O 782057573 ITEWDYMVSPZQKE-UHFFFAOYSA-N 432.473 2.351 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 786367710 JBEMIZWVJJMOCC-UHFFFAOYSA-N 443.475 2.227 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCn2c(Cc3ccccc3)nnc2C1 788937897 OEEUMTVJMJYPQP-UHFFFAOYSA-N 444.539 2.128 10 20 IECD CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789839814 AMPGLBWWNAQBJT-UTKZUKDTSA-N 449.567 2.361 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CCC(=O)OC(C)C)CC2)cc1 792601573 YIXNIYUWOPBHEY-ZGKFYVQTSA-N 431.533 2.137 10 20 IECD CCN(Cc1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793732976 KFOSHMZRWRSOJG-NRFANRHFSA-N 436.556 2.362 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 802089414 MZEDMMCMZYAJEC-UHFFFAOYSA-N 440.548 2.233 10 20 IECD CN(C)c1ccc(CN(C(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)C2CC2)cc1 806565680 RQCPRJRIJFFVBK-MRXNPFEDSA-N 436.500 2.249 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCC[C@H]1CCO 807771017 QZUHXLDYVAUPKN-WBVHZDCISA-N 425.476 2.137 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1 814679863 PSVOEEXKLZFEGR-IBGZPJMESA-N 436.512 2.256 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]4(CCCN(C)C4)C3)cc2F)C[C@@H](C)O1 815144730 NMALIGMLMJQMFU-KHCICDEESA-N 432.584 2.473 10 20 IECD O=C(Nc1ccc(N2CCOC2=O)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918296102 IFUDBLOXGZOUBI-LJQANCHMSA-N 439.468 2.495 10 20 IECD C[C@H](C(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1)n1cccn1 919812888 KSYRLVIPSNMNRM-CYBMUJFWSA-N 443.485 2.412 10 20 IECD COc1ccc(N2CCCN(CC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 1317986595 ATZOKBHZTVHNGR-UHFFFAOYSA-N 432.565 2.287 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1 1338289400 WWMYABYTDMGTSN-OALUTQOASA-N 440.496 2.383 10 20 IECD Cc1cc[nH]c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1785668020 FOLVIAPNANLZOQ-JDFRZJQESA-N 433.892 2.295 10 20 IECD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)C1 1793093247 AGDPKXOJLHOQTM-CENPHQPOSA-N 445.516 2.114 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)C1 1810554704 WJHBFRUMRSHDBN-IBGZPJMESA-N 436.512 2.374 10 20 IECD C[C@H](Nc1cccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842925733 YGDKWAYSBHZXHO-ZDUSSCGKSA-N 430.892 2.464 10 20 IECD C/C(=C\c1cccs1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847244671 JSGRKSOFLMAFTA-IKYJFFNYSA-N 435.596 2.214 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3ccccc3NS(C)(=O)=O)C=C2)cc1 467303455 ZKVIKLDQQPLOMW-UHFFFAOYSA-N 445.522 2.041 10 20 IECD Cc1c(CNC(=O)N2C[C@@H](C(F)(F)F)[C@H](S(=O)(=O)N(C)C)C2)n(C)c2ccccc12 514419747 RSIVUOQVEJOQOE-RHSMWYFYSA-N 446.495 2.450 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(OCC(N)=O)c(OC)c3)CC2)cc1 726706844 UFJSHBVKWLLYRP-UHFFFAOYSA-N 442.516 2.036 10 20 IECD CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 730286681 UUBJSEBNFXXMCM-UHFFFAOYSA-N 442.535 2.413 10 20 IECD CC1CCN(c2ccc(CNC(=O)CN3C(=O)c4ccccc4S3(=O)=O)cc2)CC1 731017139 XYTIXUHSLBTLJM-UHFFFAOYSA-N 427.526 2.384 10 20 IECD O=C(NCCNC(=O)c1c(F)cccc1F)NCc1ccc(N2CCOCC2)c(F)c1 732993661 OLWXNRPADLMBIG-UHFFFAOYSA-N 436.434 2.170 10 20 IECD CCOc1cc(/C=C2\SC(N3CCOCC3)=NC2=O)ccc1O[C@H](C)C(=O)N(C)C 747147951 JKAPPZLKUCSUMR-VVTMIQRTSA-N 433.530 2.243 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3[C@H](O)C(F)(F)F)CC2)cc1 750634422 KDDYZBVVVAOTBT-OALUTQOASA-N 444.498 2.305 10 20 IECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 751317963 JBZHCZGCIIBZEM-CQSZACIVSA-N 443.543 2.254 10 20 IECD CCc1ccccc1NC(=O)CNC(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 753856506 BQCGYSQQYJDIML-UHFFFAOYSA-N 428.508 2.274 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(Br)cn(C)c1=O 754921535 MJECZZLYACOMPV-UHFFFAOYSA-N 435.322 2.201 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCN(c2ncccc2F)C1 755306457 CVCAHPPSFNOFSQ-MRXNPFEDSA-N 431.487 2.399 10 20 IECD C[C@@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccc(Br)cc1O 756738649 KHZJUXIAORRJEC-GFCCVEGCSA-N 443.367 2.392 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccs4)CC3)cc2)C1 757640579 ZYQOZLZHAASTAI-GOSISDBHSA-N 427.574 2.482 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)NCc1cccc(Br)c1O 766199764 HVINJFRGFZVFAH-UHFFFAOYSA-N 435.683 2.468 10 20 IECD O=C(Cn1nnc(-c2ccccc2)n1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912577 OUZDFMUNPCAWQO-SFHVURJKSA-N 426.908 2.480 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(C(=O)OCC)cc1 769292772 QZJRUWRCIXYBIP-UHFFFAOYSA-N 434.514 2.286 10 20 IECD Cc1cc(C(=O)CN2CCO[C@@H](COC(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 770707546 UPNONNUQLQAGMY-LJQANCHMSA-N 449.573 2.050 10 20 IECD CS(=O)(=O)NCc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771060662 XRWHNCOHHYZVKQ-HNNXBMFYSA-N 441.937 2.082 10 20 IECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(Cc2ccccn2)nn1 771062505 ACWUZDOJQRKCNQ-GOSISDBHSA-N 426.908 2.475 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1)c1ccc(N2CCOCC2)cc1 774163911 IVFQAGJQPMLVRO-KJEZJMDVSA-N 433.505 2.216 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-n4ccnc4)nc3)CC2)cc1 778238799 ULLCBZGUORGJIZ-HJWRWDBZSA-N 432.484 2.119 10 20 IECD Cc1nc([C@H]2COCCN2C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 780822036 WLIQMHOMXYDDPK-BIENJYKASA-N 433.484 2.414 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 781444300 XJHIIIBKIHPUMU-HNNXBMFYSA-N 430.432 2.464 10 20 IECD O=C(CN1CCOC[C@H]1[C@H]1CCCC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 784355744 HTWZOBGNZGITGK-XLIONFOSSA-N 432.476 2.471 10 20 IECD O=C(OCCn1cc([N+](=O)[O-])cn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407150 DUPOXKZHZZAXKN-UHFFFAOYSA-N 438.443 2.216 10 20 IECD C[C@](O)(C1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1)C(F)(F)F 788929043 FYZCCFUUZKBYKG-FQEVSTJZSA-N 427.467 2.455 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccc(NC(C)=O)nc3)CC2)cc(OC)c1OC 789298715 GRXSLMJABJMOJU-UHFFFAOYSA-N 443.504 2.098 10 20 IECD C[C@@H](O)COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1O 792202514 JVLZWFSEBQZDKP-SECBINFHSA-N 430.822 2.292 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(Cl)n3)CC2)cc(OC)c1OC 793021033 ORMSLRGWWODQKH-UHFFFAOYSA-N 434.880 2.048 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2ccccc2F)C1)c1ccc(N2CCOCC2)cc1 803304661 GODXDKLDZMEIQJ-VGOFRKELSA-N 441.503 2.440 10 20 IECD CCN(CC)[C@@H]1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803448287 NQEQGXPTBAXHGZ-GOSISDBHSA-N 438.519 2.316 10 20 IECD C[C@H]1C[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCN1C 803451187 GCPLZKSHJGBOGF-MAUKXSAKSA-N 438.519 2.314 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)cc1F 803662452 WPCXIRMPJNWXHF-UHFFFAOYSA-N 440.519 2.271 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1F 803664343 LCLVZYPEDFOYIR-MRXNPFEDSA-N 436.528 2.414 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804034591 WHOKIMUIMZJXMZ-SFHVURJKSA-N 427.501 2.237 10 20 IECD O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NCCCSc2nccs2)N1 806929231 HXVYSTYHIBEAMW-UHFFFAOYSA-N 426.907 2.365 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 807098699 XYKDAFXJJGPXGZ-FGZHOGPDSA-N 425.529 2.028 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCc2ccc(O)cc2C1 808854242 URBJHHVDVVJBLB-UHFFFAOYSA-N 448.567 2.125 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(CC(N)=O)cc3)cc2F)C[C@@H](C)O1 811864295 VELCHNXVLVMXNS-IYBDPMFKSA-N 428.508 2.467 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3COc4ccccc4[C@@H]3O)CC2)cc1 811995764 WUQGSMQSQAJARV-GMAHTHKFSA-N 440.544 2.001 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](O)CC1 819324513 PKANHUYMYMDOET-HNNXBMFYSA-N 435.458 2.088 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CS(=O)(=O)N(CC)CC 819519677 ZWDQFJBUHZXKMX-UHFFFAOYSA-N 427.567 2.047 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(C(=O)NCC(C)C)CC2)c1 887560193 DBXGBJPZPYCCHQ-UHFFFAOYSA-N 431.577 2.411 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](c3ccco3)N(C)C)CC2)cc1 915896809 LNEMKPYLCWAVAI-NRFANRHFSA-N 429.565 2.402 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCCS(=O)(=O)N3CCCC3)cc2F)C[C@@H](C)O1 917710416 VANYKWYDFSTEED-CALCHBBNSA-N 441.569 2.261 10 20 IECD CC(=O)N[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 917954751 UGYXFUSOHHWKBG-RBZFPXEDSA-N 436.464 2.493 10 20 IECD O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968340 FHMDZOAIVMGEMF-NHCUHLMSSA-N 427.545 2.077 10 20 IECD CCC1(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CCC1 1778334493 KGVIKGFYOOSBLA-BVBLWJPBSA-N 430.501 2.227 10 20 IECD CC(C)=CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1781120835 MRCNWCLIOOORMY-XMMPIXPASA-N 438.528 2.356 10 20 IECD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)c1ccccn1 1784657558 RXQAJZHMQKHJCY-RCDICMHDSA-N 445.903 2.393 10 20 IECD COCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C[C@@H]21 1786495796 LDOHSRMPQBFVSU-BVSLBCMMSA-N 425.529 2.334 10 20 IECD N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccn1 1796062373 SNMWVNYTUDOXFW-KYZVSKTDSA-N 430.892 2.098 10 20 IECD COc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796934514 MMRFLYSAORJYNR-VBUUOAMHSA-N 447.495 2.135 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804288701 BBHRVUPTYCDXJV-BJKLQHCMSA-N 440.500 2.037 10 20 IECD COc1ccc(Cl)cc1CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845920870 QLGZCCLUOIDLFC-UHFFFAOYSA-N 431.876 2.215 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(S(=O)(=O)N(C)OC)cc3)CC2)cc1 110356716 UAIRARGJZZATTO-UHFFFAOYSA-N 433.530 2.276 10 20 IECD O=C(COC(=O)C1(C(=O)NC2CC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 729717039 YFUYQWXAMIXESQ-UHFFFAOYSA-N 432.432 2.003 10 20 IECD Cc1cc(C(=O)CN(CCCO)CC(F)(F)F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 731214007 NOAZWYDPEAUHFA-UHFFFAOYSA-N 447.479 2.171 10 20 IECD CCN(CC)c1ccc(CNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)cc1F 731447388 MSJRJTNILRREEO-UHFFFAOYSA-N 429.539 2.335 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1S(N)(=O)=O 737117995 OQLAELHREQBMOT-UHFFFAOYSA-N 444.557 2.230 10 20 IECD CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)N(C)Cc1ccccc1O 743892476 FPWMKMJGJPWUHZ-UHFFFAOYSA-N 426.517 2.140 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN(CC)S(C)(=O)=O 745698193 UBFKVDABJKFKHS-UHFFFAOYSA-N 436.372 2.358 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 753635698 HROWTICRNQQCNE-BZUAXINKSA-N 448.541 2.257 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3cccc(C(=O)NC4CC4)c3)CC2)cc1F 753861511 RDJKRBXMLPYZAC-UHFFFAOYSA-N 426.492 2.487 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C)c(S(C)(=O)=O)c3)CC2)cc1 758979968 NOELBDJMNAQLAA-UHFFFAOYSA-N 445.541 2.085 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CSc1nc2cc(F)c(F)cc2[nH]1 759699807 ZTYUMFJTYPPINU-UHFFFAOYSA-N 428.442 2.228 10 20 IECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1F 765927427 RMGDFTCPTPSBQP-RUZDIDTESA-N 429.267 2.286 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)n(-c2ncccn2)n1 768146065 HJHWJEGZUQQPPU-UHFFFAOYSA-N 433.516 2.462 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1 768160391 LMYGTEVEQPSNHT-UHFFFAOYSA-N 431.558 2.436 10 20 IECD NS(=O)(=O)Cc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 771066186 PFPYVKFUZORZFG-SFHVURJKSA-N 437.949 2.229 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H](c3ccco3)N(C)C)cc2F)C[C@@H](C)O1 774840953 GWFCZGBCKQSRCU-QINHECLXSA-N 446.523 2.068 10 20 IECD COc1ccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)CC2)cc1 776292596 QDZVHYYRRFKTGA-UHFFFAOYSA-N 426.473 2.402 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 781442426 FUNYPBKYIMJPNT-MRXNPFEDSA-N 430.432 2.464 10 20 IECD O=C(NCCCn1cnc2ccccc21)C(=O)NCc1ccc(N2CCSCC2)cc1 785410462 DVKODRCUEVHRNU-UHFFFAOYSA-N 437.569 2.412 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc(S(=O)(=O)N4CCCC4)cn3)cc2)CC1 786072075 GHSOQVICMRDGCG-UHFFFAOYSA-N 443.573 2.147 10 20 IECD CSc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789801864 WYTTUPJMCVAUFK-UHFFFAOYSA-N 431.533 2.359 10 20 IECD CCC(CC)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789801872 VFKYWQCXSUITRO-NQIIRXRSSA-N 435.540 2.379 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2c1=O 792959879 SHYWITYYAQZOGJ-IBGZPJMESA-N 435.480 2.390 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(C)c(C(=O)OC)c2)cc1C 793367174 HQMCGHRSIUIUMC-UHFFFAOYSA-N 427.504 2.047 10 20 IECD COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 797612042 MIOBOBVKFRCBDK-LBPRGKRZSA-N 435.502 2.300 10 20 IECD COCCN(C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 803299603 MCASJGNOAICLFQ-RJOZEALSSA-N 429.561 2.364 10 20 IECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)O2 803301891 BJTTWMBDAIGRNL-JVHAZSNWSA-N 445.560 2.138 10 20 IECD CCn1cc(CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 803451134 ZCYQLELSKCPOGO-UHFFFAOYSA-N 435.475 2.248 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCC1(N2CCCC2)CCOCC1 804740455 HNWLELJLRTXFSC-UHFFFAOYSA-N 442.604 2.397 10 20 IECD CC[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)S1(=O)=O 805773382 QLRXGSWRCKDIFR-GJZGRUSLSA-N 440.521 2.298 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 807290824 AQOQHWPLFLWMTA-XMMPIXPASA-N 448.567 2.086 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(OC(F)F)cn3)CC2)cc1 807528443 LIKPXSATOWOLCT-UHFFFAOYSA-N 434.443 2.047 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CCOCC(F)(F)F)cc2F)C[C@H](C)O1 809808935 BNIGGAWRKXBTJR-STQMWFEESA-N 428.448 2.438 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(CN2C(=O)CNC2=O)c1 916687734 FXJNPCAZGTYZDR-UHFFFAOYSA-N 441.463 2.036 10 20 IECD O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1 917127265 AUODMULZJKGCAM-UHFFFAOYSA-N 431.543 2.247 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 918438461 QASHSACUCMCJQQ-UHFFFAOYSA-N 442.541 2.462 10 20 IECD CC(C)OC(=O)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919784367 PWJANLZCGUBQGP-UHFFFAOYSA-N 444.511 2.083 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1nc2ncc(Br)cn2n1 919970210 UCVKRWBPFFUNBG-UHFFFAOYSA-N 445.321 2.026 10 20 IECD CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 920311259 UXOMNJVGLCGCFF-UHFFFAOYSA-N 425.532 2.341 10 20 IECD O=S1(=O)CCN(c2ccc(CNC(=S)Nc3ccc4c(c3)OCCO4)cc2)CC1 920994802 HUVIBESHFUGKFP-UHFFFAOYSA-N 433.555 2.179 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2ccnc2S)cc1 1320519646 IRDQAECLRBTIMO-INIZCTEOSA-N 427.482 2.476 10 20 IECD Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C(F)(F)F)c1 1796601231 ICUDGLKMBDHSMZ-CLLJXQQHSA-N 438.406 2.416 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812477968 WDRMEAPCMZKYDH-JLEJFLCFSA-N 449.486 2.238 10 20 IECD COc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844295 WURCBIHAQLNCLY-HNNXBMFYSA-N 438.444 2.239 10 20 IECD COc1cc(CNCc2cc(Br)cc(OC)c2O)ccc1OCC(N)=O 725848700 DFVUMNAVBXUVID-UHFFFAOYSA-N 425.279 2.326 10 20 IECD Cn1c(=O)nc(O)c2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cnc21 726566567 UKNSDFZJFRSGFU-UHFFFAOYSA-N 445.426 2.034 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(F)(F)Oc3ccc(C=O)cc3)cc2)C1 731612282 ITMMIICKOGPCEZ-QGZVFWFLSA-N 431.439 2.489 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(n4cc(Br)cn4)CC3)nc12 731668991 MERMNXJCAYMENM-UHFFFAOYSA-N 449.309 2.408 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)c2)CC1 740610006 QVAKPACDUNBCRM-UHFFFAOYSA-N 431.514 2.350 10 20 IECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)N1c1ccccc1 745690496 CEAVXSAYBDSBPL-SFGWALBWSA-N 449.555 2.382 10 20 IECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)cc21 746038852 KHYCNSDECFAOCC-CYBMUJFWSA-N 426.473 2.309 10 20 IECD Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 748647179 MKMVGCUPHJBOGE-QGZVFWFLSA-N 446.529 2.392 10 20 IECD C[S@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 752877479 CVADBJZOQIQCKL-JJCDCTGGSA-N 428.558 2.125 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCCN(Cc4ccccn4)C3=O)CC2)cc1F 753290120 NFPNXSCYLFOSGG-HXUWFJFHSA-N 441.507 2.252 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C4CCN(C)CC4)C3)CC2)cc1 756055623 WYEXNHBNWMPZQN-NRFANRHFSA-N 429.609 2.191 10 20 IECD COc1ccc(N(CC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)C(C)C)cc1F 759700347 QKSRTVWSNXPYTB-UHFFFAOYSA-N 425.482 2.344 10 20 IECD CCS(=O)(=O)N1CCC(CNC(=O)NCc2cccc(Br)c2O)CC1 765537374 PNODGAMDHDJGEK-UHFFFAOYSA-N 434.356 2.016 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)C1 768213895 VTOSJEVFBXEQJD-WOJBJXKFSA-N 432.584 2.284 10 20 IECD CS(=O)(=O)N1CCCc2cc(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)ccc21 772776888 SONSGZQKJIEUNP-WEVVVXLNSA-N 431.466 2.249 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCS(=O)(=O)c2ccccc2C1 776118713 SNGICPRMZUHSCP-UHFFFAOYSA-N 447.532 2.286 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1 778225387 GAQIQVQZQRRMSQ-HJWRWDBZSA-N 436.468 2.398 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCC(=O)Nc3ccccc3)CC2)cc1 778277170 BFUCUXCYAYWUQQ-QXMHVHEDSA-N 436.512 2.045 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)c2)CC1 780407972 SFNYNIXABJPWII-UHFFFAOYSA-N 442.541 2.386 10 20 IECD CC[C@H]1CCC[C@H](NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785528382 HFHFLTMARXVUNL-PMACEKPBSA-N 430.593 2.409 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(C)c3-n3c(C)ccc3C)cc2)CC1 786657136 SZKUEUSJVJBIKP-UHFFFAOYSA-N 434.544 2.426 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccnc(OCC(F)(F)F)c1 787277651 JFYWOAAPXHEOBX-UHFFFAOYSA-N 434.418 2.332 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H]1Cn1cnc2ccccc21 788321284 UOYBRPLHWPDORJ-NRFANRHFSA-N 447.539 2.180 10 20 IECD COCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C)o1 789811403 GHVZVNOPJYNYQZ-SFHVURJKSA-N 433.480 2.074 10 20 IECD NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(N2CCCC2)cc1 791320561 AWLVYYIRODDVLX-IBGZPJMESA-N 428.920 2.230 10 20 IECD COCCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793800349 FTSXYLQUNSWGPQ-GOSISDBHSA-N 441.528 2.042 10 20 IECD CO[C@@H]1[C@H]2C[C@@H]3CN(CC(=O)NCc4ccc(N5C[C@H](C)O[C@H](C)C5)c(F)c4)[C@H]1[C@H]3C2 796321072 SKZODCBJKXQWKB-VYRVQPAKSA-N 431.552 2.411 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCOc2ccc(F)cc21)c1ccc(N2CCOCC2)cc1 803300248 RICFDCKRTNFSKV-FOIQADDNSA-N 427.476 2.480 10 20 IECD CC(C)(C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCOCC1 805557399 PUALUDYNZZWZMV-UHFFFAOYSA-N 436.464 2.055 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 806934789 JECYRNYQFKEBTG-UHFFFAOYSA-N 435.477 2.278 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386726 GLXVZDWNMPCGLQ-UHFFFAOYSA-N 439.262 2.435 10 20 IECD C[C@H]1COC(C)(C)CN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768510 LIDQNRPDMYTVDD-GJZGRUSLSA-N 425.476 2.399 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F)c1ccc(N(C)C)cc1 810388523 YFFQVJUPWIUKOA-LBPRGKRZSA-N 434.443 2.311 10 20 IECD COc1ccc(N2C[C@H](C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2=O)cc1 913320717 BWFXYHXVXFVCFP-GOSISDBHSA-N 439.512 2.316 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 915521601 NWIFRICSPFYPAV-UHFFFAOYSA-N 425.445 2.212 10 20 IECD CCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 917833002 KAGYGIDFTCBJPK-QGZVFWFLSA-N 426.517 2.440 10 20 IECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 917929322 CWWBASIXDVKFGI-GOSISDBHSA-N 431.558 2.492 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(C(=O)NC)ccc2OC)cc1 918309036 FZMPEOMOUYHRDX-UHFFFAOYSA-N 426.517 2.498 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(Cl)ccc3F)cc2)C1 918463192 IJYNGBTYYLWSDI-AWEZNQCLSA-N 432.883 2.436 10 20 IECD C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918672749 KSMCRRJPNYJSMY-CRAIPNDOSA-N 442.947 2.476 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)OCC(=O)N1CCN(c2cnccn2)CC1 919568987 UXUYZDROVNPAEA-UHFFFAOYSA-N 425.514 2.451 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCN1Cc1ccccc1 919973435 UJVUQQCETMDZKK-JOCHJYFZSA-N 427.570 2.202 10 20 IECD O=C(NC1(c2ccc(NC(=O)c3cnncc3C(=O)O)cc2)CCC1)c1cc(O)nc(O)c1 1789754979 SGOXJQSQDYBOAL-UHFFFAOYSA-N 449.423 2.043 10 20 IECD CN(C)c1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)o1 1800715885 VDGMYAHUMCFPDH-CLLJXQQHSA-N 434.880 2.371 10 20 IECD O=C1CC(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2c2cccnc2)C1 1814087595 AXFFAPSJNJOZHY-YJYMSZOUSA-N 443.887 2.445 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 12069001 AZOYRDCBVNYUNG-UHFFFAOYSA-N 434.518 2.094 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccc(C)c(S(=O)(=O)N(C)C)c3)CC2)cc1 104502655 OLKLUJYJUJTDMK-UHFFFAOYSA-N 446.573 2.015 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc1 726793168 UXFPLHUOJGOBJN-UHFFFAOYSA-N 445.545 2.030 10 20 IECD COc1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(F)F 727177496 KUMNBVVQBMAKAK-DHZHZOJOSA-N 438.499 2.047 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H](C)CS(C)(=O)=O 732993176 CFOPONBGFDIRGB-OAGGEKHMSA-N 429.558 2.404 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(-c4n[nH]c(C)n4)cc3)CC2)cc1 737139857 UHKZDEHZXWVGOO-UHFFFAOYSA-N 434.500 2.466 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cn(Cc4cccs4)nn3)CC2)cc1 742491826 PXRRYXIBHQIUAG-UHFFFAOYSA-N 440.573 2.339 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3c(O)ccc4c3CCCC4)C2=O)cc1 743719166 RMMVLQWCUCJUDH-XMMPIXPASA-N 437.496 2.363 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(CCN(C)C)C[C@@H]3CCCO3)cc2F)CC1 745809087 PREOVBXZOQSEEI-FQEVSTJZSA-N 435.588 2.220 10 20 IECD Cc1nc(C(C)(C)C)nc(O)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 747368010 WMVJYTSBAGGLOH-MRXNPFEDSA-N 425.533 2.420 10 20 IECD COCCOc1cccc(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753857052 IWGQIOBKXQWOPB-UHFFFAOYSA-N 431.508 2.298 10 20 IECD O=C(COC(=O)c1csc([C@@H]2CCCO2)n1)NCc1ccc(N2CCOCC2)c(F)c1 756455447 BYBUVWKVHKJFRR-SFHVURJKSA-N 449.504 2.444 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCO[C@@H]([C@H]3CCCO3)C1)c2[N+](=O)[O-] 757425643 OZCGRJKIQXDFFQ-QZTJIDSGSA-N 436.420 2.390 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc2)C1 763555878 XTIJSUSZJVMFPL-QGZVFWFLSA-N 448.483 2.412 10 20 IECD CCCS(=O)(=O)Nc1cc(NS(=O)(=O)c2cccc3nonc23)c(F)cc1F 765083954 VVSFTTLOXLDUKU-UHFFFAOYSA-N 432.430 2.454 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)COC4)cc2F)CC1 768949850 MROYBVBPTPJHOS-UHFFFAOYSA-N 426.492 2.253 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CN(C)CCO1 769974205 UCWCZAKVQTYDHM-RDTXWAMCSA-N 430.471 2.060 10 20 IECD COC(=O)C[C@@]1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCOC1 770691298 GEWNPULLYUZMJP-DEOSSOPVSA-N 436.464 2.102 10 20 IECD COc1cccc(C(=O)N(C)C)c1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772882347 GWYWNLBPVFJQFU-UHFFFAOYSA-N 445.491 2.068 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773615619 FQYIAUCPOZZDMV-AWEZNQCLSA-N 435.550 2.135 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 776062490 WFNZXACMCHQCLD-UHFFFAOYSA-N 446.529 2.009 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786656124 KRNWEBDMYSRUIM-JPSZFOOASA-N 444.601 2.229 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)nc1)c1ccc(N2CCOCC2)cc1 787180254 JOPKUNGFPOPSPH-SFHVURJKSA-N 437.544 2.012 10 20 IECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1C 788035106 PUVMGJBRTSXRKJ-UHFFFAOYSA-N 442.535 2.230 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@]1(N(C)C)CCSC1 788252464 OZYSDFMORZXBEQ-GOSISDBHSA-N 444.395 2.057 10 20 IECD CC(C)(C)c1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 789381375 CXNMMAMVFUYOEM-OAHLLOKOSA-N 443.573 2.397 10 20 IECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 789823020 XUGFMLJFLXBBCJ-CALCHBBNSA-N 428.508 2.118 10 20 IECD CCCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789839930 CRKPFHGWINNPDA-IBGZPJMESA-N 435.540 2.211 10 20 IECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949141 FWQURVLCIAEPTH-ROUUACIJSA-N 443.466 2.232 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@]4(CCO[C@H]4C)C3)cc2F)CC1 790717820 DLVRVZVHZVIJLK-IUKKYPGJSA-N 434.556 2.446 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)cc1F 792344902 UJJKQCDGWVRLMP-UHFFFAOYSA-N 426.448 2.190 10 20 IECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 799763459 OEYQFLFPXXQFOQ-KRWDZBQOSA-N 445.541 2.044 10 20 IECD COCCn1c(CC2CC2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802545867 SXVHKUAJIKMCKS-UHFFFAOYSA-N 431.537 2.229 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 803450068 CIUABNUDLNGTSC-QRVBRYPASA-N 449.498 2.447 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1 807099597 AIDSYCAWSCPDBJ-RTBURBONSA-N 431.558 2.090 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc1 807101455 LUAPBCRILDJZKB-HXUWFJFHSA-N 430.593 2.108 10 20 IECD CC(=O)Nc1ncc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)s1 808529554 KPXUAPQKERAOBK-UHFFFAOYSA-N 448.515 2.002 10 20 IECD COCCn1c(-c2cccc(S(=O)(=O)N(C)C)c2)nnc1N(C)Cc1ccccc1O 812079317 JOPNHDUWILVAKQ-UHFFFAOYSA-N 445.545 2.184 10 20 IECD C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818999571 LDCBNUDQITXMEU-XCLFUZPHSA-N 449.485 2.382 10 20 IECD COc1cn(-c2ccccc2)nc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676992 YGBZREZCCDWWAA-UHFFFAOYSA-N 440.525 2.046 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccccn4)CC3)cc2F)C[C@@H](C)O1 916981689 LVVUYUKLFRUSEQ-RTBURBONSA-N 441.551 2.273 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc2sccc2c1=O 917177530 SIBWSXMBTFTWGY-UHFFFAOYSA-N 448.545 2.379 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)C[C@@H](C)O1 917710831 XSJIQAABVWYRRU-ZIFCJYIRSA-N 440.519 2.499 10 20 IECD O=C(Nc1cccc(N2CCNC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295987 HMFYZQJKNBFUFH-IBGZPJMESA-N 438.484 2.068 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1 920482672 USBUPVQLXCRHMB-UHFFFAOYSA-N 428.488 2.346 10 20 IECD Cc1cc(N/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)n(-c2ccc([N+](=O)[O-])cc2)n1 920978933 VNILCFCEVDPIFJ-OQLLNIDSSA-N 428.474 2.284 10 20 IECD C[C@@]1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CC1(F)F 1782007081 BAEOHUWDQFGNLP-ROUUACIJSA-N 430.835 2.240 10 20 IECD CC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620473 XMSZKSBVKJWJKY-MXNKGDRCSA-N 425.529 2.068 10 20 IECD CCc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804990307 XMBCLYJCSVMKRP-ZHRRBRCNSA-N 447.495 2.479 10 20 IECD Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1808532503 CKPBSEVNACUQRE-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2ccccn2n1 1818501533 QIGYMRSKYJJJEB-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 303312197 PDQRIKHSQJIVGZ-UHFFFAOYSA-N 442.535 2.413 10 20 IECD CCn1cc(-c2nn(C)cc2C(=O)N2CCCc3ccc(S(=O)(=O)N(C)C)cc32)cn1 488971497 GRFIALPMECNXIY-UHFFFAOYSA-N 442.545 2.147 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)CC2)cs1 728555899 LSLUEZSQYHGPKH-UHFFFAOYSA-N 445.570 2.401 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN([C@@H](C)c4cccc(OC)c4)CC3)nc12 728932837 RHYRBRXLTZSFJI-INIZCTEOSA-N 439.516 2.499 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc4c(c3)C(=O)NC4=O)cc2F)CC1 730110781 SCCBXAHKNQERML-UHFFFAOYSA-N 425.464 2.173 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(N2CCOC2=O)cc1 740890455 VYHPAGBRQGDGHM-UHFFFAOYSA-N 431.514 2.301 10 20 IECD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 749720481 KPUMVZOWRPDSLG-UHFFFAOYSA-N 440.500 2.485 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 751013881 LUXZYPXFDXJFFF-UHFFFAOYSA-N 426.441 2.067 10 20 IECD CC(C)C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1=O 755211843 LPRDJCRXABXMKN-TZIWHRDSSA-N 428.577 2.432 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cc(F)cc(Cl)c3)cc2)CC1 755945422 SBJASCJEHOGESN-UHFFFAOYSA-N 432.926 2.192 10 20 IECD Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3ccc(O)cc3F)c(Br)cc21 758169091 MVVZNDFPFZAKRU-UHFFFAOYSA-N 430.255 2.285 10 20 IECD COc1cc(N2CCN(C(=O)Nc3ccc4c(c3)NC(=O)CO4)CC2)cc(OC)c1OC 759928439 NJPNUDXWCXVZHZ-UHFFFAOYSA-N 442.472 2.397 10 20 IECD CS(=O)(=O)N1CCc2cc(C(=O)NCc3cccc(Br)c3O)ccc21 765769301 LHPGPSZPTGGHEV-UHFFFAOYSA-N 425.304 2.407 10 20 IECD C[C@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc(N2CCOCC2)cc1 775258727 AGBAEUUYGWQKEU-HNNXBMFYSA-N 441.923 2.442 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)c3c(C)noc3C)CC2)cc1 778393107 AHXZUBLSWBZORD-SCOAYWHSSA-N 426.517 2.425 10 20 IECD O=C(c1ccccc1)N1CCC[C@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 779613522 MEHVAJPECCRPHS-QFIPXVFZSA-N 443.569 2.247 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 784025750 KNNFKQCOVGZJHE-UHFFFAOYSA-N 440.500 2.239 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)CC1 787183303 VVZNLACIRMVVOO-UHFFFAOYSA-N 427.524 2.456 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)cc2)CC1 794450444 PKWGRDOPDXTSQS-AERCQKQUSA-N 442.560 2.084 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(Cl)nc3)cc2F)CC1 805006927 KQKPSGFMGJUJEQ-UHFFFAOYSA-N 447.942 2.291 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 806547274 FGVIJFWXWCEDQL-AWEZNQCLSA-N 436.509 2.453 10 20 IECD CSCC[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856137 NYJJWIYUKBMRRB-SFHVURJKSA-N 432.634 2.435 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)C2CC2)cc1 918457418 SEMCIRNOBQFZHM-UHFFFAOYSA-N 444.557 2.133 10 20 IECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)NCc1ccc(N2CCSCC2)cc1 918617003 CEYGTZKFCSJYOQ-AWEZNQCLSA-N 425.601 2.285 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 1346108934 GNHBLJQARJMFMM-XMSQKQJNSA-N 438.572 2.414 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CN)C[C@@H]32)cc1 1790126203 CLNOFMKJEHFXOO-NQCBNZPSSA-N 438.572 2.282 10 20 IECD CC(=O)O[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)C(C)C 1817845922 BYTZNKGEOKNAQD-KXBFYZLASA-N 445.476 2.110 10 20 IECD CCOCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146385 FZRIGVMEGGXEOE-GOSISDBHSA-N 438.488 2.231 10 20 IECD Cc1nc(C)c(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441380 PHQMXLYEPGBWKU-UHFFFAOYSA-N 437.525 2.370 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(c3ccc(F)c(F)c3)CC2)C1 1845016417 VCHIRGGHIQRNGY-UHFFFAOYSA-N 429.423 2.320 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCCN(C(N)=O)C3)c2C)cc1 10598698 NFXAKYZUVPRKAW-KRWDZBQOSA-N 441.484 2.397 10 20 IECD COC(=O)c1cc(Br)ccc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 13464129 FSJVZEZGUAEUGK-UHFFFAOYSA-N 430.232 2.440 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 726726728 VSHGKDHPVDBLFC-UHFFFAOYSA-N 428.445 2.336 10 20 IECD CN(CCN1CCCC1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 728610131 AGRGJPZDXFTOIZ-UHFFFAOYSA-N 448.501 2.269 10 20 IECD O=[N+]([O-])c1cc(Cl)cc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 732913738 BGTYXGSUBOPPGQ-INIZCTEOSA-N 448.911 2.339 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3nc(-c4ccoc4)no3)CC2)cc1 740278053 DQFCIXDWTGWQQX-UHFFFAOYSA-N 440.456 2.163 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OC2CCOCC2)cc1 742051011 OIFURGMIVSUILW-UHFFFAOYSA-N 444.553 2.409 10 20 IECD NC(=O)[C@H]1c2ccccc2CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744397810 FETMYHWIZMHACB-HSZRJFAPSA-N 439.471 2.485 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(c4cnn(C)c4)CC3)cc2F)C[C@@H](C)O1 746414569 FPXJFMOWQUPUEV-IAGOWNOFSA-N 430.528 2.205 10 20 IECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 751227101 DUGXKOCYLNTLGJ-UHFFFAOYSA-N 442.484 2.422 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1 751415782 WZZZYCNIVQXVGK-UHFFFAOYSA-N 440.543 2.054 10 20 IECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C[C@H]1C 754504746 AEXLZBVNOVXPIE-CQSZACIVSA-N 448.501 2.267 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCCCSc3nccs3)cn2)C[C@H](C)O1 758618038 JENDUHKQEFGQHT-KBPBESRZSA-N 438.579 2.279 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccnn3-c3nc(C)cc(C)n3)CC2)cc1 760215091 FYTMBAWPULJLIT-UHFFFAOYSA-N 449.515 2.011 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(F)c(C(=O)O)c2)cc1OC 763279886 IWHJFISLYXFMBM-UHFFFAOYSA-N 446.478 2.403 10 20 IECD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 773740396 LUHMTRWMHUEHRI-LBPRGKRZSA-N 442.921 2.037 10 20 IECD COc1ccc(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)N(C)C 775836369 MQCLSPDGMUUXAW-OAHLLOKOSA-N 434.562 2.301 10 20 IECD O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1 778924362 UNOLPLWDYLRDRR-CQSZACIVSA-N 440.905 2.139 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)[C@H]3CCN(Cc4ccccc4)C3=O)CC2)cc1 789523416 ZATIOKOWRFBTNX-QHCPKHFHSA-N 436.556 2.077 10 20 IECD CCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(=O)N1CCCCCC1 796601754 OKDWMSKGNZVAMR-UHFFFAOYSA-N 434.556 2.003 10 20 IECD C[C@@H](CN1CCCC1=O)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 803122250 PEWVUUUEGINVHT-CVEARBPZSA-N 434.968 2.320 10 20 IECD C[C@@H](NC(=O)C(=O)NCCN1c2ccccc2C[C@H]1C)c1ccc(N2CCOCC2)cc1 803312284 WPYHXQBCVMQXRN-RTBURBONSA-N 436.556 2.268 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)nc1 803688559 UHEHURAUBOJEIO-HXUWFJFHSA-N 449.555 2.266 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1nccn1C(F)F 803801983 OBHFPEHLVUQGFE-UHFFFAOYSA-N 431.237 2.411 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(F)(F)F)[C@@H](CO)C3)cc2)C1 806494456 QMVVUGTWSWRAGF-JFIYKMOQSA-N 442.482 2.091 10 20 IECD COCCN(CCOC)C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 806683360 HAVBBEAJNPVQHY-UHFFFAOYSA-N 448.608 2.433 10 20 IECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 806736768 OSOATCLZVJSIQD-ZDUSSCGKSA-N 438.502 2.279 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(F)c1 807385977 YLUJUPJLSRZLMA-UHFFFAOYSA-N 425.210 2.335 10 20 IECD C[C@H]1COC(C)(C)CN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768511 LIDQNRPDMYTVDD-LSDHHAIUSA-N 425.476 2.399 10 20 IECD Cc1nccc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 918360913 QNSYLVRQPOMTEX-UHFFFAOYSA-N 443.441 2.130 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(CO)cc3)cc2F)C[C@@H](C)O1 918878640 YAKMIOPNLFVGKW-IYBDPMFKSA-N 430.476 2.405 10 20 IECD O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1320543349 JGOSCYDLPZXEQP-IRXDYDNUSA-N 434.518 2.161 10 20 IECD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1 1790932811 OGSBOADMQBRPJW-IHPCNDPISA-N 439.512 2.027 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@H]1C[C@]1(F)Cl 1791372602 BJTWNWXCTJNGQS-XDUGFGTRSA-N 447.290 2.269 10 20 IECD Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604836 QQQYRZSSFKAFOO-BJWYYQGGSA-N 438.484 2.000 10 20 IECD O=C(Cc1ccccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931664 APFNFUOIGRLUNZ-FNLKRUPLSA-N 431.496 2.055 10 20 IECD Cc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1803268277 XEOICTONTMIOLC-GAJHUEQPSA-N 447.495 2.154 10 20 IECD CN1CC(C(=O)N2CC[C@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1811809156 HJFOMZBXPCDOTF-KUHUBIRLSA-N 444.919 2.027 10 20 IECD C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189280 DFYSPTDMTZDYDR-UGAVNNIXSA-N 444.582 2.080 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1CCSCC1 1814235510 NWEGFFVKFVZMHV-OXJNMPFZSA-N 442.541 2.351 10 20 IECD Cc1noc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816401984 NSOHKERSTOHAAC-CQSZACIVSA-N 426.433 2.440 10 20 IECD Cc1cnn([C@@H](C)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1822744555 PIYSZRDTLDOTMP-BBRMVZONSA-N 439.476 2.288 10 20 IECD O=C1CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1830737938 ZLYADTOZIURBBH-DLBZAZTESA-N 449.935 2.263 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1 1832300293 RKOPEESTHYWCCN-PXPVJAHISA-N 437.500 2.230 10 20 IECD Cc1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031541 NAQVZILRMGFFJP-UHFFFAOYSA-N 440.500 2.122 10 20 IECD Cc1ccc(C(=O)C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1846287415 OARQQJNVTLISSV-CSKARUKUSA-N 436.464 2.211 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NCc2c(C)c3ccccc3n2C)CC1 472224597 OYILMTIRYRGIOX-UHFFFAOYSA-N 445.545 2.308 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C4OCCO4)CC3)cc2F)C[C@@H](C)O1 726789591 OOHJPHXFTCOGRT-CALCHBBNSA-N 435.540 2.140 10 20 IECD COc1ccc(O)c(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(C(C)=O)cc2)c1 734016689 YVFNZOWSKNOQRC-UHFFFAOYSA-N 434.514 2.321 10 20 IECD CNC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 740920575 QGYLYJSWTMCTID-UHFFFAOYSA-N 428.508 2.188 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(C(=O)N(C)C(C)C)CC3)CC2)cc1 743362951 MKDNCURETDQUGB-UHFFFAOYSA-N 445.608 2.106 10 20 IECD CN(C)C1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)Cc2ccccc2C1 743634599 WGKLSMAZKGUBJS-QFIPXVFZSA-N 449.599 2.287 10 20 IECD Cn1c(=O)n(C)c2cc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)ccc21 747548973 CXLSGNZMCKFXOG-UHFFFAOYSA-N 434.452 2.343 10 20 IECD COC1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCOCC1 747617594 RQSQFAXXXZEDOO-UHFFFAOYSA-N 426.516 2.180 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CS(N)(=O)=O)cc3)cc2F)C[C@H](C)O1 748841840 YHBOMEZHDFSINI-GJZGRUSLSA-N 435.521 2.158 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCC(=O)c3cccc(N)c3)CC2)cc1 753470553 DOIWRHRMPKEROS-UHFFFAOYSA-N 425.485 2.132 10 20 IECD COc1ccc(N2CCN(C(=O)CCc3c(C)c4c(C)nn(C)c4[nH]c3=O)CC2)cc1F 753739863 ZKGOABFHVMSMKS-UHFFFAOYSA-N 441.507 2.308 10 20 IECD C[C@@H]1OCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@H]1C 765690192 ODLHIMYLJJVBQK-IRXDYDNUSA-N 428.512 2.261 10 20 IECD COc1cc(CN2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c(O)cc1C 768437969 LYSGFWRVZAHOTR-UHFFFAOYSA-N 435.502 2.432 10 20 IECD COc1c([N+](=O)[O-])ccc(CNc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)c1O 774937680 QITFOHSVTWPSKW-UHFFFAOYSA-N 443.504 2.131 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1cnc2ccccc2c1=O 777828956 QOIVVNLFFYJWBW-UHFFFAOYSA-N 429.860 2.347 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407186 HZXNTDIRMIJTFG-UHFFFAOYSA-N 446.529 2.123 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1 783317532 WEBSLJXOOCNANU-UHFFFAOYSA-N 446.573 2.178 10 20 IECD O=C(OCCCN1CCOC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785412715 LNPWWZPPKMOQPL-UHFFFAOYSA-N 426.472 2.254 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 786708645 BTXHGAUXHQGZMF-UHFFFAOYSA-N 427.523 2.127 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 789827123 RKFNWJMMFUJASY-HOTGVXAUSA-N 431.512 2.149 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 789848071 YJKMLVVWIYQHIM-ONTIZHBOSA-N 442.629 2.189 10 20 IECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(O)cc2SC)s1 792701876 FSMFATSFSLLLFL-UHFFFAOYSA-N 436.602 2.458 10 20 IECD Cc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 793717355 FTUFBJLEFJLTGL-RDJZCZTQSA-N 428.558 2.252 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3N(C(=O)OC(C)(C)C)CC3(C)C)nc12 796220632 HHAIUNZYBXLFGA-HNNXBMFYSA-N 448.476 2.300 10 20 IECD COc1ccc(CNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c(O)c1 797390684 NAQSSAUOUHQMAC-AWEZNQCLSA-N 445.903 2.279 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2cccc3nsnc23)cc1)C1=S=CC=C1 797972997 JVRZLAPVESIHHN-UHFFFAOYSA-N 444.519 2.026 10 20 IECD CO[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771791 PKDLLJBICYBMQC-XMHCIUCPSA-N 447.447 2.453 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCN(C4CC4)CC3)cc2F)C[C@H](C)O1 801874558 GJTVHZAHPTYCTC-IRXDYDNUSA-N 447.551 2.473 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 803134573 KXNMBTAHUDXSNA-JOCHJYFZSA-N 448.523 2.113 10 20 IECD CCN1CCN(c2ccc(CNc3ccc(C(C)=O)cc3S(N)(=O)=O)cc2F)CC1 804441057 ZOEFMOPCCBLFRS-UHFFFAOYSA-N 434.537 2.430 10 20 IECD CCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805006747 DEHWLHJBAAMAKC-UHFFFAOYSA-N 426.536 2.463 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Oc4ccncc4C)CC3)CC2)cc1 809995776 WJEQTNPSVKVLED-QFIPXVFZSA-N 440.588 2.425 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3COc4ccccc4[C@H]3O)CC2)cc1 811995762 WUQGSMQSQAJARV-FYYLOGMGSA-N 440.544 2.001 10 20 IECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C[C@H](C)S1(=O)=O 813062905 KEMFYEKSQOAPCO-FUHWJXTLSA-N 440.585 2.075 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(N(C)C)c3)cc2F)C[C@H](C)O1 919154007 UONCMDHAANOGKG-HOTGVXAUSA-N 444.507 2.374 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(Cc2cn3ccccc3n2)CC1 919790892 RTBFSWQELDUCGA-UHFFFAOYSA-N 434.544 2.198 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)c1 919819766 SYOKIDLEOGKUNH-UHFFFAOYSA-N 440.481 2.341 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc(N(C)C)cc3)CC2)cc1 1116502896 GZHVHOQYYMFTNG-OUKQBFOZSA-N 436.556 2.325 10 20 IECD COC(=O)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccn1 1334405888 TZOIBOLAQBPUNJ-QGZVFWFLSA-N 447.494 2.294 10 20 IECD CC(=O)NC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425165 DZOHLHGIXPOAEE-UHFFFAOYSA-N 426.473 2.155 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547295 JWFCNSTVLIODNZ-UHFFFAOYSA-N 433.505 2.069 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)[nH]n1)c1cc(O)nc(O)c1 1817848382 GWOVWVWYNRWNGD-DWTRPJMMSA-N 435.444 2.025 10 20 IECD NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1821954094 SGUJKYVKCARDLC-ZDUSSCGKSA-N 435.868 2.046 10 20 IECD CNC(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736451 CNOCFIVOUHTAAM-MRXNPFEDSA-N 437.924 2.121 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc3cnccc3n2)C1 1843682246 CWIASXNVFVTGSA-QPJJXVBHSA-N 446.463 2.277 10 20 IECD O=C(c1ccc(C2CC2)cc1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054266 CDGNEPUCDIJHEC-UHFFFAOYSA-N 429.567 2.241 10 20 IECD NS(=O)(=O)c1ccc(CNC(=S)NCc2ccc(N3CCSCC3)cc2)cc1 726467622 FURBAAOWAHBQGE-UHFFFAOYSA-N 436.628 2.052 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(C(F)(F)F)cc3)cc2)CC1 726976059 IEBAUTKJQNSENM-UHFFFAOYSA-N 448.488 2.419 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)Cc3c[nH]c4ccccc34)cc2)C1 729598615 HNOKTFMISZWXTD-QUCCMNQESA-N 449.555 2.272 10 20 IECD COc1ccc(O)c(CNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)c1 734014853 GLYGZESTKJOWQI-UHFFFAOYSA-N 431.493 2.494 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C[C@H]4CCCO4)CC3)cc2F)CC1 734276141 VZYIYANGOMIYDD-OAQYLSRUSA-N 447.599 2.410 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCCNC(=O)NC3CCCCC3)CC2)cc1 742921184 PCIKYELLEKOUKF-UHFFFAOYSA-N 445.608 2.346 10 20 IECD O=C1C[C@@H](Cc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)C(=O)N1 743313991 LFAOYKUOIOMUSM-OAQYLSRUSA-N 435.524 2.031 10 20 IECD Cc1nsc(N2CCCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)n1 745648580 RVOYWXGXDGKZKB-UHFFFAOYSA-N 448.568 2.369 10 20 IECD CC(=O)N1CC[C@@](C)(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 747091351 LMDABZZRHMACPS-XMMPIXPASA-N 434.448 2.202 10 20 IECD CS(=O)(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749555004 MRLPTHATWWGTKM-UHFFFAOYSA-N 449.548 2.331 10 20 IECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 756890670 ZYWBQQHNOPUXAJ-QZTJIDSGSA-N 442.560 2.228 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc(OC)c1OC 760117449 JGJQXXXMLUYWGP-IAGOWNOFSA-N 448.564 2.191 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 773922841 OGPBOIBAPFZMQA-QHCPKHFHSA-N 435.540 2.190 10 20 IECD C[C@H](NC(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1)c1ccc(N(C)C)cc1 775656162 YAFOXANXHBUOPO-ZACQAIPSSA-N 428.537 2.468 10 20 IECD O=C1NC(=O)C2(CCC(NCc3ccc(N4CCOCC4)cc3C(F)(F)F)CC2)N1 776020910 BWSWUROXKAXQDW-UHFFFAOYSA-N 426.439 2.152 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 781440809 VYWQABJKLSXTIM-UHFFFAOYSA-N 441.484 2.346 10 20 IECD C[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCN(c2ccccc2)CC1 788015158 MNHUSASLEDHRDO-KRWDZBQOSA-N 447.630 2.068 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCNc3ccccn3)cc2F)C[C@H](C)O1 788640574 BAXOCCQNYNFEIW-IRXDYDNUSA-N 443.523 2.069 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@H]21 788922799 YHCGIIONYKTMGX-MWCGGFADSA-N 429.536 2.344 10 20 IECD CC1CCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789823713 FETVFGBIIXYUJZ-QRVBRYPASA-N 448.583 2.292 10 20 IECD CCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccn1 789842675 FUFOGMWMLVUDOX-HXUWFJFHSA-N 428.508 2.456 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N(CCO)[C@H]1CCc2ccccc21 789855895 ZROHAPOPAKETIV-QFIPXVFZSA-N 439.581 2.364 10 20 IECD CC[C@@]1(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOC1 790243917 WFTMKHPXSQVZPT-JOCHJYFZSA-N 428.512 2.311 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@H](O)CN3CCOCC3)cc2Cl)C1 800720382 SEBHESOSYBOLMU-MJGOQNOKSA-N 439.000 2.411 10 20 IECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N2CCOCC2)cc1 801746144 IWACMGFPSUBYTJ-SFHVURJKSA-N 446.573 2.080 10 20 IECD C[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)(C)CN(C)C 803449425 ALRWBBYJCSKNEW-HNNXBMFYSA-N 440.535 2.466 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c(C)c1 807513348 LTUUQZCZMITDQG-UHFFFAOYSA-N 440.283 2.387 10 20 IECD C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CN1C1CC1 807770560 MOQGTUYYTHWHQB-OWCLPIDISA-N 436.503 2.114 10 20 IECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 808357398 GDYNVOAOVDNMJX-MDNUFGMLSA-N 428.577 2.342 10 20 IECD O=C1CC(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)(c2cccc(Cl)c2)C1 810172768 PBDZGAVPCQAUCO-UHFFFAOYSA-N 446.956 2.492 10 20 IECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 810208395 VBEAJMLMAYFUMJ-UTKZUKDTSA-N 427.549 2.197 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3nnc4n3CCCCC4)CC2)cc1 915915958 ZSSMRLCYYDSZGQ-UHFFFAOYSA-N 441.580 2.025 10 20 IECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H](C)O1 918117709 HXAVQUJUTCYYSY-NSHGMRRFSA-N 445.608 2.075 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(-n2cccn2)c1 918440916 UOKMNLMAGUIIKW-UHFFFAOYSA-N 437.475 2.227 10 20 IECD Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918466073 YIEFZKNIGPCUNB-SFHVURJKSA-N 437.544 2.018 10 20 IECD COc1ccc(OC)c(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918897613 CZGRUROEZZEIKK-UHFFFAOYSA-N 446.475 2.082 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1sccc1F)CCO2 1785504056 VXLAAWHTOXYSDW-XAFBZQIESA-N 448.472 2.161 10 20 IECD CCOCCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791965578 ZGGJPAPKOZUKLT-UHFFFAOYSA-N 435.571 2.407 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ccnnc3)CCC2)cc1 1792313879 FUYWRYBZSDNCDA-UHFFFAOYSA-N 441.538 2.085 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1[C@H]2C=CS[C@@H]21 1804289822 WBWSPVIKKTYHNK-KAKHCHCBSA-N 428.510 2.330 10 20 IECD Cc1onc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1C 1807994419 WUOCXNPNBHMNHN-MGPUTAFESA-N 437.456 2.126 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997875 GCXYMVHNOJNQGC-HDDHGUNASA-N 434.855 2.132 10 20 IECD O=C(Cn1cccn1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1815719402 NWIGSPLPYKMEKW-LLVKDONJSA-N 447.904 2.330 10 20 IECD CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n[nH]1 1817703017 PLTVIFJXVMEWLG-HNNXBMFYSA-N 425.449 2.121 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1)c1cc(O)nc(O)c1 1817846852 DXMQYNQZQSWPTP-INIZCTEOSA-N 448.443 2.107 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823479289 FWKJVOSYXZGGLB-DERGHVRDSA-N 430.461 2.267 10 20 IECD Nc1ccccc1/C=C/C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842958760 LXEVDCZUGGZPLH-VAWYXSNFSA-N 443.507 2.278 10 20 IECD O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249442 JRVDXQWEZQSWGD-UHFFFAOYSA-N 428.395 2.383 10 20 IECD O=C([C@H]1CCCSC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442894 BOPKHHMWUDUESZ-INIZCTEOSA-N 426.542 2.126 10 20 IECD COc1ccsc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844583841 LTQSXVNOPXIAGX-UHFFFAOYSA-N 438.509 2.367 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(C)c(F)c3)CC2)cc1 12069525 DABGEWZRFADLSG-UHFFFAOYSA-N 428.508 2.410 10 20 IECD O=C(NCc1ccccc1O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1 109678596 YUDAKQBSRHFEQL-UHFFFAOYSA-N 438.465 2.293 10 20 IECD Cc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)N1CCOCC1 437018086 LLNCRDFEAYJMIY-UHFFFAOYSA-N 445.541 2.121 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C 728758371 HHGQGLNVIUARTB-INIZCTEOSA-N 425.485 2.434 10 20 IECD CC1CCN(c2ccc(CNC(=O)Nc3cnc4c(c3)c(=O)n(C)c(=O)n4C)cc2)CC1 731106357 WKMUITOWULGYEQ-UHFFFAOYSA-N 436.516 2.190 10 20 IECD O=C(N[C@@H]1CCN(CCN2CCOCC2)C1)N(Cc1ccco1)Cc1ccccc1O 734685987 JDOJTUFYHYVXBI-HXUWFJFHSA-N 428.533 2.104 10 20 IECD CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NCc3cccc(OC)c3O)ccc21 737278977 SJZFJKOWDTZLEU-UHFFFAOYSA-N 425.441 2.174 10 20 IECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1OC 739955809 WZVZETUQYLYESE-UHFFFAOYSA-N 434.514 2.438 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(N2CCNC2=O)CC1 745905941 SUQYAVVWVFLQJD-OAHLLOKOSA-N 437.491 2.456 10 20 IECD Cc1n[nH]cc1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 747875685 ZJHQLVUIPWUCKU-UHFFFAOYSA-N 431.430 2.063 10 20 IECD CCOC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751937569 QSRKVROEDREDLC-QGZVFWFLSA-N 431.514 2.417 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 755121650 IAHKQJVHMZGLHG-LJQANCHMSA-N 430.455 2.406 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@H](C)O1 761609728 FIGDGZMLFXSDQE-GJZGRUSLSA-N 449.529 2.260 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C[C@H](C)NS(=O)(=O)c2cccnc2Cl)c1 761966891 BCQVOWQVMVHRSB-RYUDHWBXSA-N 427.910 2.384 10 20 IECD C[C@@H]1COCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762704196 LZCFSEWWZBDPDF-SJKOYZFVSA-N 435.458 2.256 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(OC)c(OC)cc3OC)CC2)cc1 766418635 HRKFJZSWZQXRTF-UHFFFAOYSA-N 443.500 2.445 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCC(N)=O)cc1 769280564 IAOOHZIYCBKWQX-QFIPXVFZSA-N 432.524 2.427 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1C(=O)O 775277601 MFLGMGKJZKXJRV-UHFFFAOYSA-N 427.485 2.167 10 20 IECD CCCN1CCC(N(C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778244391 KVNCCWPFWNOWCV-MDZDMXLPSA-N 428.577 2.233 10 20 IECD COC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)OC 778501035 FJZUCGYZLQPOLV-VWLVURMCSA-N 428.557 2.034 10 20 IECD Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 782105640 BYEGUQMMVKYBSZ-GOSISDBHSA-N 433.512 2.433 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc2c(=O)n3ccccc3nc21 784424100 YJJGZZZTZDQNMS-UHFFFAOYSA-N 449.486 2.216 10 20 IECD CC[C@@]1(C)CCCN(C(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 785530023 ZKCLFPCJAQPFLT-DEOSSOPVSA-N 430.593 2.362 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)o1 785644350 CGZOLZPHWXGTKX-PXNSSMCTSA-N 428.533 2.021 10 20 IECD CC1CCN(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 787665283 ZNRJCJIXDXLMDB-QGZVFWFLSA-N 438.519 2.221 10 20 IECD CCN(CCCN1CCCC1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 788552061 WFFJWSSXYIWDLF-VAWYXSNFSA-N 428.577 2.234 10 20 IECD COC(=O)c1cncc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 788637506 XUOWCABCDVOCQV-AWEZNQCLSA-N 441.456 2.417 10 20 IECD CC(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 789383330 WTYPVLJUZMYZPA-OAHLLOKOSA-N 443.573 2.397 10 20 IECD COC[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789821550 TXGUPYRXBAQWFQ-SCTDSRPQSA-N 435.540 2.331 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3CCCCCCC3)cc2)C1 793731584 FUVJCOIHCSZRQV-FQEVSTJZSA-N 428.577 2.481 10 20 IECD CCN(CC)C[C@@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793795481 QMQRQGPERDLADW-HZPDHXFCSA-N 426.508 2.220 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1OC 794863979 KAWICHKBKINGSH-UHFFFAOYSA-N 445.475 2.174 10 20 IECD COCCN1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 801589637 IGOLKCVXBRJUAW-GXDHUFHOSA-N 439.584 2.004 10 20 IECD COc1ccccc1OCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803297485 XOZBHTIBHZNAAB-SFHVURJKSA-N 441.528 2.294 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@]4(CC=CCC4)C3)CC2)cc1 803751311 UJZZEXFVGAGZRX-RUZDIDTESA-N 440.588 2.282 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCC(F)(F)C3)cc2F)CC1 805007820 QRDLCKZGRWGPSR-INIZCTEOSA-N 426.483 2.135 10 20 IECD CCc1cnccc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805010217 XPINAXLNUSOEGA-QGZVFWFLSA-N 441.551 2.419 10 20 IECD CCNC(=O)COc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512057 JLOWSDGRCQEESW-UHFFFAOYSA-N 440.283 2.469 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@H](C(=O)N2CCCC2)C1 807819352 WRNOHPJUQUQGMM-AWEZNQCLSA-N 449.554 2.339 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C2CC2)cc1 808346366 SHBGNUYYGGKSFO-XZOQPEGZSA-N 442.604 2.128 10 20 IECD Cc1cnn([C@H]2CCN(CC(=O)c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C2)c1 810120412 CBKFBRAFNYBBEK-IBGZPJMESA-N 441.557 2.376 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCCN3C(=O)C(C)(C)C)CC2)cc1 914719505 MQAMLSGIRJRSAM-OAQYLSRUSA-N 430.593 2.361 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNS(=O)(=O)c2ccccc2F)cc1 916566443 YMPDLQTYDPBLEP-LJQANCHMSA-N 449.548 2.378 10 20 IECD Cc1nc2nc(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)nn2c(C)c1C 917247802 QMMBVFMDMDUECD-UHFFFAOYSA-N 444.536 2.434 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 917709534 QFITUBOTEJTPQP-UHFFFAOYSA-N 426.408 2.081 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 918286687 KBHXFLQDZROSSU-GASCZTMLSA-N 429.496 2.155 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)c(NC(C)=O)c3)CC2)cc1 918461833 ODASOCAWNAMQCH-UHFFFAOYSA-N 440.500 2.340 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 920091278 NNMVVEOPTLAXKY-ICSRJNTNSA-N 448.583 2.295 10 20 IECD COC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 920188121 DESLMATZOXLNKB-UHFFFAOYSA-N 444.463 2.120 10 20 IECD C[C@H](NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920882283 YQNAMVMUUQZVGC-INIZCTEOSA-N 429.542 2.455 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCS3)C2)C1 1784796229 IAMBDDWDZYJCHF-KXBFYZLASA-N 426.922 2.090 10 20 IECD Cn1nncc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3O)cc2)CCC1 1792298343 UDVYFXOTMOECML-ONNFQVAWSA-N 449.467 2.393 10 20 IECD CCC1(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)COC1 1792315806 DABCHVKNXZBVMC-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccnn2C)cc1 1794785745 OACKMIWIPWBLHE-JHDGKUDLSA-N 447.539 2.345 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CCOCC1)C1=NN(c2ccccc2)C(=O)C1 1795895890 OBIWZZYXYJBBEV-FNLKRUPLSA-N 438.528 2.234 10 20 IECD CC1(C)CCC(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)CC1 1796140654 TVGARXNNLYACLS-UPHUGPLXSA-N 431.533 2.303 10 20 IECD O=C(CCc1cn[nH]c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423737 FACQZHRWNYJMHO-SFHVURJKSA-N 427.505 2.082 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1829475127 FJSNEVJIZRDHHT-IBGZPJMESA-N 441.532 2.336 10 20 IECD CN(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1Cl 1845849522 PLFGYZUVPLUXKS-LJQANCHMSA-N 444.919 2.266 10 20 IECD O=C(CC12CCCN1CCC2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038238 ISWGWXCKTGKPHD-FNORWQNLSA-N 441.528 2.039 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H]2CCc3ccoc3C2)=NN1c1ccccc1 1847663990 WBSKNGMUUMLPJN-YYWHXJBOSA-N 446.507 2.379 10 20 IECD O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 31681669 IDPNMSOHQBELJT-UHFFFAOYSA-N 446.440 2.245 10 20 IECD C[C@@H](NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O)c1ccc(N2CCOCC2)cc1 60106142 HYUIIBNYGABRNE-MRXNPFEDSA-N 429.542 2.336 10 20 IECD CC1CCC(N2C[C@H](C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2=O)CC1 731325179 ROSLSBVBGSUSEF-IHWTVUROSA-N 440.588 2.432 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 735391768 BKBAYEROUYGUCY-UHFFFAOYSA-N 440.500 2.229 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCO[C@H](C(F)(F)F)C3)cc2F)C[C@@H](C)O1 739923739 XISAGWPOAZBGGQ-IYOUNJFTSA-N 433.446 2.319 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCCO2 746834375 JCTIDNREMYMYLC-UHFFFAOYSA-N 444.553 2.287 10 20 IECD Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NCc1ccc(N2CCCCC2)cc1 749909311 ZILUZVVQRVLGCB-UHFFFAOYSA-N 445.531 2.171 10 20 IECD C[C@@H]1OCC[C@]1(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 753054262 ZZUIQBOWYKBZCM-BUXKBTBVSA-N 435.458 2.399 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 756337341 UHRJHOLKBAXJOG-VXKWHMMOSA-N 438.524 2.500 10 20 IECD COc1cc(N2CCN(C(=O)NCC[S@](=O)C(C)(C)C)CC2)cc(OC)c1OC 759261947 QWSHMXQSYDJRPY-LJAQVGFWSA-N 427.567 2.091 10 20 IECD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 770543841 LMXGVLUZZTXAOT-INIZCTEOSA-N 433.521 2.337 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cn4ccccc4n3)cc2F)C[C@@H](C)O1 775125157 CMSIMCXQKCIOJU-HZPDHXFCSA-N 439.491 2.020 10 20 IECD CCCCn1c(N)c(N(CC)C(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)c(O)nc1=O 775832696 ABOLVFWQPXLFQB-HNNXBMFYSA-N 430.553 2.101 10 20 IECD COC(=O)C1(N(C)C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 778400382 ALFSRYLGXBYCTM-QXMHVHEDSA-N 443.544 2.234 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 781450202 RJKZESBZPBBFMC-UHFFFAOYSA-N 443.475 2.137 10 20 IECD COCCn1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 784307686 GZHDQONLKAWLPD-CQSZACIVSA-N 447.447 2.489 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3sc(-c4cnn(C)c4)nc3C)cc2)CC1 786258699 GJRASDYQTYHWLY-UHFFFAOYSA-N 438.557 2.451 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)CN1CCCCC1 787753258 XOCBXJUUKWZQNP-AWEZNQCLSA-N 426.355 2.494 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1-n1cccn1 788321865 CSXLESQDPGMBJD-GOSISDBHSA-N 433.512 2.203 10 20 IECD Cc1cc(F)cc2c1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 789801389 SOGCEPKNYUHVSB-UHFFFAOYSA-N 429.467 2.311 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CSCCS3)cc2F)C[C@@H](C)O1 789817179 GQKGNPQEAVQTQI-IIAWOOMASA-N 441.594 2.020 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(O[C@@H]2CCOC2)cc1 789900132 FUQPJRSYALIOFR-OAQYLSRUSA-N 430.526 2.019 10 20 IECD C[C@@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 793716397 CYZUUXNSRIGJQR-GHTZIAJQSA-N 436.556 2.267 10 20 IECD COc1ccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)c(O)c1 794388873 BGGQGFFFDCWGCV-MRXNPFEDSA-N 442.534 2.256 10 20 IECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661992 QICAHBJCMMGHNK-YOEHRIQHSA-N 436.528 2.270 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(OC)ccn3)CC2)cc1F 804852259 FEFVABMUURIGNC-UHFFFAOYSA-N 443.523 2.041 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3nc(C)ns3)CC2)cc1F 804852868 PNLPOXSKVKPCGB-UHFFFAOYSA-N 448.568 2.187 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCC(CCCN2CCOCC2)CC1 806281465 ZFVSVQIVFASPBZ-UHFFFAOYSA-N 440.635 2.093 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 807102888 IPGGSDCPODPWOV-HSZRJFAPSA-N 438.572 2.085 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 807631626 BUXHYHQQKUKKFR-LAUBAEHRSA-N 442.512 2.492 10 20 IECD CCN1CCC[C@@H]1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913660857 MFBLOAHXLJZMNB-MRXNPFEDSA-N 448.501 2.315 10 20 IECD NC(=O)CSc1ccccc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918036199 TYUULTDPIVRMPM-MRXNPFEDSA-N 441.557 2.287 10 20 IECD CCN(CC)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 918311349 QFKYFOAIJLGESR-UHFFFAOYSA-N 425.533 2.362 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920925797 LTFKFLJIQCSQPG-CQSZACIVSA-N 444.919 2.352 10 20 IECD CN1CCN(c2ccc([C@H]3NC(=O)c4cc(N5CCOCC5)ccc4N3)cc2F)CC1 1115863398 BGDGRZIZLAOEGD-JOCHJYFZSA-N 425.508 2.268 10 20 IECD COCCn1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1=O 1116446914 NHXZBGLCKSPSED-UHFFFAOYSA-N 449.510 2.315 10 20 IECD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1 1780778637 ZPTUMQILCNRMSY-UMESLIDUSA-N 438.480 2.269 10 20 IECD CC1(C)CC(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)C1 1785510700 YODOENVMDAIQPF-DOHLAZSCSA-N 430.501 2.083 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cnoc3)CCC2)cc1 1792315267 WKIUKOZFXWRJRU-UHFFFAOYSA-N 430.511 2.283 10 20 IECD CNCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807140919 ZKJDVRLYLIARSD-QRWLVFNGSA-N 446.935 2.465 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810553991 BWMXIQPGAVCVAQ-QGZVFWFLSA-N 432.565 2.316 10 20 IECD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cn1 1837417639 GRGGXJVAONRHEQ-UHFFFAOYSA-N 440.500 2.122 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3ncccc3[nH]2)C1 1845588749 WRXLDRFOTUYHIH-FNORWQNLSA-N 434.452 2.210 10 20 IECD CC(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056002 QFWZENNYGRHTTO-UHFFFAOYSA-N 431.583 2.487 10 20 IECD Cc1cc(C(=O)Cn2c(Cl)nc3c2c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1 10720383 JQIGDGHEPRMABT-UHFFFAOYSA-N 425.876 2.378 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 108199438 HAUXIZBAAMHVBC-UHFFFAOYSA-N 435.571 2.352 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(c2ccccc2F)C1=O 303571878 YOZNMBQCTCUAET-GOSISDBHSA-N 430.455 2.406 10 20 IECD COc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2=O)cc1 726503865 QBRNXVNAUFXANT-IBGZPJMESA-N 441.503 2.336 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1(N2CCCC2)CCOCC1 729597966 PWHXSJHWHGPDGV-UHFFFAOYSA-N 430.593 2.340 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)ccc1N1CCOCC1 730774884 ZQQUWRIHOJUPMY-UHFFFAOYSA-N 433.505 2.149 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 732673312 BPLFBOGVHTVCMV-LLVKDONJSA-N 439.456 2.323 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cc(OC)ccc3O)CC2)cc1 734064323 DSDAJJJZZIPCPO-UHFFFAOYSA-N 428.533 2.421 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[S@](=O)Cc3ccccc3)cc2)C1 735108498 UXRDSKXSMBCIQO-GEFUHLBYSA-N 442.585 2.136 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(N4CCNC4=O)c3)CC2)cc1 742928561 VUVVWYRDAWKQBK-UHFFFAOYSA-N 438.532 2.169 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)COc1ccc(S(N)(=O)=O)cc1 743809229 PLPTWWHMMPNZAU-UHFFFAOYSA-N 443.319 2.230 10 20 IECD Cc1ccc(CCC(=O)NCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 749266692 YOJYZAJGGVOPKU-UHFFFAOYSA-N 427.520 2.460 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 755300830 FIQJXQDEMRKCRD-UHFFFAOYSA-N 435.468 2.384 10 20 IECD COc1cc(N2CCN(C(=O)NCCCN3CCCCCC3=O)CC2)cc(OC)c1OC 759211969 QOTQDFNQJDIFJI-UHFFFAOYSA-N 448.564 2.337 10 20 IECD CCC1(CO)CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 764483973 GCOJZYPEWIFNFG-UHFFFAOYSA-N 433.574 2.409 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])c2cccnc12 765648498 LKNFJSDCQSTGTG-UHFFFAOYSA-N 440.481 2.308 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(N2CCOC2=O)c1 765926684 PADWQFBJXZBPHC-UHFFFAOYSA-N 434.246 2.366 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnn1CC(C)C 766578908 YQUFJQVSOGCURN-UHFFFAOYSA-N 431.512 2.203 10 20 IECD COC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 768931345 VDLLEHFBURMNDG-HXUWFJFHSA-N 438.528 2.217 10 20 IECD COc1cccc(CNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)c1O 769508605 YXKVYJNSGYIPQF-UHFFFAOYSA-N 443.319 2.344 10 20 IECD C[C@@H](NCC(=O)NCC(=O)N[C@H](C)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 775258167 RYZIARUHDLNQGS-QZTJIDSGSA-N 442.535 2.307 10 20 IECD CCOCCCN1CC[C@H](NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)[C@H](C)C1 775926783 AGRUFHMIXPOFJX-OFNKIYASSA-N 432.609 2.070 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(CCO)CCCCC3)CC2)cc1 778326765 RCGRSTJTPVIMHV-KTKRTIGZSA-N 429.561 2.349 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4ncn(C)n4)cc3)CC2)cc1 779756204 YASDSLGHEMAEBF-UHFFFAOYSA-N 434.544 2.433 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(F)c(Cl)c2F)cc1 779830771 IYEHQXVKQUDNEE-UHFFFAOYSA-N 440.833 2.489 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3cscc3C)CC2)cc1 785527050 JEKRKIGQJXKKMN-UHFFFAOYSA-N 430.574 2.010 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3c(C)nc4c(c(C)nn4C)c3C)cc2)CC1 786655580 FUKQCJFEGZUWDS-UHFFFAOYSA-N 448.571 2.421 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)c1ccc(N2CCOCC2)cc1 787639424 OWHFURHBYNKHKY-HTAPYJJXSA-N 442.535 2.259 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3c(F)cccc3F)cc2F)CC1 787909014 HGMBURUPOBKRDZ-UHFFFAOYSA-N 448.489 2.221 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN(c2ccccc2)C1 788324908 ZMYODRLDMHJRDV-QHCPKHFHSA-N 436.556 2.267 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2)CC1 789214672 KBKNBYISZJEDDN-FQEVSTJZSA-N 442.560 2.228 10 20 IECD CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789845105 KDWQCAUHUFZVLI-WOJBJXKFSA-N 435.540 2.065 10 20 IECD C[C@@H]1OCC[C@@]1(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 790261391 WVCWOZXBLMSBQJ-OYXJARGQSA-N 426.585 2.386 10 20 IECD C[C@H]1CCC[C@](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)(N(C)C)C1 793808247 AFHNUKZDTSOVAP-CYFREDJKSA-N 430.593 2.108 10 20 IECD COCCNC(=O)c1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 795954571 BSMHMDCWBUYMDR-UHFFFAOYSA-N 443.319 2.009 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 803134192 GKFCXHSYWIBRLA-NRFANRHFSA-N 438.528 2.145 10 20 IECD CCOc1c(OC)cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC 803662388 VTXWRCPVTPEJGN-UHFFFAOYSA-N 433.480 2.240 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3[C@H]4CCCC[C@@H]4C[C@H]3C)CC2)cc1 803747683 TYXYEINXVCXHFO-KNKQGSTJSA-N 428.577 2.113 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@@H]3c3ccccc3)CC2)cc1 803750536 NFOVONZJJGRKHQ-HSZRJFAPSA-N 436.556 2.297 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCOC4(CCCCC4)C3)cc2F)CC1 805010103 UPMIFXQDSLSLPT-UHFFFAOYSA-N 446.567 2.146 10 20 IECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768226 FXFMMZDLIAHXHM-BZUAXINKSA-N 425.476 2.399 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)S(=O)(=O)[C@@H](C)c3ccccc3)CC2)cc1 810020963 JEXYOHFVAWOZOM-SFHVURJKSA-N 431.558 2.367 10 20 IECD COCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 918070901 WPSBGWHFVYPEHR-UHFFFAOYSA-N 434.606 2.314 10 20 IECD NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 918372147 UEBCOXTVTCRARO-UHFFFAOYSA-N 440.319 2.185 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4ncsc4c3)cc2)C1 918464755 CMQSSZYGEIGSFU-HNNXBMFYSA-N 437.525 2.253 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccsc1)C2)c1cc(O)nc(O)c1 1777849317 SMSGCLQGQWNHJB-RRWGRLAFSA-N 443.525 2.395 10 20 IECD CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)CC1 1783370805 QLCSTDXUYPUIFB-QQMNAOGKSA-N 431.533 2.399 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cccs1)CCO2 1785509049 QFHRNJWXYZDQNM-KOXUSJRISA-N 430.482 2.022 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccccc1 1804340496 RWXSADRBHPTCOK-MXASKKJJSA-N 431.583 2.289 10 20 IECD C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189276 DFYSPTDMTZDYDR-DFXACFSPSA-N 444.582 2.080 10 20 IECD Cc1nc(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)o1 1819799281 APNWFPLKGUFOIE-CQSZACIVSA-N 426.433 2.440 10 20 IECD CC(C)n1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1827858978 QWVTYJZFNSVGMA-KRWDZBQOSA-N 442.520 2.212 10 20 IECD O=C(c1cccnc1Cl)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440991 XXTMCNFOLQFXIY-UHFFFAOYSA-N 437.887 2.345 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1-n1nnnc1C 472784716 FCCPPAGZWRBQCQ-UHFFFAOYSA-N 433.472 2.034 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)N[C@H](C)c3cc(OC)ccc3O)C2=O)cc1 728980883 PJXOXUDRMYVEFN-MCMMXHMISA-N 427.457 2.054 10 20 IECD CN1CCN(C)[C@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 732149394 INMKFABIQGICEY-DSQDWWTGSA-N 438.644 2.092 10 20 IECD COc1cc(OC)cc([C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 735680119 DOZVGEXVKOGSQT-NRFANRHFSA-N 433.480 2.212 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n(C(C)(C)C)n1 737131068 KXERIEPAMXPEGB-UHFFFAOYSA-N 427.549 2.410 10 20 IECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742242848 OZZCUQPULSHRDQ-FYIGHOIKSA-N 425.529 2.186 10 20 IECD CCNC(=O)c1ccc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742948332 RQMLEZNLTBCOJO-UHFFFAOYSA-N 439.560 2.066 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1=O 744878214 SDJRPSWSBWXSAI-HXUWFJFHSA-N 426.492 2.263 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 751294844 QDQBHEZDVLICJE-GOSISDBHSA-N 434.514 2.396 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4ccnn4)CC3)cc2F)C[C@@H](C)O1 753208557 ALWBUDMRJPUFSV-HDICACEKSA-N 444.555 2.059 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 753295778 ZUVUQWNBBAZDHR-SFHVURJKSA-N 445.585 2.141 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3cccc([N+](=O)[O-])c3)cc2)C1 758969853 NAHXJTUZOBOLGJ-GOSISDBHSA-N 425.489 2.338 10 20 IECD CCn1c(/C=C/c2cn(CC(=O)O)nn2)nc2cc(S(=O)(=O)C(F)(F)F)ccc21 759074439 DJOKQKDUGQEVGM-ZZXKWVIFSA-N 429.380 2.196 10 20 IECD O=C(O)CCC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 761258336 CNAXXZOSOYWMCE-UHFFFAOYSA-N 432.498 2.049 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)n1cccn1 761982422 LEYIMUPMMXMBTQ-CRAIPNDOSA-N 433.940 2.042 10 20 IECD C/C=C/C[C@@H](CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770349115 HWKHYGQTMFNIAT-DCKQQPRJSA-N 428.512 2.069 10 20 IECD O=C(CN1CC[C@@]2(C1)OCc1ccccc12)NCc1ccc(N2CCOCC2)c(F)c1 770673138 GJDIAKIFSXREEX-DEOSSOPVSA-N 425.504 2.410 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 774116990 LOPQTUSPCNJLGL-JTBPQFFMSA-N 434.489 2.415 10 20 IECD COc1ccc(N2CCN(CCN[C@@H]3CCS(=O)(=O)c4ccc(F)cc43)CC2)cc1 775497612 SRUWISHDMBYHMT-OAQYLSRUSA-N 433.549 2.465 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1ccc2c(c1)OCO2 778078347 GOCPMMOABVAMCY-UHFFFAOYSA-N 428.455 2.315 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CCCN3CCN(C)CC3)cc2F)C[C@@H](C)O1 779333621 YYVHYPUPWVDABS-KDURUIRLSA-N 435.588 2.218 10 20 IECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2C1 784670310 IKGVJGHRIXJQAO-HSZRJFAPSA-N 437.540 2.264 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc4c(c3)OCO4)cc2)C1 785370612 RJRJPPYTJIELAS-QGZVFWFLSA-N 447.495 2.437 10 20 IECD CS(=O)(=O)CC1(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 785407303 GJTYPBYYMPDMFZ-UHFFFAOYSA-N 445.540 2.236 10 20 IECD COc1cc(N[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)cc(OC)c1 785433974 QUWUFQKOZVEHMG-GOSISDBHSA-N 440.544 2.489 10 20 IECD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccc(N4CCC(O)CC4)c(F)c3)cc21 786574968 HKRIMBJYIZAJAO-UHFFFAOYSA-N 429.452 2.498 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1F 786750768 DDUOFCMXTQINRO-UHFFFAOYSA-N 435.521 2.008 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 789953246 BCYVTSUTNJQQIQ-MIFYACCESA-N 443.466 2.230 10 20 IECD COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 792212090 LDBXTJHROBUBKV-UHFFFAOYSA-N 438.406 2.201 10 20 IECD C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793723293 WLDRFIJYAKTTFJ-ZNLUXHQJSA-N 449.555 2.009 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ncccc3F)cc2F)C[C@@H](C)O1 795787542 RNGHZCYAJHHWIU-GASCZTMLSA-N 433.455 2.376 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)c(O)c1 797388321 XYRCJEZVNWCHSS-UHFFFAOYSA-N 439.390 2.176 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1OC 799121539 BOEYJURDTDAFRU-UHFFFAOYSA-N 428.517 2.262 10 20 IECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cc(Br)cc(C(N)=O)c1 799772565 GCNRWDJHAFLCKM-UHFFFAOYSA-N 426.336 2.401 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803661626 HXFAXWDFASANIG-GOEBONIOSA-N 436.528 2.270 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(OC)c(F)c3)CC2)cc1 804318767 BTKCOGYALGIKOI-UHFFFAOYSA-N 429.492 2.287 10 20 IECD COc1cccnc1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806550193 IZHWFEPWEDERFQ-UHFFFAOYSA-N 436.491 2.205 10 20 IECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 806919876 FJICWJUTIKLXLQ-UHFFFAOYSA-N 446.525 2.079 10 20 IECD COc1ccc(CN2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1F 807102482 ZXZXXGIMXAQJBQ-UHFFFAOYSA-N 442.535 2.169 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385624 NWSMDZWXSXTAEJ-UHFFFAOYSA-N 434.290 2.468 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)nc12 808564144 FWXHAJFBYJJZJT-UHFFFAOYSA-N 436.327 2.084 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@](CO)(c4ccccc4)C3)CC2)cc1 813050709 NYHFAWIEYNDCEY-VWLOTQADSA-N 438.572 2.163 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)c1 814271427 JZYGDSPLEUGTSC-AWEZNQCLSA-N 432.498 2.458 10 20 IECD CCC1CCC2(CC1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 917707409 DKSNSPCIXVROKB-UHFFFAOYSA-N 446.523 2.169 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(S(=O)(=O)NC2CC2)c1 917707690 WGIPNOYCLXRWDM-UHFFFAOYSA-N 433.505 2.033 10 20 IECD C[C@@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)CC1(F)F 1790245662 XVWBOEPPJPPJCE-JCTLKHEBSA-N 444.862 2.390 10 20 IECD CC(=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 1798418181 BGMQNUQMHPYPQO-MHORFTMASA-N 447.532 2.192 10 20 IECD Cc1ccc(C)c(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804336405 VKLCYRGTPRFVEZ-BCDXTJNWSA-N 445.610 2.344 10 20 IECD Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995179 DSWBAHVUFDUOME-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cncnc3)C2)CC1 1808505417 JXWVZACPEIGJOY-UHFFFAOYSA-N 446.511 2.114 10 20 IECD Cc1nc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cs1 1810547939 ZMOQHQLDMMSCTR-UHFFFAOYSA-N 430.530 2.345 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1 1814191072 GSKGHAIBFFMHEW-UZLBHIALSA-N 446.598 2.138 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(F)cn1 1816587222 RZXIKVBXDJHGHJ-HNNXBMFYSA-N 426.408 2.370 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848372 GLARXZOQYUJOJF-LRDDRELGSA-N 439.476 2.288 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1820772527 IYQAVRDXXKFXCY-RGIROJJOSA-N 435.575 2.308 10 20 IECD COc1cccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1844910272 KQYUAVOTRQWLMK-UHFFFAOYSA-N 432.480 2.305 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 69158062 MRHINVVLVDFWQH-UHFFFAOYSA-N 431.558 2.329 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CNC(=O)OC(C)(C)C)CC3)nc12 109805834 NHXMHDHBUSOPBZ-UHFFFAOYSA-N 433.509 2.348 10 20 IECD COc1cccc(CN2CCC(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 115735498 YAJCLDMKIXGGNE-UHFFFAOYSA-N 433.530 2.167 10 20 IECD O=C(NCCc1nccs1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237196 JLRUWVRUANYAJT-UHFFFAOYSA-N 441.536 2.441 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1 729293526 MBJKELQDMFGRSQ-XMMPIXPASA-N 439.556 2.452 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)NC(=O)[C@@H](CC)N4)nc12 729721818 SWOUKPAJRGQWAL-CQSZACIVSA-N 439.428 2.111 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 743872897 FEGVNDWDECOOMA-WFASDCNBSA-N 433.368 2.011 10 20 IECD Cc1nsc(N2CCN(CC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CC2)n1 746489294 FMGVVVSVXDPRSA-UHFFFAOYSA-N 447.520 2.383 10 20 IECD COC(=O)C1(NC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)CCCCC1 751931274 OZILUQXCUSGOKQ-UHFFFAOYSA-N 431.514 2.465 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C(=O)OC(C)(C)C)C[C@H]3C)CC2)cc1 754081165 JGHAXASZIFRHCQ-CTNGQTDRSA-N 448.608 2.119 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(C)c1 754212605 MUBDFAYSEJHWQC-UHFFFAOYSA-N 442.491 2.180 10 20 IECD COc1cc(N2CCN([C@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc(OC)c1OC 759886984 RYZFESRWCQQNQA-CYBMUJFWSA-N 448.545 2.022 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1 766270091 POQCUZQWLAUGKA-QGZVFWFLSA-N 432.546 2.341 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN([C@H]2CCC[C@@H]2O)CC1 769157652 XZBBIITVJYLISC-GOTSBHOMSA-N 430.593 2.072 10 20 IECD CCCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n(C)n1 772209784 RZFYVBIXFQFXBQ-HUUCEWRRSA-N 431.512 2.380 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c1 772775819 OSMAEEZPWWGOJR-PKNBQFBNSA-N 448.497 2.323 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccc(OC)c(O)c3)CC2)cc1 778326401 OWHQFQJYJDWYRA-ZHACJKMWSA-N 439.512 2.273 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1 784356263 YKSHKBLGKVOBMW-LEWJYISDSA-N 429.586 2.297 10 20 IECD COc1ccc(OCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 785561305 PRCOBUWAFHCQRX-FQEVSTJZSA-N 428.485 2.104 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3[C@H](O)c3ccc(F)cc3)CC2)cc1 787254284 UYASWLOKSPNBDR-JTHBVZDNSA-N 440.519 2.296 10 20 IECD CC(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 787342700 QJVIFDOSHGMMRU-OAQYLSRUSA-N 436.556 2.444 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3CCN(c4ccccc4)C3)CC2)cc1 788815568 OWGLIFQLKMVVDE-LJQANCHMSA-N 436.556 2.423 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F 789797574 AUOOTBWVKGULDY-AWEZNQCLSA-N 435.446 2.477 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798033 AOYAMXOXZXBMJX-UHFFFAOYSA-N 438.550 2.034 10 20 IECD CC[S@](=O)[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848076 YPNAJIQVNKESNX-CEKZQKLHSA-N 437.631 2.052 10 20 IECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 799833088 LCSDDJSYHLUMTL-UHFFFAOYSA-N 433.530 2.376 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H](N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803309182 QWBCOOAGABHHHX-FPOVZHCZSA-N 428.577 2.177 10 20 IECD CC1CCC(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)CC1 803310143 DKQXFAOUQXRGAI-FUHYEJFZSA-N 442.604 2.423 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc21 813281097 QTWRNTNGLSDVRF-UHFFFAOYSA-N 444.513 2.272 10 20 IECD O=C(COc1ccc(N2CCCC2=O)cc1)NCc1ccc(N2CCOCC2)c(F)c1 917710020 ZAQXUMYIPNKUNW-UHFFFAOYSA-N 427.476 2.484 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2NC1=O 918298049 WVFWGKNPXHRWQD-PBHICJAKSA-N 439.468 2.258 10 20 IECD C[C@H]1CN(Cc2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@H](C)O1 919812736 NOJPTYNIZYAQQQ-HOTGVXAUSA-N 447.557 2.303 10 20 IECD O=C(CN1C(=O)CCOc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971097 OEGFJQIIUNFRRT-UHFFFAOYSA-N 427.476 2.219 10 20 IECD C[C@H](NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 920868759 LHYUXMVWIIYPJT-CVEARBPZSA-N 432.546 2.292 10 20 IECD CCN(CC)[C@H](CN/C=C1\C(=O)NC(=S)N(CCOC)C1=O)c1ccccc1Cl 920979392 KTNNAKFQXOQJBS-OKACTXMXSA-N 438.981 2.086 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3CNc3cccc(C)n3)CC2)cc1 1320971208 VJZGNWUABJRPKS-GOTSBHOMSA-N 439.604 2.458 10 20 IECD Cc1scc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1C 1795334513 SGCVLGSXLDWWHX-BTTYYORXSA-N 437.612 2.477 10 20 IECD C[C@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603305 IOECMWQESPUFIG-HNKHHVNMSA-N 428.514 2.320 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)C(=O)C1CC1 1803060658 GJLLJEXPHLSLKB-RDTXWAMCSA-N 443.887 2.445 10 20 IECD CNCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1807140917 ZKJDVRLYLIARSD-FOIQADDNSA-N 446.935 2.465 10 20 IECD Cc1noc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816401983 NSOHKERSTOHAAC-AWEZNQCLSA-N 426.433 2.440 10 20 IECD O=C(/C=C/c1cnccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822870966 HUYQQGAKNZCVKA-DWTRPJMMSA-N 435.444 2.025 10 20 IECD COc1ccc(F)c(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1846804464 KLGFWUYQEVWQTJ-XBXARRHUSA-N 442.443 2.482 10 20 IECD O=C(c1cccc2ccoc12)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055638 NUIIYGYIBLCNGR-UHFFFAOYSA-N 429.523 2.110 10 20 IECD O=C(O)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 15036508 BFWHYLZRWMBDFE-XFFZJAGNSA-N 429.317 2.241 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(N4CCSCC4)cc3)nc2)CC1 108092677 VFTDXOWOYHUQRD-UHFFFAOYSA-N 447.630 2.183 10 20 IECD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727991004 DGXOQQQAOSDJNY-LGCWCKNTSA-N 444.601 2.262 10 20 IECD Cn1c(S)nnc1CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 731438397 HYVBXJSQMJHDQY-DHZHZOJOSA-N 439.613 2.463 10 20 IECD COc1ccc(N2CCN(C(=O)CN(c3ccc(C(C)=O)cc3)S(C)(=O)=O)CC2)cc1 731664485 OFYCAMMBICMRSV-UHFFFAOYSA-N 445.541 2.013 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(N(C)CCCO)CC3)cc2F)C[C@H](C)O1 741079192 BGRXPYATWFMJMQ-ROUUACIJSA-N 436.572 2.428 10 20 IECD COc1ccc(N(CC(=O)N(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)CC(C)C)cc1 744395726 WNYXEXLUAROUAI-TZIWHRDSSA-N 438.590 2.352 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](CN(C)CC4CC4)C3)CC2)cc1 746414813 UXGXJHCWWUFQKH-NRFANRHFSA-N 429.609 2.191 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)C3CCN(CCc4ccccn4)CC3)nc12 746458687 VCMLQOWVYXFSTL-UHFFFAOYSA-N 438.532 2.146 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnn(CC(=O)NC2CCCCC2)c1 746583274 MWINGUYQRZQHBC-UHFFFAOYSA-N 439.560 2.441 10 20 IECD COC(=O)c1nscc1S(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 751014196 PVWWQWNWBFINRP-TXEJJXNPSA-N 443.522 2.161 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 752871980 PVUBBPKWKDDDNO-VJIACCKLSA-N 441.528 2.257 10 20 IECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 753106764 JCJRKWLXQHPSCI-BQRYGKNWSA-N 445.589 2.316 10 20 IECD O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 753965717 GITZMNOWOGQYDS-SFHVURJKSA-N 437.562 2.039 10 20 IECD CNC(=O)c1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759929638 UFDRHJYWSNFVHP-UHFFFAOYSA-N 428.489 2.426 10 20 IECD C[C@H]1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS1(=O)=O 759986836 CZFYHAXEYGLZCO-LSDHHAIUSA-N 440.521 2.298 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](N2CCCC2=O)C1 761114754 OUHUSGDQKGRQNF-CVEARBPZSA-N 431.492 2.486 10 20 IECD O=C1[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCN1Cc1ccccn1 761732686 BEXHGTDZDIGXIA-QGZVFWFLSA-N 428.876 2.396 10 20 IECD COc1ccc([C@H](CCO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764353325 WRVCMLDUOUSINN-UGKGYDQZSA-N 440.544 2.320 10 20 IECD O=C(CN1CCN(Cc2cccc(F)c2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 766153137 DKGCBBXVOQMWRI-UHFFFAOYSA-N 444.526 2.235 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cnn(CC(F)(F)F)c3)cc2F)CC1 772649546 JPQLVMGMODVUCN-UHFFFAOYSA-N 449.474 2.205 10 20 IECD C[C@]1(C2CCCCC2)NC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772876369 RFQYBILXIOEGTK-HSZRJFAPSA-N 446.523 2.169 10 20 IECD C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 775835784 JIOPUNPQFHBXPE-KRWDZBQOSA-N 448.564 2.075 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(OC)c(F)c3)CC2)cc1 778232653 LPLHOJWZYCBLQA-KTKRTIGZSA-N 427.476 2.364 10 20 IECD CC(=O)N(Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1)C1CC1 785296597 GXAPCVHVQALWAX-CQSZACIVSA-N 425.485 2.295 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1COc2ccccc21 789840826 NWJXJZGVAHQTIA-HNAYVOBHSA-N 441.503 2.084 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21 789950008 LSOPBWYTSIXDBK-WIOUJZMWSA-N 437.462 2.319 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c(O)c1 797388902 FOMYDKPKKMNLRN-UHFFFAOYSA-N 429.542 2.247 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](CCCO)c1ccccc1)c1ccc(N2CCOCC2)cc1 803299935 OWDNNZRHUNEGED-AVRDEDQJSA-N 425.529 2.330 10 20 IECD CC(C)N(CCN(C)C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451827 XSAMINODQDGCDQ-UHFFFAOYSA-N 426.508 2.172 10 20 IECD CCN(CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 804256253 LQZVMZQFUAEMJZ-UHFFFAOYSA-N 448.564 2.107 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cn1C 804971527 FLZHZGMWRSJSDQ-UHFFFAOYSA-N 433.530 2.240 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc1 806087356 DUFPUGMYOPAVCK-FGZHOGPDSA-N 430.593 2.251 10 20 IECD Cc1cc(C)c(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2=O)c(C)c1 808210227 SKRWUBJWBKDINH-IBGZPJMESA-N 440.519 2.355 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccnn1C 809793466 FLLYQVMWIFIISM-MOPGFXCFSA-N 428.533 2.189 10 20 IECD CSCc1cccnc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 811437199 HDKWKUJONFFNDF-UHFFFAOYSA-N 433.505 2.394 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc(OC)c1OC 917833475 OQBOCXGHWHDTDB-MRXNPFEDSA-N 427.501 2.344 10 20 IECD NS(=O)(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1F 919895194 FVOQWHOUUFMDIF-UHFFFAOYSA-N 432.521 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccn(-c5ccncc5)n4)n3)CC2)cc1 1261162033 JITVVUIJGPHYSL-UHFFFAOYSA-N 445.483 2.217 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 1322874905 YZOAFBGECZTDBX-OAHLLOKOSA-N 437.949 2.171 10 20 IECD CCOC(=O)C1=S=c2nc(NC(=O)c3c(Br)cnn3CC)sc2=C1C 1530604946 RGVVGQAOIXGVQM-UHFFFAOYSA-N 443.348 2.278 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cncs1 1786209653 AXYRDVYALFRUNN-WBIUFABUSA-N 437.905 2.115 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)C)C[C@@H]32)cc1 1790126280 NEXOFQIBDNRXIN-PMVMPFDFSA-N 438.572 2.249 10 20 IECD CSCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1793408907 GBJVNAYICWGBOV-YWVIFJGQSA-N 442.965 2.344 10 20 IECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cccs1 1804340585 WDDQNZPXQFYFPV-YIYPIFLZSA-N 437.612 2.350 10 20 IECD Cn1ncnc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1807961630 XCJFXKWIXOUPJC-UHFFFAOYSA-N 433.896 2.038 10 20 IECD CCc1noc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725993 QVMOYPALYNZQMU-LLVKDONJSA-N 443.485 2.348 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1 1826213132 NULSZNOPEMAOHZ-GOSISDBHSA-N 426.473 2.141 10 20 IECD CCc1[nH]nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1F 1827427049 NHTVJETUAAPYPD-MRXNPFEDSA-N 445.495 2.465 10 20 IECD CN1CCC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)C1 1827427653 GQUAXPFWWGPXAH-MJGOQNOKSA-N 430.549 2.068 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc3ncsc3[nH]2)C1 1844394419 LCJQTLYKCZGTAS-UHFFFAOYSA-N 448.508 2.234 10 20 IECD O=C(c1ccc2ncncc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037163 DVBIBVLZGQNEQO-QPJJXVBHSA-N 446.463 2.277 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1 727363362 URIAPMZJJMBJKM-UHFFFAOYSA-N 427.486 2.129 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1 729064173 QRBCDAQNWHELFN-INIZCTEOSA-N 426.517 2.359 10 20 IECD CC(C)OC(=O)Cc1nc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cs1 733463982 DXHAHUMQBZUTTB-UHFFFAOYSA-N 428.488 2.071 10 20 IECD CNC(=O)COc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC 735520383 ZLKDZXNOCBNOIB-SFHVURJKSA-N 428.485 2.347 10 20 IECD O=C1CCc2cc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc2N1 738888084 BTWAYWIPSKCOBD-UHFFFAOYSA-N 428.514 2.128 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 742920797 UJEQLKFNEIAIRJ-IBGZPJMESA-N 428.577 2.115 10 20 IECD Cc1cc(C(=O)CN2CCC3(CCOCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 744429468 VWXIKCOCKJOFKS-UHFFFAOYSA-N 431.558 2.427 10 20 IECD Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2)n1C 746380735 FOQHZQGHRYZNOP-INIZCTEOSA-N 448.527 2.443 10 20 IECD CN1CCCN(c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)CC1 747017377 AQWSHFBFLUQYSW-UHFFFAOYSA-N 435.572 2.466 10 20 IECD CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 749634212 WBPZXGYQRUCVTI-UHFFFAOYSA-N 444.557 2.099 10 20 IECD CS(=O)(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 751136200 FSWWSJXKPNCESK-MRXNPFEDSA-N 425.528 2.166 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)c(F)cc3F)CC2)cc1 753370863 MKUFFPDYNIZREK-UHFFFAOYSA-N 425.501 2.382 10 20 IECD CN(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCCC2)cc1 753567585 ADHRTCIRHOHZDT-QHCPKHFHSA-N 437.588 2.375 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754211589 HEQABJMTEDQEHZ-UHFFFAOYSA-N 430.436 2.300 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c(C)o1 754694227 NQPMQPVXTHQAMU-UHFFFAOYSA-N 446.470 2.275 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3cn(CC(C)C)cn3)CC2)cc(OC)c1OC 759105137 ZWCSMULFJIAJSL-UHFFFAOYSA-N 438.550 2.076 10 20 IECD CCc1nnc(O)c(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1CC 760083210 DCZQRZFPGZCITI-UHFFFAOYSA-N 430.505 2.295 10 20 IECD CCc1csc(-n2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cn2)n1 762955500 NXLCBNDWHNEZLY-UHFFFAOYSA-N 445.570 2.056 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(C)c(OC)cc3C)CC2)cc1 773068280 MEDZGZIHAHRDSP-UHFFFAOYSA-N 440.544 2.198 10 20 IECD Cc1nc2ccccc2n1CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 775109331 RSZAPXVFFNPKFV-UHFFFAOYSA-N 435.528 2.004 10 20 IECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 777899856 WAHVDEXDVNTFNT-UHFFFAOYSA-N 437.587 2.404 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NC(=O)Nc2ccc3c(c2)OCCCO3)cc1 784557639 NTQBMADNQBPUIQ-UHFFFAOYSA-N 443.456 2.184 10 20 IECD CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785527127 ASHLBLWDMDQBDU-UGKGYDQZSA-N 430.593 2.409 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1 785562304 VYKGIQDNPRQNPV-OAQYLSRUSA-N 425.529 2.321 10 20 IECD Cn1cc([C@@H]2CSCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 790237017 IXFKHSDOUAMPNP-PXNSSMCTSA-N 442.589 2.122 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2csc(-c3ccccc3)n2)ccc1O 790404669 GLSMSTQRJWTQDW-UHFFFAOYSA-N 425.513 2.225 10 20 IECD Cc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 793722074 JXZAPPGABHJOJF-AZUAARDMSA-N 436.556 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@](CO)(c4ccccc4)C3)CC2)cc1 794734773 NYBZPFMSKNGLSW-XCMWCYMESA-N 449.551 2.063 10 20 IECD CN(C)S(=O)(=O)c1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nc1 797652800 PSGAHQMUBUPBOK-INIZCTEOSA-N 434.518 2.251 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ncc(C)c(OC)c3C)CC2)cc1 803669145 HZSOXUISJXDDBF-UHFFFAOYSA-N 426.517 2.117 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3cccc(Cl)c3)CC2)cc1 803752086 XZPPSIBKAFNZGO-UHFFFAOYSA-N 444.963 2.245 10 20 IECD COC(=O)c1cc(C)nc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 804373053 PZBUFDWMXMNEJX-UHFFFAOYSA-N 437.479 2.439 10 20 IECD CC(C)(O)[C@@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770093 YAODGFKNTWHQGT-YOEHRIQHSA-N 425.476 2.135 10 20 IECD CCC1(O)CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 809319857 BOEBXVOVAJKEGJ-BUIXOBLPSA-N 435.540 2.255 10 20 IECD COC[C@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN(C(=O)OC(C)(C)C)C1 810192719 KMBAELFPJBTDBA-QHCPKHFHSA-N 433.549 2.413 10 20 IECD COc1cc(N2CCN(C(=O)NCC[C@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc(OC)c1OC 813786132 KNNGORAHKMMFGB-QQMNAOGKSA-N 433.549 2.485 10 20 IECD CC(C)C(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 917055693 UHJAAPVBQNCTRJ-ROUUACIJSA-N 448.583 2.292 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc4c(cc3F)CCC(=O)N4)CC2)cc1 918461573 GLHQCXCMNIWTJT-UHFFFAOYSA-N 440.475 2.396 10 20 IECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 1321295701 GVTUHDIPKRTMFQ-HNNXBMFYSA-N 439.465 2.293 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)s3)C[C@@H]21)c1cc(O)nc(O)c1 1787291683 LMAZCEKJURYTMK-DRZSPHRISA-N 437.905 2.115 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1=CCCC1 1816702998 PAHSPGHFSBJKSA-CQSZACIVSA-N 433.559 2.372 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CC[C@H](O)CC2)n[nH]1 1822538892 MWDCHRCVBWUYPN-XNRPHZJLSA-N 429.477 2.073 10 20 IECD O=C(CCc1cncnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426272 QYBNKORTYPIAJZ-IBGZPJMESA-N 439.516 2.149 10 20 IECD CCC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878148 FLASNKXFNLWOCB-LKUPDRCFSA-N 430.501 2.415 10 20 IECD CCOCCCN1CC[C@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)[C@@H](C)C1 516592936 TYPJBUUKDMNHFC-PXNSSMCTSA-N 428.577 2.356 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(CC(=O)N4CCCC4)CC3)cc2)CC1 731049735 MOAPXVXTEZJFNK-UHFFFAOYSA-N 427.593 2.373 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCCCSc2nccs2)C1 733973810 XJBZFXFYMAYFDI-CQSZACIVSA-N 443.620 2.182 10 20 IECD CN(Cc1nccn1C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 734176554 HCEVIFIAXZUZMX-UHFFFAOYSA-N 445.457 2.107 10 20 IECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 743872895 FEGVNDWDECOOMA-IUODEOHRSA-N 433.368 2.011 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 746755373 PAJFPOMAPDOHIK-NRFANRHFSA-N 426.561 2.374 10 20 IECD COc1cc(N2CCN(C(=O)c3ccnc(N4CCCC4)n3)CC2)cc(OC)c1OC 759220124 DYKVKXIQLDANMN-UHFFFAOYSA-N 427.505 2.065 10 20 IECD CCN(CC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl)c1ccc(OC)c(OC)c1 760829777 QABNHKRNDMMUML-UHFFFAOYSA-N 427.910 2.470 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccn(CCC(C)C)n3)cc2F)CC1 766439895 XLOCNUWNESYWDL-UHFFFAOYSA-N 444.555 2.465 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 785296647 OMDKZDWCPOVKOX-HNNXBMFYSA-N 425.485 2.410 10 20 IECD Cn1ccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)cc1 785600435 SKXXENITAVMNLC-OAQYLSRUSA-N 433.487 2.457 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@H](O)C[C@H]3C)c2C)c1 788274726 AFWYZJAWTHQFNX-BFUOFWGJSA-N 428.485 2.305 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)sc1Cl 788885375 GMGXCOCCXMSZBK-UHFFFAOYSA-N 434.992 2.423 10 20 IECD CC(C)N1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824582 JJMWUTRITCUIPH-WSTZPKSXSA-N 448.583 2.292 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797390922 ZUETXLUMPUCOQM-UHFFFAOYSA-N 435.502 2.198 10 20 IECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)NCCF 800183751 HPYUEDVUQQBJQQ-COVOJHCQSA-N 429.564 2.320 10 20 IECD CCCCn1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)n1 803298040 NGJXEIBJWQCUFQ-QGZVFWFLSA-N 427.549 2.322 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803308530 GKEGPAPKXPIDRF-IAGOWNOFSA-N 448.564 2.072 10 20 IECD COCCN(Cc1ccnn1C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677145 GWOODKFDTWFTOP-UHFFFAOYSA-N 441.576 2.480 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)c1cccc(S(=O)(=O)NC)c1 804389168 NSBPXHKNGSWUCG-INIZCTEOSA-N 447.557 2.306 10 20 IECD O=C(NCCC1(O)CCOCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 804969828 NRYVYTUFKLPHFY-UHFFFAOYSA-N 431.455 2.273 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCO[C@@H](C)C3)cc2)CC1 805023877 MOKXGALLXMZRKS-FQEVSTJZSA-N 430.593 2.156 10 20 IECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc2[nH]1 807387470 LEPUNQJDZWJUNP-UHFFFAOYSA-N 445.273 2.251 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@@H]1CCO 807768168 DMISUULGHBJIHC-IIDMSEBBSA-N 425.476 2.040 10 20 IECD O=C(COC(=O)[C@@H](O)c1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)c(F)c1 811278986 BNGMHMVBRSVCEC-FQEVSTJZSA-N 436.867 2.209 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](O)C23CCCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 814668142 ZZOAJLZIOOOQLC-NRFANRHFSA-N 431.558 2.304 10 20 IECD COc1ccc(N2CCN([C@@H](C)C(=O)NCCc3ccc4c(c3)OCCO4)CC2)cc1 856903856 VKKSRQVOOFJXAX-SFHVURJKSA-N 425.529 2.336 10 20 IECD COc1ccccc1-c1csc(NS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)n1 915222649 PQTBKQOGYSDRNT-UHFFFAOYSA-N 425.513 2.267 10 20 IECD CC(C)(C)C(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918008345 JSKMYGNMOOWFFF-GOSISDBHSA-N 443.592 2.225 10 20 IECD COc1cccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1OC 918334146 FGPWDHLXZOZHRB-UHFFFAOYSA-N 432.542 2.188 10 20 IECD C[C@@H](OC[C@H]1CCCO1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 921006558 CYQSICVDAFTBII-IEBWSBKVSA-N 443.523 2.143 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)CC(C)C)CC3)cc2F)CC1 1318574686 PRZWGGBBNKKDRY-UHFFFAOYSA-N 433.572 2.368 10 20 IECD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cnc1C 1794265319 XWJFCANJLSQDDX-HGKCTWBKSA-N 445.903 2.280 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CCCCC1)C2 1802079911 YYGJUAVGGFONEU-BPHLJZQPSA-N 448.491 2.079 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1 1803651601 ANEBDZYVDYDCOH-KEEKTEOCSA-N 426.448 2.100 10 20 IECD Cc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1805241914 QHZIBHGMJDMGBE-KDOFPFPSSA-N 439.497 2.286 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)c1ncon1 1811182942 HAVSKLJQWWPEKN-MLGOLLRUSA-N 443.847 2.163 10 20 IECD CCN(CC)C[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729156 RRXDKMZXJAPXJV-GXTWGEPZSA-N 447.561 2.153 10 20 IECD Cc1ncc(/C=C/C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843442189 FMUKWKSCNKWANJ-CMDGGOBGSA-N 449.536 2.461 10 20 IECD C[C@@H](Nc1cccnc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501005 OYURKRJRVNQXCH-CYBMUJFWSA-N 430.892 2.464 10 20 IECD COc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1OCC(N)=O 115773771 YQIVWPBHPXYWKB-UHFFFAOYSA-N 438.528 2.344 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ncc(C)c(OC)c3C)CC2)cc1 726248642 QGMTWCMCSQTGPW-UHFFFAOYSA-N 427.549 2.337 10 20 IECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)c1O 727761002 HAFWEGUGXMBCJL-UHFFFAOYSA-N 440.468 2.396 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)o1 730933127 WVBQHJVAIYUBFW-UHFFFAOYSA-N 425.444 2.220 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc1F 731408016 AGZJUBWKBQIMNO-UHFFFAOYSA-N 426.448 2.153 10 20 IECD COC(=O)CN(Cc1cccc(S(=O)(=O)N(C)C)c1)Cc1cc(Cl)ccc1O 731844786 JBFCBCSYLHLXKE-UHFFFAOYSA-N 426.922 2.471 10 20 IECD C[C@H](OC(=O)c1ccc(C(N)=O)cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 748894245 SERQVNCMFRNUJJ-LBPRGKRZSA-N 443.415 2.140 10 20 IECD CN1CCCc2cc(CNC(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)ccc21 751085287 KWQONEPDVCOKFN-UHFFFAOYSA-N 429.609 2.495 10 20 IECD Cc1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C(N)=O 751374185 XECPTQNRAXOBFO-INIZCTEOSA-N 437.949 2.396 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](c3nc(C4CC4)no3)C(C)C)CC2)cc1 754182477 DXGFRBJVRUQKJN-TZIWHRDSSA-N 429.565 2.425 10 20 IECD COc1cc(N2CCN(C(=O)COCCOc3ccccc3)CC2)cc(OC)c1OC 759221150 NZUXMXSTTBGNCC-UHFFFAOYSA-N 430.501 2.457 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 759358088 ABOCYFBLFZHEDZ-KBPBESRZSA-N 446.479 2.117 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1O 760366485 WUJNKRFEUZIVSC-UHFFFAOYSA-N 440.499 2.066 10 20 IECD CS(=O)(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 764733155 AZZFACJEGLWHBN-PBHICJAKSA-N 431.505 2.475 10 20 IECD CS(=O)(=O)Nc1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cccc2nonc12 765073361 HRNBEAUCXFCNNP-UHFFFAOYSA-N 436.393 2.414 10 20 IECD Cc1cc(C(=O)CN2CCN(C(=O)[C@H](C)O)CC2)c(C)n1-c1ccc(OC(F)F)cc1 766266960 GXWQZCBOWPWUHA-INIZCTEOSA-N 435.471 2.403 10 20 IECD CCC[C@@H]1CN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CCN1CCOC 766377276 RAKMXBVIILAIND-HSZRJFAPSA-N 433.593 2.360 10 20 IECD CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)O1 774773831 ZEHRGWSMCAUOPD-ZWKOTPCHSA-N 440.491 2.192 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)N3CCCCC3)cc2F)C[C@@H](C)O1 774889710 MQUAJQYWXNSVKS-HDICACEKSA-N 448.583 2.436 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)cc1 776239880 WVHNEEYDJREBQJ-OAHLLOKOSA-N 432.546 2.195 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1 779459060 MNEGFQFDGNYBHJ-UHFFFAOYSA-N 432.376 2.272 10 20 IECD COC(=O)COc1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc1 782190379 ZTFBMFVUELUIED-GHRIWEEISA-N 436.555 2.162 10 20 IECD O=C(COC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1ccc(O)c(O)c1 784340822 XMZVIBYVGPEWSD-CQSZACIVSA-N 433.844 2.405 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1 788933734 XFUMCUNDVRCSQE-HXUWFJFHSA-N 426.561 2.200 10 20 IECD CCn1ccnc1[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812188 KEJXEFGFTYPIEQ-HXUWFJFHSA-N 443.523 2.249 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)c3ccccc23)cc1 797431555 RRNKBOIGAMWBHS-UHFFFAOYSA-N 448.526 2.475 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccc(N2CCOCC2)cc1 803304083 CSPSQOIHIPWLEX-JXFKEZNVSA-N 429.542 2.362 10 20 IECD CCNC(=O)C1(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CCC1 803677073 FLWYPZQVWHBQTN-UHFFFAOYSA-N 428.577 2.494 10 20 IECD O=C(NCCC1(O)CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 803702819 CABXDHOQMZMDQA-UHFFFAOYSA-N 435.458 2.136 10 20 IECD CC[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)S1(=O)=O 805773385 QLRXGSWRCKDIFR-HUUCEWRRSA-N 440.521 2.298 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)cc1 806087350 DUFPUGMYOPAVCK-FCHUYYIVSA-N 430.593 2.251 10 20 IECD O=C(N[C@@H]1CC[C@@H]2SCCS[C@@H]21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809520922 GXFXFKUYPOBSCO-OGWHTMIXSA-N 436.599 2.396 10 20 IECD COc1cc(Br)cc(CN2CCC(C(=O)N3CCN(C)CC3)CC2)c1O 809733012 ONVSQNJXKKCJQT-UHFFFAOYSA-N 426.355 2.149 10 20 IECD COc1ccc(N2CCCN(CC(=O)N(C3CCCC3)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 917089737 JTNYJGBPLKVXBV-OAQYLSRUSA-N 449.617 2.166 10 20 IECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NCc1ccc(N2CCSCC2)cc1 917383793 MVIBWXZZUUOJKG-UHFFFAOYSA-N 442.497 2.190 10 20 IECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 918284722 QERNWCURVCYGTA-UHFFFAOYSA-N 428.464 2.184 10 20 IECD CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)CC1 918444479 TWGDXKWNEMHUJZ-UHFFFAOYSA-N 445.541 2.410 10 20 IECD CC(C)Oc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918462526 BVUTYKOTKHDKHH-SFHVURJKSA-N 438.528 2.430 10 20 IECD CCCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918464687 ZIIIFPNSQMMRPR-GOSISDBHSA-N 438.528 2.432 10 20 IECD CCN(CC)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919782558 BEEZGAIFOJKJTQ-UHFFFAOYSA-N 443.571 2.473 10 20 IECD C[C@H](Cn1cccn1)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919785330 XRHBVTKKGVEUPH-QGZVFWFLSA-N 438.511 2.027 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OCC(=O)N(C)C)c1 920189910 RPXGSGUUXNGBKH-UHFFFAOYSA-N 426.517 2.125 10 20 IECD CN1CCN(c2ccc(CN3CCC[C@H](S(=O)(=O)NC4CCCC4)C3)cc2F)CC1 1320243324 YAPNKQMSVNLPQK-FQEVSTJZSA-N 438.613 2.404 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccoc4s3)C[C@@H]21)c1cc(O)nc(O)c1 1787291149 KOPAGKULOJMPND-QEJZJMRPSA-N 443.481 2.208 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2CNC(=O)C2)cc1 1801675711 RXCMWRXWHNUZEA-KRXUUXHPSA-N 434.540 2.482 10 20 IECD Cc1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816722286 GGZSYRGCSUMWGY-ZDUSSCGKSA-N 425.470 2.192 10 20 IECD O=C(CC[C@@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823028163 IQTGTLLGQDIDKY-CZUORRHYSA-N 429.477 2.339 10 20 IECD CO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832878247 HNYIJFCHGIVXOW-ZYMDLIBXSA-N 432.517 2.471 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cn2cc(Cl)cn2)C1 1843028665 GGYSHMILFYDEME-UHFFFAOYSA-N 425.272 2.118 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2c[nH]c(=O)cn2)C3)cc1 1845398847 KWWAMOUBBCDTDQ-UHFFFAOYSA-N 431.496 2.308 10 20 IECD Cc1cccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1848113151 JNAMZFJTZSXWDT-VXKWHMMOSA-N 445.523 2.317 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3ccn(CC(=O)N(C)C)n3)cc2F)C[C@H](C)O1 726080676 LZHLUPJWISVTSB-GJZGRUSLSA-N 432.500 2.046 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F 727928185 RAUJALBQWDAABN-MRXNPFEDSA-N 445.438 2.418 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3c(F)cccc3F)cc2)C1 741081124 LLYXIVGVVSFCTJ-KXBFYZLASA-N 432.471 2.199 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC([C@H](O)C(=O)OC)CC3)c2C)cc1 749535642 SNRUIZNFHZLXHE-QFIPXVFZSA-N 442.512 2.309 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 749731898 ZZOMAELSQJRFGP-UHFFFAOYSA-N 432.527 2.029 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cnccc3SC)CC2)cc1 750252843 DVBWBCCLNRBABM-UHFFFAOYSA-N 443.573 2.079 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](Cn2ccnn2)C1 752631837 QMKVHWKYUYAPJY-CQSZACIVSA-N 447.542 2.398 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 756365047 XVOFYWPSHOAQFC-HNNXBMFYSA-N 434.514 2.051 10 20 IECD COc1cc(N2CCN(CN3C(=O)NC4(CCC(C)CC4)C3=O)CC2)cc(OC)c1OC 758953097 ASOVNOMZJWZUKK-UHFFFAOYSA-N 446.548 2.293 10 20 IECD C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 760209818 AGSDEFXZIQNGLT-CQSZACIVSA-N 429.496 2.209 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccccc1C[S@](C)=O)c1ccc(N2CCOCC2)cc1 762639450 HAXSMBUMBUHIEB-JTBPQFFMSA-N 429.542 2.218 10 20 IECD C[C@H]1COCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762704202 LZCFSEWWZBDPDF-YVEFUNNKSA-N 435.458 2.256 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CN1Cc1ccccc1 764347866 WVIXPXDJXAFDGT-UHFFFAOYSA-N 426.492 2.298 10 20 IECD C[C@@]1(c2ccc(CNC(=O)NCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 765483864 XXHXHMQQSLHANS-IBGZPJMESA-N 447.289 2.209 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc21 767691732 UMGTXSGAPRDJJH-UHFFFAOYSA-N 444.513 2.117 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc(O)n1 777136163 BNWNACSWELUCTJ-GJZGRUSLSA-N 431.464 2.322 10 20 IECD CN(C)CCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 782368306 NLGBGIRJGXKLCC-UHFFFAOYSA-N 438.572 2.254 10 20 IECD CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788320915 RKNANSJXKBFQAY-RUZDIDTESA-N 439.556 2.329 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3cncc4ccccc34)CC2)c1 788620930 IGJJRKIOTUHDQN-UHFFFAOYSA-N 426.498 2.274 10 20 IECD CS[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)C 789845994 YDIMFUGIPLKUTN-SFHVURJKSA-N 425.570 2.297 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@H](c2cccc(O)c2)C1 789863793 HZXQKIVSVCBXQU-NRFANRHFSA-N 441.553 2.162 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21 789867507 HANBWIMFADHZKO-FGTMMUONSA-N 437.656 2.352 10 20 IECD CC(C)(C)C[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734107 PRTKOLVRYIZVHT-UYAOXDASSA-N 428.577 2.432 10 20 IECD O=C(COC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53)NCc1ccc(N2CCOCC2)c(F)c1 796317114 HLAGKXRGCBUFDY-SHFCHBAXSA-N 440.515 2.216 10 20 IECD CCOC(=O)c1cc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc(S(C)(=O)=O)c1 797633950 YDBNULYUUZYJAK-LBPRGKRZSA-N 436.486 2.431 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(N2CCOCC2)cc1 803312194 WBCIDPKVVCYWDR-IBGZPJMESA-N 434.540 2.393 10 20 IECD CC(C)(O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 806854360 ZGQWRWHFVNHQEA-UHFFFAOYSA-N 429.492 2.269 10 20 IECD CCCS(=O)(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 808277340 OZZXRKCPNQTIIO-UHFFFAOYSA-N 438.571 2.390 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H](C)O)cc1 813685083 BTGXKVWEBXKDRD-MEDUHNTESA-N 447.340 2.352 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 914455879 GJGZPPSIDDOVPF-UHFFFAOYSA-N 440.525 2.372 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917383365 CTHHSAOYAZIXRS-UHFFFAOYSA-N 435.571 2.352 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1C[C@@H]2CCCN2c2ccccc21 918284850 RMUFUBFVUBVQGQ-SFHVURJKSA-N 438.503 2.294 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN1CCN(c3ccc(OCC)cc3)CC1)n2C 1323032798 IBGQPPLXZDOHDJ-UHFFFAOYSA-N 440.548 2.357 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1)CCO2 1785508130 YKOXFIWCHCESLA-NKOINVLESA-N 442.443 2.099 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccn(C)n2)cc1 1794792917 KRHMIRITMGPHTC-JHDGKUDLSA-N 447.539 2.345 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)no1 1798908538 DBBJFWWOPYRHQV-RRJKNOHSSA-N 427.457 2.319 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2(C)COC2)C3)cc1 1799620155 SBYHSNQUNJPUSA-VTYHHJSWSA-N 437.540 2.334 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1 1809511436 NXTOBCJNPTZZFS-QRCPMIHRSA-N 445.903 2.237 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2nc(N)c3ccccc3n2)CC1 22818474 PCSDBBDPPLEWLN-UHFFFAOYSA-N 447.587 2.054 10 20 IECD CC1CCN(S(=O)(=O)C2=S=C(C(=O)Nc3ccc(-c4ncn(C)n4)cc3)C=C2)CC1 544343438 PPUWJDIONCUWKL-UHFFFAOYSA-N 445.570 2.088 10 20 IECD CC[C@@H](C)NC(=O)CN1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728195312 JNRDSWDHOQYJRP-QGZVFWFLSA-N 425.529 2.361 10 20 IECD Cc1cc(C(=O)CN2CCC(CN(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 732569643 SZJHVXJKWQRTRT-UHFFFAOYSA-N 432.590 2.198 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1 742041002 GZBXYXXDPKUVNZ-MRXNPFEDSA-N 435.594 2.209 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)cs1 743046737 PIHUEOCNJDAVTM-UHFFFAOYSA-N 448.511 2.435 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c(OC)c1 743889616 PHDOJOJAHPLMTI-UHFFFAOYSA-N 429.473 2.154 10 20 IECD Cc1c(NC(=O)C(=O)NCCCSc2nccs2)c(=O)n(-c2ccccc2)n1C 749731584 UOWWLPLYWDYIED-UHFFFAOYSA-N 431.543 2.178 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(N2CCCC2=O)CC1 751061003 QFJVSGUDQZKGAH-UHFFFAOYSA-N 449.554 2.482 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@H](C)N3CCCCC3)CC2)cc1 753286530 MZLGFQHTWRDTBB-PISNEZEASA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3ccccc3Cl)CC2)cc1 754008971 JICILECCNAICPL-IBGZPJMESA-N 446.979 2.402 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(N)=O)ccc1-n1cc(C)cn1 755195274 ZJBSMIBXOJRFGN-UHFFFAOYSA-N 448.527 2.333 10 20 IECD COC(=O)c1cccc(OC)c1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758226496 XHQVPCLTKRWSPD-SFHVURJKSA-N 430.501 2.052 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 759873948 RATLQNBRXGNTRA-UHFFFAOYSA-N 445.585 2.052 10 20 IECD COc1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(OC)n1 759959659 XOGDTZAFBZVHEQ-UHFFFAOYSA-N 432.477 2.479 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@H](NC(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 760658686 VWBGEMFNIUZEBZ-RKVPGOIHSA-N 433.528 2.185 10 20 IECD O=S(=O)(NCc1ccco1)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765014932 YSTUYVHZBBRANH-UHFFFAOYSA-N 434.455 2.095 10 20 IECD COc1cc(O)c(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)cc1OC 768445132 FREVRBPLMYUILX-UHFFFAOYSA-N 426.457 2.198 10 20 IECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 769869442 ANVPEOQHHGEPKM-UHFFFAOYSA-N 435.461 2.360 10 20 IECD Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(C(F)(F)F)n1 772956482 YXACKUJKVWLEHU-UHFFFAOYSA-N 427.452 2.247 10 20 IECD O=C(NCc1cn2ccccc2n1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 775125715 FCPUFXJXILBDQH-HNNXBMFYSA-N 443.454 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)C(=O)Nc3ccccc3)CC2)cc1 778273829 ZCNOCEXBJOLXIR-QFQMRYFISA-N 436.512 2.043 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779011499 DZUUMVQVNYKTMG-QWHCGFSZSA-N 427.523 2.139 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](O)[C@H](O)c3nc4ccccc4[nH]3)cc2F)C[C@@H](C)O1 779607790 UFCABMNDBXRSAX-GDMOEJLQSA-N 442.491 2.026 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1 788321385 VOXKDVLXFJMDJW-LJQANCHMSA-N 440.519 2.064 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 789835914 RNKXOXFFZMVICF-JFIYKMOQSA-N 433.524 2.273 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)c(OC)cc2Cl)ccc1O 790407419 LJBHHMUXROJKCR-UHFFFAOYSA-N 441.314 2.417 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)ccc(C)c3[N+](=O)[O-])cc2)CC1 790878418 UTIBOPOCWXTWMF-UHFFFAOYSA-N 446.529 2.359 10 20 IECD C[C@H](c1cccs1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793731536 FLIPEBOYSFUYNZ-WBVHZDCISA-N 428.558 2.286 10 20 IECD Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793754660 DPIXNHOQIQJVJR-UKRRQHHQSA-N 435.475 2.292 10 20 IECD COc1ccc(CCCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 793763191 UADCKCRMXRMBNE-GOSISDBHSA-N 425.529 2.458 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccccc1OCC(=O)N1CCOCC1 797633208 XAHTYAVYZJNGKX-HNNXBMFYSA-N 429.473 2.088 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N(C)Cc1ccccc1 803304957 GFUXJTOTIINDSO-VQTJNVASSA-N 438.572 2.337 10 20 IECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308672 HSZHVFDWADUPQI-IAGOWNOFSA-N 448.564 2.120 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3ccnn3C)C(C)C)CC2)cc1 804316864 MCCNEUBPAFTOCQ-FQEVSTJZSA-N 427.549 2.070 10 20 IECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386918 QILTYOAASXXJOO-UHFFFAOYSA-N 447.289 2.248 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)CC2)cc1 807664908 QVIPGPUOGIOQHY-UHFFFAOYSA-N 448.564 2.153 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H](C)S1(=O)=O 811864951 QEGZSSMBTUOQDQ-KBPBESRZSA-N 449.495 2.259 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nnn1-c1ccn(C)n1 814406502 ZKIRFQDYXNXQLH-UHFFFAOYSA-N 449.437 2.095 10 20 IECD O=C(COc1ccccc1CNCc1ccc(N2CCOCC2)cc1)NC[C@H]1CCCO1 916846112 HZIYVOKBIFNXHG-HSZRJFAPSA-N 439.556 2.487 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918309549 AOPUMOSODAUILN-UHFFFAOYSA-N 426.473 2.299 10 20 IECD O=C(CN1C(=O)COc2ccc(Cl)cc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970936 KCABUVCCLUQYKR-UHFFFAOYSA-N 447.894 2.482 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 1117671139 YQKHMQOUTMGMHL-UHFFFAOYSA-N 447.557 2.111 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc4c(c(S(N)(=O)=O)c3)CCC4)CC2)cc1 1319626708 XRVYVQAOMBZSNS-UHFFFAOYSA-N 429.542 2.184 10 20 IECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319949620 ACIAMEJMPPKNIZ-RBBKRZOGSA-N 445.627 2.390 10 20 IECD Cc1cscc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777847955 FPXYEJMFGMGXEA-IIBYNOLFSA-N 431.514 2.304 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@@H]31)C2)c1cc(O)nc(O)c1 1796137768 PMKWQALWNXLYTE-BVGZRJROSA-N 443.544 2.303 10 20 IECD CCc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992093 UXSPZHQKVWTCHI-AOMKIAJQSA-N 447.495 2.479 10 20 IECD Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1811605161 MTPDQMZZYMQFHE-IIBYNOLFSA-N 435.484 2.168 10 20 IECD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)CCC1 1814406099 KRKXCIOIQGJJMC-CYBMUJFWSA-N 435.575 2.452 10 20 IECD CCc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721161 HGDPBRBUPOPOPF-AWEZNQCLSA-N 439.497 2.446 10 20 IECD CC(=O)O[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1828767148 IOTAFTYUZWMGKE-NQIIRXRSSA-N 447.532 2.314 10 20 IECD CC(C)c1nc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)no1 1845500802 QPHDQKFGEHPTEI-UHFFFAOYSA-N 434.880 2.317 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(=O)(=O)N(C)C)ccc1F 728301408 AHHGTMMDGBVOES-UHFFFAOYSA-N 435.521 2.185 10 20 IECD COC(=O)[C@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 728539806 QRJFBLGAQWGQPM-PCRWRXJSSA-N 440.568 2.130 10 20 IECD CC1(C)CN(C2(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCCCC2)CCO1 733364009 DWCKZMOBARRTOF-UHFFFAOYSA-N 439.578 2.307 10 20 IECD CC(=O)N1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 751227295 GVMAHWVNICDPKL-UHFFFAOYSA-N 447.532 2.174 10 20 IECD COc1ccc(N2CCN(CCCNc3cc(N4CCCC[C@H]4CO)ncn3)CC2)cc1 753551017 MCZLEBPAHOAGSQ-NRFANRHFSA-N 440.592 2.461 10 20 IECD CC[C@H](C)c1nc([C@H](C)NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)n[nH]1 754709527 KTJYDCZSEJSRKG-BUINCNPSSA-N 440.548 2.409 10 20 IECD COc1cccc(OC)c1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 757158576 JXYBJYYKJISLQC-UHFFFAOYSA-N 446.475 2.082 10 20 IECD O=C(NCC1(CCO)CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 764861891 ISBLNAINMFVDQA-UHFFFAOYSA-N 449.485 2.384 10 20 IECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 765659601 NLSGTHCWRWKRKQ-WBVHZDCISA-N 428.455 2.256 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)cc2F)CC1 769156811 UFEKBIQCARFRLO-DHIUTWEWSA-N 447.599 2.145 10 20 IECD C[C@H](NC(=O)N1CCC([C@H](O)c2nccn2C)CC1)c1ccc(N2CCOCC2)cc1 771971312 RLUITIBSVCECKJ-UWJYYQICSA-N 427.549 2.473 10 20 IECD CC(C)n1cnnc1[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772222069 WCOBFRXYFVTSHF-LJQANCHMSA-N 444.555 2.331 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1ccccc1S(=O)(=O)N1CCCC1 772674336 ALVNVHXCSWLAFG-UHFFFAOYSA-N 447.629 2.388 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN([C@H]2CCOC2)CC1 773480424 CGGACDJLQDGETM-SJORKVTESA-N 433.508 2.196 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1 774363142 QXQFRFUCXFEGMM-UHFFFAOYSA-N 433.464 2.325 10 20 IECD CCN(Cc1ccccc1)C(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 774363242 XJIGVRRWCDXOOQ-UHFFFAOYSA-N 438.572 2.372 10 20 IECD CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 776118710 SMENNMKZSLHYLZ-SFTDATJTSA-N 435.540 2.248 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1C 780407163 GVBIKKISYOKZJB-UHFFFAOYSA-N 431.514 2.251 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)CC2)cc1 784356755 SIIHSBRYLQEINK-VXKWHMMOSA-N 427.545 2.175 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(Cc3cccc(C)c3)CC2)cc1 784554515 KGBSNCJWALKZLC-UHFFFAOYSA-N 425.529 2.327 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(C[C@@H]4CCCO4)CC3)cc2)CC1 787117139 QMFUUDLCVMULHA-QHCPKHFHSA-N 442.604 2.299 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@@H](C)O1 787197043 JCEVNLWTKVIEIU-RTBURBONSA-N 449.555 2.004 10 20 IECD CC(=O)N[C@@](C)(C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797495129 QULOMBTZTMEUHA-OYHNWAKOSA-N 431.558 2.385 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 802609755 KRNJEFTXQXVHPS-UHFFFAOYSA-N 433.530 2.410 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@@H](C)C3CCCCC3)CC2)cc1 803750655 MWYSECTXTVYZKX-IBGZPJMESA-N 430.593 2.361 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1)c1ccc(N(C)C)cc1 807670537 GGUNYALPYLJPQI-XLIONFOSSA-N 443.617 2.096 10 20 IECD CCOc1cccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 807671957 VPLHQNKCCFMPJR-KRWDZBQOSA-N 425.533 2.072 10 20 IECD CCn1cc(CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 807768760 BDQYFCVKYJNIRJ-MRXNPFEDSA-N 435.475 2.248 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCC(n2ccnc2)CC1 807769825 IPIMGJBSKLJFDL-INIZCTEOSA-N 447.486 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@@](C)(c4ccc(F)cc4)C3=O)CC2)cc1 810022757 YXMRWECSGCVTKQ-DEOSSOPVSA-N 439.487 2.200 10 20 IECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(N2CCCNC2=O)cc1 812762898 DFILADBYXCGMGC-CYBMUJFWSA-N 432.502 2.174 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCN(C)C(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 912704594 OYVHJJLYPUKEMH-MRXNPFEDSA-N 426.469 2.460 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 918286689 KBHXFLQDZROSSU-HUUCEWRRSA-N 429.496 2.155 10 20 IECD CC1=CC(NC(=O)c2cccc(F)c2)=S=C1C(=O)Nc1ccc(-c2nnnn2C)cc1 1617755745 RFYFIRGUOPGDLU-UHFFFAOYSA-N 436.472 2.380 10 20 IECD COc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)ccc1O 1810546538 JEMNZKKPMUJUSP-UHFFFAOYSA-N 441.484 2.366 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(OC2CCN(C(=O)c3ncc[nH]3)CC2)CC1 1837340354 IWSKRTLTYPBHLJ-UHFFFAOYSA-N 448.907 2.400 10 20 IECD Cc1cc(C(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 16134574 SGUNCBLKOUAVDL-UHFFFAOYSA-N 426.473 2.128 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3=NN(C)C(=O)CC3)c2C)cc1 17734139 AAXQDHMWYHAFKZ-UHFFFAOYSA-N 425.441 2.215 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)CC2)cc1 110421674 XIVWSUQISHIHNC-UHFFFAOYSA-N 435.521 2.483 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3csc(-c4cnn(C)c4)n3)CC2)cc1 117277392 RUDTUFYNJCXFMQ-UHFFFAOYSA-N 440.573 2.494 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@](C)(C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 725798756 ARJCDZLQLCDUNG-SRGWNRLKSA-N 442.535 2.046 10 20 IECD COc1ccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cc1O 726626996 NQAMDEDLDZQAPA-CXUHLZMHSA-N 436.536 2.450 10 20 IECD CSc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 726977150 XEGCEUWHCJAMHQ-UHFFFAOYSA-N 426.585 2.122 10 20 IECD COc1ccc(N2CCN(CCCNCc3cccc(NS(C)(=O)=O)c3)CC2)cc1 727464276 NNHGIIRNORTAMG-UHFFFAOYSA-N 432.590 2.369 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1 741095310 KOMREHSQNSDOHK-UHFFFAOYSA-N 444.557 2.099 10 20 IECD O=C(NCCOC1CCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 743557725 SRGHAFWJXHXVHN-UHFFFAOYSA-N 428.512 2.311 10 20 IECD C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 746831757 HYDAWDNLXQANSO-INIZCTEOSA-N 439.578 2.041 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN3C(=O)CC(C)(C)C)nc12 748381278 DYAGWKLXAWZONP-HNNXBMFYSA-N 432.477 2.082 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 748485156 DCTCYFVWHKTTIC-UHFFFAOYSA-N 431.514 2.212 10 20 IECD O=S(=O)(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnn([C@H]2CCOC2)c1 751979903 MLHDPHNIQGZVFH-INIZCTEOSA-N 442.488 2.393 10 20 IECD Cc1nn(C)c(C)c1C(=O)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753614516 ZQHBVWXUHQABRR-UHFFFAOYSA-N 445.431 2.177 10 20 IECD COCCCn1c(S)nc2cc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)ccc2c1=O 753642364 BWVVSHOZIJQDPK-ZDUSSCGKSA-N 443.525 2.494 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](c4cccc(F)c4)C3)CC2)cc1 754028791 BTKFXDGSGCHIMQ-VWNXMTODSA-N 429.536 2.391 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)N1CC[C@H](CO)C1 759700607 DDELZWRPGIGPNT-OBTCNRAFSA-N 441.372 2.491 10 20 IECD Cc1ccccc1-n1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 761871889 ODPMRZFRBPBPGR-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 766379954 ATUZQXUMKJPEMK-OAHLLOKOSA-N 443.500 2.365 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](c4nccn4C)C3)cc2F)C[C@@H](C)O1 767114232 AEHJSPIDYDXZQF-SCTDSRPQSA-N 429.540 2.279 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cccc21 769259156 FTIGDXUTBMIDHX-UHFFFAOYSA-N 438.553 2.404 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(-n5cccn5)n4)n3)CC2)cc1 771055630 HKTBFQSGORAVHC-UHFFFAOYSA-N 445.483 2.217 10 20 IECD C[C@@H](NC(=O)N(C)[C@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 771768806 KZNJRRDFIXSCPE-XXBNENTESA-N 429.609 2.394 10 20 IECD COc1c([N+](=O)[O-])ccc([C@@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)c1O 772177117 LMNKTIXUQAZBJH-QGZVFWFLSA-N 426.389 2.317 10 20 IECD COc1ccc(N2CCC(NCCNS(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 773009895 PTGBRHDEZRGYFN-UHFFFAOYSA-N 434.518 2.140 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 774778817 FNUVNFDJEVBBKI-RTWAWAEBSA-N 425.529 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccnc(N4CCCC4)c3)CC2)cc1 778223148 INDNDSADQVBZDG-HJWRWDBZSA-N 449.555 2.212 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 779479670 MSSVXTLGPPBQMT-UXHICEINSA-N 427.526 2.438 10 20 IECD COC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)on1 781274255 FUXDMCXFHKZTFN-LLVKDONJSA-N 448.387 2.421 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NCC(=O)Nc2cccc(Cl)c2C)cc1 784566202 STRPNVDTKAKTRN-UHFFFAOYSA-N 433.892 2.391 10 20 IECD C[C@@H](OCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 785565555 ZDBNYLSNDFYOLI-LJQANCHMSA-N 425.529 2.424 10 20 IECD CC(C)Nc1nc(NCCO)nc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 786575105 JIFRMPRPHXAJEP-GJZGRUSLSA-N 433.532 2.461 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1 786752526 MPTFMJIZELWSOY-UHFFFAOYSA-N 443.569 2.355 10 20 IECD Cc1ccccc1OCCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321576 XSTSKDUPRLSSMA-UHFFFAOYSA-N 425.529 2.375 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 788333280 RHVWDSFBXOUNPI-GGAORHGYSA-N 437.540 2.424 10 20 IECD Cc1ccc(O[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 788412591 KICMAOJFNZZMKP-IBGZPJMESA-N 425.529 2.374 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)cc1 788977000 GIXRGDCHQWSAHZ-SFTDATJTSA-N 443.636 2.166 10 20 IECD CN(CC1(N(C)C)CCC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449699 JXTALKJFLLGGBG-UHFFFAOYSA-N 438.519 2.316 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(NC(=O)c2ccccc2)CC1 807287595 KUBKXLVFOYOMSO-UHFFFAOYSA-N 432.524 2.100 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1 807695270 SNKZDNBNSRIZKC-INIZCTEOSA-N 447.333 2.293 10 20 IECD Cc1cc(C)c(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2=O)c(C)c1 808210228 SKRWUBJWBKDINH-LJQANCHMSA-N 440.519 2.355 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3COc4c(F)cc(F)cc4C3)cc2)C1 812011253 YUGGLBTXKKDUAT-QAPCUYQASA-N 444.482 2.469 10 20 IECD Cn1cnnc1Sc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1[N+](=O)[O-] 916590745 LAWLLPBIWSUCLQ-UHFFFAOYSA-N 430.398 2.325 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCCc4ccc(F)cc43)cc2)C1 918464902 DFEUNBQWYQKPBC-SFHVURJKSA-N 438.503 2.123 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2cc3c(cc2Br)OCCO3)C(=O)NC1=S 920979549 BWLLJUIWKHGFFH-JXMROGBWSA-N 440.319 2.415 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1 1320364622 FFUFMRHSNOJNCX-UHFFFAOYSA-N 428.558 2.495 10 20 IECD CC(C)C1(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCC1 1785510562 PRGUDIXZZBOZTQ-BVBLWJPBSA-N 444.528 2.473 10 20 IECD O=C(CCN1CCOC1=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427935 IERSBGVAEPDMJO-UHFFFAOYSA-N 440.456 2.083 10 20 IECD CO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823479292 FWKJVOSYXZGGLB-SYFYSMEQSA-N 430.461 2.267 10 20 IECD CCN1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1823551308 OEMUGRHJZLFTEJ-QGZVFWFLSA-N 442.520 2.254 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(Br)c(O)c2)C1 1845375688 HAXDQUWSSVGPFG-UHFFFAOYSA-N 448.273 2.092 10 20 IECD O=C(COC(=O)CN1CCCCCC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 11385513 LNXVUEMMMFPRBD-UHFFFAOYSA-N 434.448 2.346 10 20 IECD COC(=O)[C@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 728539801 QRJFBLGAQWGQPM-JFBXQDQPSA-N 440.568 2.130 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1 729231115 URLMOBINFRUIAN-CQSZACIVSA-N 427.505 2.058 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC(=O)N3CCc4ccccc43)cc2F)CC1 730127235 LTTAZINCAXASNN-UHFFFAOYSA-N 439.535 2.356 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2)C1 736006364 QFJUBYMHPHPHMX-FQEVSTJZSA-N 428.577 2.040 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Cc3c(C)nn(C)c3C)CC2)cc1 745276076 LZEWHRMUIFUSNP-MRXNPFEDSA-N 428.533 2.116 10 20 IECD O=C(NCc1nnc2n1CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751064337 IKHCYIARFWGCBJ-UHFFFAOYSA-N 433.515 2.112 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)o1 751354077 NQIHQNRISVPIML-STQMWFEESA-N 439.509 2.179 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4c(cccc4NC(C)=O)C3)CC2)cc1 754012437 HPUWBHIVFMBLSQ-JOCHJYFZSA-N 438.572 2.195 10 20 IECD COc1ccc2c(c1)[C@H](NC(=O)/C=C\c1cnn(C)c1)CCN2C(=O)/C=C/c1cnn(C)c1 760651211 YPRKGCRHGCDUJW-XNRIYHRASA-N 446.511 2.483 10 20 IECD COC(=O)c1cn([C@H]2CCCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)C2)nn1 762571092 KQGIZGVZVQOBFZ-APWZRJJASA-N 442.520 2.009 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](CC(=O)OC(C)C)C3)CC2)cc1 766914599 DHTBJZSVLJUOQT-RBBKRZOGSA-N 433.593 2.232 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1 767495519 VEGLFLUVVYZHRJ-IBGZPJMESA-N 449.548 2.280 10 20 IECD O=C(COC(=O)Cc1cc(F)c(F)cc1F)NCc1ccc(N2CCOCC2)c(F)c1 768075376 GWXQSNOMUYFGBW-UHFFFAOYSA-N 440.393 2.482 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(F)cc3C(=O)N(C)C)CC2)cc1 768136119 XWNYGTNQFWEEPR-UHFFFAOYSA-N 442.491 2.260 10 20 IECD NC(=O)c1cc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)on1 769257778 AIKWPONBYDKVIB-JYRVWZFOSA-N 436.540 2.133 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)O1 774776904 USLONBLPPGVTPC-JLSDUUJJSA-N 440.491 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3(c4noc(C)n4)CCCC3)CC2)cc1 778242086 QXXAUNZDHIZPPD-KTKRTIGZSA-N 439.516 2.177 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCN1CC(C)(C)O 780313063 UWSWFKYXRLSKPY-RCCFBDPRSA-N 436.572 2.426 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCc2nc(C)ncc2C1 786673837 MDJXANHITFYIEG-MRXNPFEDSA-N 447.333 2.275 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 788955645 YPRSNQUKCJJFPW-JOCHJYFZSA-N 436.556 2.409 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CCOc2ccc(F)cc21 789800173 MOXLPDCZXYGGJU-GOSISDBHSA-N 431.439 2.058 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccc(F)cc1 789814104 XYBQYAKXPPATEM-HNNXBMFYSA-N 433.455 2.001 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccs1 793723458 WYQMDBFMGORKKD-KRWDZBQOSA-N 442.585 2.160 10 20 IECD C[C@@H](c1cccs1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793731534 FLIPEBOYSFUYNZ-RDJZCZTQSA-N 428.558 2.286 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3c(C)nn(CCN(C)C)c3C)CC2)cc1 795092992 NMFFNWGXKGOTMN-UHFFFAOYSA-N 435.594 2.017 10 20 IECD COC(=O)[C@@H](CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1)c1ccccc1 795288929 AVTSDNRMYZWBKA-AWEZNQCLSA-N 446.934 2.410 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cncnc3)cc2F)C[C@@H](C)O1 796166088 RHMKYHVBLDQAMS-HZPDHXFCSA-N 430.480 2.022 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 797629542 IOLBAMOSGACCDC-CYBMUJFWSA-N 430.486 2.440 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1 799253811 WWJDBFXEBWXCRN-XOBRGWDASA-N 441.484 2.135 10 20 IECD C[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCOCC1 803448430 RCGZAQRUVNTBDV-AWEZNQCLSA-N 425.476 2.304 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@@H]3[C@@H]5OC)CC2)cc1 806332827 BGALOTRPHNRRMY-HYYNZMQPSA-N 428.577 2.272 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)C2CC2)cc1 807841944 MDJKOAHDRPSCKZ-LJQANCHMSA-N 426.561 2.151 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]4(CCCN(C)C4)C3)cc2F)C[C@@H](C)O1 815144731 NMALIGMLMJQMFU-YDIMBITNSA-N 432.584 2.473 10 20 IECD Cc1nc2ccnn2c(C)c1CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917836707 RRFHXRGMCLSBOU-LJQANCHMSA-N 434.544 2.297 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 918286645 JLZXYUNELLAWEB-OKILXGFUSA-N 429.448 2.423 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(OC)c1 918442711 RSUVRUTYDSHSGB-UHFFFAOYSA-N 427.501 2.167 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(F)c3F)cc2)C1 918463000 GDNZEPVFVZTFEC-CYBMUJFWSA-N 434.418 2.061 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccccc2CC)C1 1320386620 OIGDKGYFQXYDMA-MSOLQXFVSA-N 440.496 2.304 10 20 IECD Cc1cc(C)n2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)c2n1 1796604099 GORIYPJYQKKCRN-BJWYYQGGSA-N 435.484 2.323 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1800253734 INESDSCIMHUTHV-GGPHIMKMSA-N 448.527 2.000 10 20 IECD O=C(C[C@@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283686 KLFXBZZPVXPPOI-XNZHWBCHSA-N 430.501 2.414 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1 1823500683 HBSUTAUDGJRSAX-GFCCVEGCSA-N 439.538 2.154 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@]3(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826266448 RKKUBPKNFSYXKE-MHIIWPAESA-N 426.857 2.100 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1F)CC2 1828197725 HJHKAYAOSSJVFX-NBGZAXBNSA-N 433.461 2.243 10 20 IECD CC(C)(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1834786469 VMUNPBNYODNCJH-NRFANRHFSA-N 440.924 2.257 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc1 726616483 MWCNWSLRLYIYLN-PMACEKPBSA-N 445.608 2.296 10 20 IECD CN(CC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729227026 OEFGQDIBJWKQAC-UHFFFAOYSA-N 428.455 2.306 10 20 IECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C(=O)N(C)C 741094961 BNRZKERLKPZNGJ-UHFFFAOYSA-N 438.528 2.131 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 741097859 ZKEXHSWMDNNPGS-OAQYLSRUSA-N 434.496 2.435 10 20 IECD CC1(C)NC(=O)N(CCCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742805760 NQAACCDWQIJCEF-CQSZACIVSA-N 438.475 2.484 10 20 IECD O=C(NCCCSc1nccs1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746020440 VODFSGBMWOGNGG-INIZCTEOSA-N 445.570 2.291 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1 747571751 PFSMFBXLFSXNPG-QLFBSQMISA-N 431.493 2.116 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCC(N(C)C)CC3)cc2F)C[C@@H](C)O1 748960710 QJOWLIQCPHDQMR-HDICACEKSA-N 435.588 2.265 10 20 IECD O=C(CN1CCC[C@@H](Cn2ccnn2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 752062693 CKCCVYUGNUVXFN-MRXNPFEDSA-N 429.480 2.404 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC3(c4ccccc4)CCOCC3)CC2)cc1 754070557 ZUGIVKKYUNMCBV-QHCPKHFHSA-N 425.573 2.474 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc4nc(C)cc(C)n34)CC2)cc1 758195038 BNUFUUUACINDRK-GOSISDBHSA-N 428.562 2.025 10 20 IECD COc1ccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(OC)c1 759886625 NYNHTEYFMASFJJ-UHFFFAOYSA-N 445.516 2.490 10 20 IECD COc1cc(N2CCN(C(=O)[C@H](NC3CCOCC3)C(C)C)CC2)cc(OC)c1OC 760454202 LQXVXQWFASNVAH-OAQYLSRUSA-N 435.565 2.154 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 763278437 AYCULAAKUKZRIV-AWEZNQCLSA-N 436.530 2.498 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)cc1 768029664 MMYJVJKSIVCHRY-UHFFFAOYSA-N 431.562 2.156 10 20 IECD C[C@H](NC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(N(C)C)cc1 775404279 MJFHRLGKGJADGH-KKSFZXQISA-N 435.528 2.480 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4ccccc4n3C)CC2)cc1 778219524 HLEZBZHYJDZLRN-QXMHVHEDSA-N 433.512 2.103 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc([S@](C)=O)c3)CC2)cc1 778267746 FNXJYUQOUSVPEL-QVUHDTGZSA-N 427.526 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](C4CCN(C)CC4)C3)CC2)cc1 778393968 CBXZLOCORJFIOR-NJRZHNRPSA-N 440.588 2.090 10 20 IECD COCCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786291293 WTMAHVYMCKWOFG-UHFFFAOYSA-N 429.492 2.231 10 20 IECD Cc1nccn1-c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 787480224 CADJYDWEKKRGKU-HXUWFJFHSA-N 449.511 2.105 10 20 IECD COC(=O)COc1ccc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)cc1[N+](=O)[O-] 788691507 XWRSGGMIDYXXPC-MDWZMJQESA-N 440.455 2.213 10 20 IECD COc1ccc(CC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1 789178177 VFSGEUCMGBOPHI-HZPDHXFCSA-N 445.491 2.245 10 20 IECD C[C@H](NC(=O)C(=O)N(CCCO)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 803301088 YSCVUIGAHAMUHY-IBGZPJMESA-N 425.529 2.112 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688145 VXHFDMWAWWCMCE-VQIMIIECSA-N 444.576 2.447 10 20 IECD CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807513335 LMRSDQKFLRCRCK-UHFFFAOYSA-N 446.312 2.003 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1 808032460 XJOFIXIWXRPGLO-PKOBYXMFSA-N 432.565 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)CC2)cc1 809542189 CHZPTXPXZVFRFH-PWRODBHTSA-N 427.545 2.198 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c(C)n1-c1ccccc1 913374640 LLBWOPZUGKICCA-UHFFFAOYSA-N 446.463 2.079 10 20 IECD O=C(C=c1[nH]c(=O)c(=Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)s1)c1ccco1 916131640 IXUYAMFNIYBATE-UHFFFAOYSA-N 425.466 2.420 10 20 IECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)CC1 917618756 GNOQPLRLSNKORI-INIZCTEOSA-N 447.532 2.412 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)cc2F)C[C@H](C)O1 917918349 OLBNQPGTESHHJX-KBPBESRZSA-N 449.504 2.363 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC)c2)cc1 918429910 QVESCOXDELKVMP-UHFFFAOYSA-N 432.546 2.004 10 20 IECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)C2CCN(S(N)(=O)=O)CC2)c1C 919064459 SHHISYVCWBGNFI-UHFFFAOYSA-N 433.530 2.044 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)OC)cc2)cc1 920482069 FVDGMVOEMISJJB-UHFFFAOYSA-N 442.515 2.191 10 20 IECD O=C(CN1CCCCC1=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429083 TXSZTYRXTGGLBI-UHFFFAOYSA-N 438.484 2.253 10 20 IECD Cn1ncnc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3O)cc2)CCC1 1792297771 IRADRILJKDRGRO-ONNFQVAWSA-N 449.467 2.393 10 20 IECD Cc1csc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1793513893 VARDTACKVYIGAX-VBUUTPMESA-N 444.509 2.090 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]1(F)Cl)C1=NN(c2ccccc2)C(=O)C1 1802486371 VWEGONVUTHSMGZ-UOYAZOMKSA-N 432.883 2.342 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1803124163 PGDNJNYVWSITQI-WSTLGDPDSA-N 448.527 2.184 10 20 IECD CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1816712800 VNVQGIHKSPARBW-LBPRGKRZSA-N 442.501 2.014 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1cc(O)nc(O)c1 1828336004 MHKYESNPDDOFTL-GFCCVEGCSA-N 434.543 2.318 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2CCC(F)(F)C2)C1 1841014580 OQIBBIAXPUPVAX-OAHLLOKOSA-N 430.455 2.418 10 20 IECD CC[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O)N(CC)CC 1847876505 CKSMGDCCZJCUAJ-AWWXYHOZSA-N 431.533 2.139 10 20 IECD Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2=O)cc1 554644485 ODASODJQSRQYFG-FQEVSTJZSA-N 432.524 2.329 10 20 IECD O=C(Nc1ccc(NC(=O)C2=S=CC=C2)cc1)C(=O)Nc1ccnn1-c1ccncc1 682188541 QBUDCEROIZHMRE-UHFFFAOYSA-N 432.465 2.061 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1O 737283982 JGDXCCJTUSFEII-HZPDHXFCSA-N 427.501 2.265 10 20 IECD COCCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 743859672 ZJYVYCIHLVRRHL-CMKODMSKSA-N 437.556 2.040 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 743896053 ZKFRCRLRIDNDGK-GOSISDBHSA-N 433.512 2.135 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743956796 VXVAFYWFESHKPX-UHFFFAOYSA-N 438.513 2.224 10 20 IECD COc1cccc(CNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1O 745787505 YCZMJKWLBJCMLF-UHFFFAOYSA-N 433.530 2.301 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC[C@@H]3COc4ccccc4O3)cs2)cc1 751931893 VLNQSSFECGVNFY-MRXNPFEDSA-N 439.493 2.429 10 20 IECD COC(=O)C1(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1 752020346 IWGFKSJHLSSNAQ-UHFFFAOYSA-N 432.565 2.240 10 20 IECD O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)N(Cc1ccco1)Cc1ccccc1O 752089501 XOLVTYKAYWSYQO-JOCHJYFZSA-N 441.528 2.227 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1F 753737664 HOPGXSXAUDDOKB-UHFFFAOYSA-N 449.548 2.468 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755703598 KLNSCKQIUNQCNT-IAGOWNOFSA-N 449.548 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC(F)F)c3)cc2F)C[C@@H](C)O1 762414534 NMKZUFQQTBHWOR-CHWSQXEVSA-N 439.438 2.156 10 20 IECD COc1cc(N2C[C@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc(OC)c1OC 763279641 NHPHYGALBQQQSL-UKRRQHHQSA-N 444.484 2.224 10 20 IECD CN1CCCc2cc(CNC(=O)N[C@H](Cc3ccccc3)C(=O)N3CCOCC3)ccc21 765883794 USRYMPIYSBKCKL-JOCHJYFZSA-N 436.556 2.338 10 20 IECD O=S1(=O)N=C(N2CCN(Cc3cc(Br)ccc3O)CC2)c2ccccc21 768803630 GPZVXWLQMZUFAD-UHFFFAOYSA-N 436.331 2.421 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 769733787 YVXJGJOMSFXXJQ-UHFFFAOYSA-N 441.531 2.476 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]3C)nc12 772328927 YYODKKFMKDCSGC-UONOGXRCSA-N 433.509 2.441 10 20 IECD CC(C)[C@@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCCS1(=O)=O 772693625 FSYLFXAXHMIYKO-SFHVURJKSA-N 445.532 2.433 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773848406 WQKISVAYRYRIAC-CYBMUJFWSA-N 448.520 2.148 10 20 IECD CCOC(=O)N1CCC([C@@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778232925 JUTINPFRLAEXON-GOSISDBHSA-N 432.565 2.190 10 20 IECD CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NCc1ccc(N2CCOCC2)cc1 778642348 DKKACFOJHYYYEJ-UHFFFAOYSA-N 447.482 2.398 10 20 IECD COc1ccc([C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)N2CCOCC2)cc1OC 779494046 QFTDRWHSDRYVLQ-SBLNNXNXSA-N 428.485 2.318 10 20 IECD Cc1noc(COc2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2)n1 785302619 DRRPMEGJAUXTKK-LBPRGKRZSA-N 426.429 2.054 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(C(F)(F)F)n3)cc2)C1 786291250 YMBNLOIMQKDPOP-AWEZNQCLSA-N 449.433 2.057 10 20 IECD Cc1nc(Cn2nnc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)no1 787451656 XODIJWPRCBKMGF-INIZCTEOSA-N 445.911 2.080 10 20 IECD CCC1(CC)[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H]1OC 789847522 SNZKIZCWROBQDN-VQTJNVASSA-N 435.540 2.113 10 20 IECD C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789855651 VFWLPLQNBGTMCM-GUDVDZBRSA-N 432.634 2.339 10 20 IECD C[C@@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793719022 KVGMHKFPBIRAMG-NVXWUHKLSA-N 440.569 2.212 10 20 IECD COc1ccc(CCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 793763192 UADCKCRMXRMBNE-SFHVURJKSA-N 425.529 2.458 10 20 IECD Cc1nn(C)c(Br)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 800854318 ZIATYJMOYUURGS-AWEZNQCLSA-N 434.338 2.123 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1)c1ccc(N2CCOCC2)cc1 803296827 IAAXUSWXGFZVHJ-SFHVURJKSA-N 433.512 2.203 10 20 IECD COc1nc(C)cc(C)c1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803303226 ZZNWRAMEVKGQBF-QGZVFWFLSA-N 426.517 2.037 10 20 IECD CC(C)[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803448844 FIFJHONPULFGQN-SFHVURJKSA-N 425.476 2.256 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3c(F)cncc3F)CC2)cc1 804824294 LNLTWNHLPFKRKM-KIUWMYQTSA-N 430.455 2.451 10 20 IECD C[C@H](O)CN1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H](C)C1 806877609 AZMYZSBMUNUZHZ-ULQDDVLXSA-N 426.508 2.353 10 20 IECD CCSCC[C@@H](C)NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 807046735 GTCOMUGDNIQZLP-OAHLLOKOSA-N 439.578 2.009 10 20 IECD CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2F)ccn1 810359019 UWHCRJRBFPIQEX-UHFFFAOYSA-N 438.415 2.333 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)c(C)n1-c1ccccc1 915749488 WVLHJPYDAVNTPU-UHFFFAOYSA-N 429.484 2.367 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Cc3nnn(-c4ccccc4)c3C)CC2)cc1 919963700 VPOOAWNXULCDFV-UHFFFAOYSA-N 448.571 2.455 10 20 IECD Cn1nc2ccccc2c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1338267168 GMJZUDWFAJUNOE-UHFFFAOYSA-N 426.448 2.022 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1 1781680595 NIQQVIGPPPGADT-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cccs1 1785908520 NZVRLLRGOKFNNY-XQVRWPTMSA-N 444.509 2.172 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@@H]3CCOC3)CCC2)cc1 1792315809 DFQUTMSJNIKELT-CYBMUJFWSA-N 433.555 2.017 10 20 IECD Cc1ccc(OC(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)nc1 1796604483 LIOAKFJUTNRWPM-BJWYYQGGSA-N 440.500 2.306 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncnn2c1)c1cc(O)c(O)c(Cl)c1 1798234805 PGJKPIGHGNETSM-QDMKHBRRSA-N 441.875 2.360 10 20 IECD CCc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807991006 MIGQMCKAIZUXRM-OPAMFIHVSA-N 447.495 2.479 10 20 IECD CC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1812574423 QZNJTMNRAGUTJF-QGQQYVBWSA-N 445.497 2.255 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n[nH]1 1817844835 MQQLWXJDONASHB-HNNXBMFYSA-N 425.449 2.121 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848585 QZWYARPTPGBSTD-XJKSGUPXSA-N 439.476 2.055 10 20 IECD CC(=O)Nc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)o1 1845501604 GRLPPIMVWIQHAL-UHFFFAOYSA-N 433.848 2.433 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3cc(S(C)(=O)=O)ccc3C)CC2)cc1 110467325 HOXYMIVNAMLRDG-UHFFFAOYSA-N 438.571 2.354 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCN(C(=O)c4cccn4C)CC3)CC2)cc1 726715688 XCXLERCKSYIRCP-UHFFFAOYSA-N 425.533 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nncn3CCc3ccccn3)CC2)cc1 727745147 MNMVJOVWMMODBU-UHFFFAOYSA-N 438.557 2.365 10 20 IECD CN(C)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 730077684 DYRRZLAMOFTVMT-INIZCTEOSA-N 448.501 2.267 10 20 IECD CCCCN(C(=O)CN(C)Cc1ccccc1O)c1c(O)nc(=O)n(CC(C)C)c1N 731842771 ABHKLTCPVMLLEQ-UHFFFAOYSA-N 431.537 2.158 10 20 IECD Cc1cc(C(=O)NCC(=O)NCCN2CCOCC2)c(C)n1-c1cccc(C(C)C)c1 732156321 LNQMUKFSLRIVKS-UHFFFAOYSA-N 426.561 2.396 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)ccc21 737167560 WDNDWKRLPZIHFG-UHFFFAOYSA-N 440.456 2.393 10 20 IECD COc1cc(F)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 738930504 FKHXLOXTJGKSMK-UHFFFAOYSA-N 437.493 2.399 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(Cc4ccncc4)n3)cc2)C1 743165803 RFUODBFKJIISMI-LJQANCHMSA-N 433.516 2.350 10 20 IECD CC(C)N(C)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 747596297 LPRIYYLZCBTWEN-UHFFFAOYSA-N 441.531 2.256 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cn4cccc(C)c4n3)CC2)cc1 752191711 PXVZHSJLEGLIMI-SSEXGKCCSA-N 426.542 2.249 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(-c4cccnc4)n3C)CC2)cc1 758198430 VYRFNBZQDUVZON-LJQANCHMSA-N 440.573 2.161 10 20 IECD CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 758935175 IETTUQGHNRUBDY-UHFFFAOYSA-N 430.461 2.307 10 20 IECD C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 760209817 AGSDEFXZIQNGLT-AWEZNQCLSA-N 429.496 2.209 10 20 IECD Cc1cc(C(=O)CN2CCS[C@@H]3COCC[C@H]32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767910008 DHCXTEBSCINKOD-TZIWHRDSSA-N 449.598 2.131 10 20 IECD COC(=O)c1csc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 776492261 UTCZOBLWKWDRCA-UHFFFAOYSA-N 449.504 2.198 10 20 IECD Cc1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 777197364 LLZZJXUKAANLHH-OKILXGFUSA-N 430.480 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nnc(C(C)(C)C)s3)CC2)cc1 778325293 RYMTWMJXLWNFNL-MDZDMXLPSA-N 443.573 2.365 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CCO)c3cccs3)CC2)cc1 778370694 GZHBOLCQXNRGCA-OLHLWXQYSA-N 429.542 2.201 10 20 IECD CCN1CCN(S(=O)(=O)c2cccc(NC(=O)/C=C\c3ccc(O)c(O)c3)c2)CC1 779475780 RIFPONPUQQPMCC-CLFYSBASSA-N 431.514 2.076 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(CCO)C(C)(C)C2)c([N+](=O)[O-])c1Br 780630075 CRLNHKMQFNRGKH-UHFFFAOYSA-N 433.259 2.167 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(CN4CCN(C)CC4)cc3)c2)CC1 781277935 ITOSJXRSRRYLAB-UHFFFAOYSA-N 435.572 2.355 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(I)cc1 785297124 LTBKVFNFGNEWNR-JTQLQIEISA-N 440.237 2.388 10 20 IECD COc1ccc(OC)c([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 785498534 KFTCLUFYTPJNNH-QGZVFWFLSA-N 441.528 2.376 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)C[C@@H](C)[C@H]3C)CC2)cc1 785530857 QATATPHRFIAQIF-VAMGGRTRSA-N 430.593 2.217 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc4nnnn4c3)c2C)cc1 786051727 KTRRSRSTTOKJCQ-UHFFFAOYSA-N 433.424 2.358 10 20 IECD CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 787079903 HHIGLMFTGCZWRJ-KRWDZBQOSA-N 438.528 2.317 10 20 IECD O=C(NCCCNc1ccccn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 788664812 LATCXKBQFLOQTE-UHFFFAOYSA-N 447.486 2.386 10 20 IECD C[C@H](c1nccs1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788935791 FPWPVTRQBUPVAL-QGZVFWFLSA-N 427.574 2.265 10 20 IECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1Cc1ccccc1 792939896 IMGSSNOKIAVXDB-QFIPXVFZSA-N 440.563 2.137 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(c4ccc(Cl)cc4)C3=O)ccc21 803687334 BZGMCRSNTVRNEP-IBGZPJMESA-N 440.931 2.260 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C2CC2)cc1 804004554 NBGMLQLDXLUAFQ-QFIPXVFZSA-N 434.540 2.161 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807100119 KFARAKVLUCRZJR-GOSISDBHSA-N 431.558 2.046 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](C)CC1(C)OCCO1 807425079 KUJVYCMYIXCABH-CYBMUJFWSA-N 443.338 2.409 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 808346714 LOBSSDCGMOFBIV-IFMALSPDSA-N 431.577 2.405 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C 810207505 KNRJVFHUWRCPLT-GOSISDBHSA-N 431.558 2.296 10 20 IECD CN(C[C@@H]1COc2ccccc2O1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117865 RLVWLORFUVURPA-AZUAARDMSA-N 438.528 2.370 10 20 IECD CCOc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918287612 QUNCSJMGUDAPTE-GJZGRUSLSA-N 430.480 2.488 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H](O)c1ccco1 919784261 NIBVTJPFWRKFGH-LJQANCHMSA-N 440.479 2.068 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1Cl 920926446 OGHRYHSEHNJRQF-CQSZACIVSA-N 444.919 2.352 10 20 IECD O=C(COc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715925 XSQCMICMQYVOQN-QDMKHBRRSA-N 431.876 2.477 10 20 IECD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(C)c1 1803963755 YXNAAMFERLDAHB-BJWYYQGGSA-N 439.468 2.153 10 20 IECD C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340175 JZPHHWCJUSQBAU-OWLYRPNTSA-N 445.610 2.364 10 20 IECD O=C(CCc1ccccn1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804708235 UTHXITIDCPSRNF-SBUREZEXSA-N 447.495 2.235 10 20 IECD CCN(CC)C(=O)CN1CCCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 110423137 HQHJEAIIAWPPJE-UHFFFAOYSA-N 445.608 2.250 10 20 IECD COCCNC(=O)c1ccc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)nc1 480840976 ADRWNZDCYDNOOO-UHFFFAOYSA-N 434.496 2.281 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN([C@H](C)c4cccc(OC)c4)CC3)nc12 728932839 RHYRBRXLTZSFJI-MRXNPFEDSA-N 439.516 2.499 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)N2CCCc3ccccc32)cc1)C1=S=CC=C1 729896857 HLLIAVWEOPBITA-UHFFFAOYSA-N 441.534 2.330 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 734491239 AIVZPANYWBWNEJ-UHFFFAOYSA-N 433.505 2.050 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 742528607 OUKKWBVGGLVEHA-WKDRNLAYSA-N 437.496 2.037 10 20 IECD CCOC(=O)Cc1csc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n1 742928554 VPZVEZCCUNESSN-UHFFFAOYSA-N 447.561 2.201 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-c2ccccn2)nc1O 746834101 FZWQRFXGZVUTOV-UHFFFAOYSA-N 438.509 2.014 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccc4c(c3)OCO4)CC2)cc1 749470934 UHVBNQVHZNCWNZ-HXUWFJFHSA-N 437.496 2.377 10 20 IECD C[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)[C@@H]1C 752318191 IGHPWDGSVWFAGU-AHFBHCKLSA-N 447.582 2.463 10 20 IECD O=C(COC(=O)C1=Cc2cc(F)ccc2OC1)NCc1ccc(N2CCOCC2)c(F)c1 761632972 KBITVDNSOLSGMY-UHFFFAOYSA-N 444.434 2.437 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 762442523 RKUIEGPQYMCWRZ-CQSZACIVSA-N 429.448 2.265 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2cccc(Br)c2O)cc1 765752035 DRPTWVLAGDWTIZ-UHFFFAOYSA-N 427.320 2.312 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)N1CCC2(CC1)OCCO2 766823982 GQRUWVLCLCBZIT-UHFFFAOYSA-N 435.340 2.060 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)CNC(=O)CNC(=O)OC(C)(C)C 767068567 CROHATZZCDRMEW-UHFFFAOYSA-N 444.326 2.144 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)c1 769643995 YXWJNMGQWNPUEK-UHFFFAOYSA-N 432.502 2.105 10 20 IECD COC[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769949892 XRBJGOPGUGLZNT-HNNXBMFYSA-N 435.458 2.352 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1Cl 771212970 NFVXFUNBVZNXGP-UHFFFAOYSA-N 437.855 2.352 10 20 IECD O=C(N[C@H]1CCO[C@]2(CCOC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771416145 LFLJSFBMCBNZDO-IFXJQAMLSA-N 438.527 2.322 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccnc1Br 774124994 SYAHQNYEVKHUHJ-UHFFFAOYSA-N 433.306 2.278 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 778248515 UVLWASADWMDJSJ-RAKWIPDMSA-N 428.577 2.137 10 20 IECD C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 778550274 CBBJJTXJTOLUSJ-AWEZNQCLSA-N 429.496 2.209 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(OC)c(Br)n3)CC2)cc1 781954917 ZDNAHKHCZZCQHQ-UHFFFAOYSA-N 449.349 2.413 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 784467733 WICQFWGFOXQTLP-OALUTQOASA-N 428.533 2.428 10 20 IECD CCN(C[C@H]1COc2ccccc2O1)C(=O)CN(C)c1ccc(OCC(=O)OC)cc1 784563284 DPGSOMVEELTDJZ-IBGZPJMESA-N 428.485 2.363 10 20 IECD O=C(Nc1cnc(C2CC2)nc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766363 HICAIFRXUFHPPR-INIZCTEOSA-N 429.908 2.432 10 20 IECD O=C(NCCCn1cnc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785413391 YDRQQANCYDDPQS-LJQANCHMSA-N 436.512 2.456 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@@H](C)CC3)CC2)cc1 785529019 UJZOMRURKUYAGR-WOJBJXKFSA-N 430.593 2.409 10 20 IECD CC(C)(C)c1nc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 789800879 WFPGCMZOHZQFCF-UHFFFAOYSA-N 448.564 2.391 10 20 IECD CN(Cc1ccc(F)c(F)c1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844290 FIUOJRYVICLQDA-UHFFFAOYSA-N 435.446 2.340 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Cl)cc(C(=O)OC)c1OC 790069124 UKBZOGMSPMUDBM-UHFFFAOYSA-N 429.834 2.428 10 20 IECD COc1ccc(CNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c(O)c1 792869883 CWEUNIUOFNHFNV-UHFFFAOYSA-N 433.530 2.301 10 20 IECD COCCOC1CCC(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 796198346 XWTOTAQJZJVVOX-UHFFFAOYSA-N 434.533 2.109 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nn(C)c3Br)cc2)CC1 800952803 LGQOKRJTKZNDLA-UHFFFAOYSA-N 434.338 2.090 10 20 IECD CC(C)Cn1c([C@@H]2CCS(=O)(=O)C2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802665432 UGORAAFOWVEUQL-LJQANCHMSA-N 447.605 2.309 10 20 IECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803305710 OGOSSJALSUEQLD-PKOBYXMFSA-N 445.560 2.138 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1F 803662317 ISEYYEGSQFWIRZ-UHFFFAOYSA-N 446.910 2.146 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@@H](C)c3ccc(F)cc3)CC2)cc1 803753207 WXWNRAQHCKWEHP-SFHVURJKSA-N 442.535 2.292 10 20 IECD CC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 806855600 SEFUQWIEGYOUFL-UHFFFAOYSA-N 427.476 2.492 10 20 IECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cc(OC)c(OC)cc1O 809679714 JWYIMLJBKIRIIF-UHFFFAOYSA-N 438.502 2.051 10 20 IECD COCCN1C(=O)/C(=C\Nc2ccnn2Cc2ccc(C(C)C)cc2)C(=O)NC1=S 814316994 XZXUPMUJJJXLCV-ATVHPVEESA-N 427.530 2.240 10 20 IECD CCN1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 913674738 DWWJEZAANZXYAQ-UHFFFAOYSA-N 448.501 2.315 10 20 IECD CCCC(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 917055564 OWBCMTYSPANLAP-HDICACEKSA-N 448.583 2.436 10 20 IECD C[C@@H](Cn1ccnc1)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 919966004 SHSFPNXFAGHAOH-ZDUSSCGKSA-N 445.457 2.116 10 20 IECD Cc1ccc(NC(=O)NC(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(C)c1 920637369 GVJJAEDMSKLGTM-CYBMUJFWSA-N 449.485 2.274 10 20 IECD COC(=O)c1cc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)oc1C 1317920396 ITDDTEMWWOOQLR-INIZCTEOSA-N 428.489 2.076 10 20 IECD O=C(CCc1ccccn1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005217 ZSSAZDCNSZCEOV-JOCHJYFZSA-N 445.903 2.223 10 20 IECD CC(C)n1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782007659 VWTJLOMAHXCFJX-NRFANRHFSA-N 448.907 2.286 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)C(F)(F)Cl)C2)C1 1784178909 XBJZAEDPEBBFQY-OAHLLOKOSA-N 425.215 2.026 10 20 IECD CC/C=C(\C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1791871116 CUNFLZMERDBEGJ-YYBHFMGBSA-N 438.528 2.115 10 20 IECD CCC[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)CC1 1796141313 WHRWMUXHAPXHOR-NDJUXDTMSA-N 431.533 2.303 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1)C2)c1cc(O)c(O)c(Cl)c1 1799768938 HFQLJRBGMZFPMT-ZSBFGKGUSA-N 434.851 2.407 10 20 IECD CC1(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CCC1 1802427630 XLBSTKFGHWKZFK-MAUKXSAKSA-N 446.598 2.138 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1CCC(O)CC1 1804291047 BWMUDYCUWYSUTC-SGYUAVSYSA-N 430.501 2.006 10 20 IECD Cc1scc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1C 1804332178 PZRIELCGAVGPHD-BTTYYORXSA-N 437.612 2.477 10 20 IECD Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807994147 QHVFYCMVLXCDQV-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCSC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001761 QMDSDGNZHXQDOS-FTRWYGJKSA-N 442.541 2.351 10 20 IECD O=C(c1cnnc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427063 OHFGYEHVKGAEPO-MRXNPFEDSA-N 445.907 2.483 10 20 IECD CC(C)(C)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1834786470 VMUNPBNYODNCJH-OAQYLSRUSA-N 440.924 2.257 10 20 IECD Cc1noc(C)c1CCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842074971 MMNSQRFLUUHKKL-UHFFFAOYSA-N 449.511 2.220 10 20 IECD O=C(c1cc2ccoc2s1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056814 NFCZRFPWYUNMGE-UHFFFAOYSA-N 435.552 2.172 10 20 IECD CN(C[C@H](O)COCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 732889778 UUWHXEZTLWFKIW-FQEVSTJZSA-N 431.508 2.381 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3c(F)cccc3F)cc2)C1 734659903 IQQVLLFEYYUWFI-HNAYVOBHSA-N 432.471 2.199 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 734701800 IEGHMWBGZUXNKP-UHFFFAOYSA-N 438.528 2.317 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c1O 737286287 UMRJLECHJCPZSG-UHFFFAOYSA-N 434.514 2.369 10 20 IECD CCS(=O)(=O)c1ccccc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742927514 SQMQQSWOHXHFEQ-UHFFFAOYSA-N 431.558 2.041 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 743359769 WQUOLOOJJCJHHD-BGYRXZFFSA-N 447.624 2.004 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccccc3[N+](=O)[O-])CC2)cc1 743566652 JBKTUIGJEIAQKY-UHFFFAOYSA-N 427.505 2.267 10 20 IECD COC(=O)c1ccc(OCCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(Cl)c1 744854541 JSXSOIZECYDIES-UHFFFAOYSA-N 443.861 2.440 10 20 IECD C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)C1 748485292 GWFRKTNFOPQEMC-HNNXBMFYSA-N 431.514 2.068 10 20 IECD CN(Cc1ccccc1)[C@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 750053672 JCSQIWUAGCYOIK-QFIPXVFZSA-N 440.563 2.485 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccccc3CS(C)(=O)=O)CC2)cc1F 753911273 HNHQGVCIAUSXPQ-UHFFFAOYSA-N 435.521 2.411 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1 754194434 ZGYZPXIOEDMSKM-CQSZACIVSA-N 441.484 2.126 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCNC(=O)c1ccc(C)cc1O 755887752 DODUAWJFVIUWSJ-UHFFFAOYSA-N 434.876 2.381 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cncc4ccccc34)cc2)C1 758979066 JSNDMXQIADSISB-SFHVURJKSA-N 431.496 2.191 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(C)nc3C)CC2)cc(OC)c1OC 759409584 LXMKTPOPZQKUFK-UHFFFAOYSA-N 428.489 2.012 10 20 IECD CNS(=O)(=O)c1cccc([C@H](C)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761230739 WPYVVRIKPCFNON-LBPRGKRZSA-N 437.905 2.479 10 20 IECD O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(OCCN2CCOCC2)c(Cl)c1 768491161 CKXJMXLYRMPMPS-JXAWBTAJSA-N 437.949 2.354 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1ccc(F)cc1F 769617287 RIOKJIJIRUONMD-UHFFFAOYSA-N 426.803 2.255 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H](c4nccn4C)C3)CC2)cc1 769770296 IQULZJCBIHJQTL-VJIACCKLSA-N 437.544 2.040 10 20 IECD CCOC(=O)N1CC[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 771573475 HVMMSXGZRJMUNN-ZDUSSCGKSA-N 439.515 2.215 10 20 IECD CCOC(=O)C[C@](C)(NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 776003669 XYGDZBGZFYJTGC-IPYQYMIDSA-N 445.560 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3-n3ccnc3)CC2)cc1 778418525 GBFDIOCSIRMHSN-ZHACJKMWSA-N 445.523 2.402 10 20 IECD Cc1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)no1 780822038 WLIQMHOMXYDDPK-LPMFXHHGSA-N 433.484 2.414 10 20 IECD Cn1cc(-c2nc([C@H]3COCCN3C(=O)NCCCSc3nccs3)no2)cn1 780844361 VZGZPLKHUHTXMB-CYBMUJFWSA-N 435.535 2.192 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 787964727 XQDNLARHCWVQQG-FQEVSTJZSA-N 438.528 2.202 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 788399921 FVONDSQDWVFMHK-ROUUACIJSA-N 441.528 2.293 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1 788964375 NJDPMRUVHZWPKF-FCHUYYIVSA-N 430.593 2.033 10 20 IECD Cc1nc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 789383539 YQZAJISURXBNES-OAHLLOKOSA-N 429.908 2.000 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789824108 GMCGOPPLBLBVSX-QKSJRXBFSA-N 433.524 2.129 10 20 IECD CN1CCN(c2ccc(CN3CCc4c(cccc4S(=O)(=O)N(C)C)C3)cc2)CC1 793605139 DUTKMARCLIAJOC-UHFFFAOYSA-N 428.602 2.247 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)c(O)c1 797390846 VPBYCTAWYIVCQN-UHFFFAOYSA-N 437.246 2.189 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@H](CO)[C@@H]1CCOC1 797762243 JVKMVSCNVNFGOM-LFVFQHRSSA-N 440.612 2.491 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304997 HCNRWOBDQFCKPE-IEBWSBKVSA-N 429.517 2.057 10 20 IECD CCN1CCCC[C@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450603 LLENSDSWWQQHGO-SFHVURJKSA-N 438.519 2.364 10 20 IECD O=C(Nc1nncn1C1CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 803517850 ZITGIGKINIZWDO-UHFFFAOYSA-N 444.429 2.280 10 20 IECD CC1(C)C[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806806467 NGVPFHZIBWVQPK-HUUCEWRRSA-N 425.476 2.447 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]1C 807771177 SFZRVEFMTFFXKT-LVQVYYBASA-N 425.476 2.397 10 20 IECD O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1cccc(Br)c1O 811460044 VXMBLMRZFRRPJG-UHFFFAOYSA-N 435.246 2.028 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(S(=O)(=O)c3c(C)noc3C)CC2)cc1 918229792 RLDJPYIZEBCWOQ-UHFFFAOYSA-N 449.577 2.354 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)Cn2ccnc2)cc1 1794869453 USZCWWPTTXZBNU-RUMRUAAYSA-N 447.539 2.194 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n[nH]1 1796413142 OQDWWYHZAXLYKG-VBUUOAMHSA-N 434.500 2.017 10 20 IECD O=C(c1ccc2ncoc2c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441578 ITGWTDFRNXDQOI-UHFFFAOYSA-N 443.463 2.438 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 12069012 YLPMLMHXXNRTPM-UHFFFAOYSA-N 434.518 2.094 10 20 IECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 109190421 HBFBDNQHSZLGOZ-IRXDYDNUSA-N 447.557 2.076 10 20 IECD CCn1cc(CN2CCCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)cn1 573636700 RMKAOMTTWIIVRS-UHFFFAOYSA-N 436.560 2.054 10 20 IECD COc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1OCC(=O)NC1CC1 614831041 BWWSMRWXGBEJTQ-UHFFFAOYSA-N 434.499 2.158 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ccn(-c4ccccc4)n3)CC2)cc1 729877528 VEFKUXYZDACZLE-WJOKGBTCSA-N 438.553 2.478 10 20 IECD CN(C)C(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903272 FJSMZEUVVNVTND-HNNXBMFYSA-N 425.480 2.266 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C(C)(C)CO)CC1 747839996 GOXWWHBHCBJBCZ-MRXNPFEDSA-N 435.524 2.178 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(O)nc2ccccc12 749352668 LFQWYUUKVHMXKF-UHFFFAOYSA-N 425.510 2.414 10 20 IECD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 751235959 OSOSKQSADDELRF-UHFFFAOYSA-N 438.449 2.054 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 752902455 DQCSCXRURIINGN-UHFFFAOYSA-N 443.483 2.226 10 20 IECD Cc1cc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ncn1 757012216 WNVMZSKYCILSEK-UHFFFAOYSA-N 436.495 2.040 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc(OC)c1OC 759221202 MOTFLUGLGAUSSL-UHFFFAOYSA-N 427.501 2.377 10 20 IECD O=C(COC(=O)c1ccc2nnc(O)n2c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 763106300 HKICSAUNEDBXNK-UHFFFAOYSA-N 442.387 2.006 10 20 IECD COc1ccc(S(=O)(=O)N2CCCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 765321595 JSMPNRRLPLTWMO-UHFFFAOYSA-N 446.573 2.367 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c1 769702204 UMEUOJIYTZVNJB-UHFFFAOYSA-N 440.481 2.341 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCN1CCc2ccccc21 787687065 IPZLSTTZFNKWBL-UHFFFAOYSA-N 436.556 2.051 10 20 IECD CC(C)(C)c1csc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788311193 RNPSTMZOBHQWBQ-UHFFFAOYSA-N 430.574 2.252 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1Cn1cnc2ccccc21 788321288 UOYBRPLHWPDORJ-OAQYLSRUSA-N 447.539 2.180 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCSC(F)(F)F)cc2F)C[C@@H](C)O1 788539096 LAUJOJPAXIBYRQ-VXGBXAGGSA-N 437.459 2.425 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCCc2c1cnn2C 789589193 CLLFIKSTXWVGKV-OAHLLOKOSA-N 435.322 2.431 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](C)OC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 790360257 MHSAQZMZKZSJHE-CEXWTWQISA-N 449.567 2.325 10 20 IECD COc1ccc(CNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)c(O)c1 792818319 DZFKTBBIMRWMGT-UHFFFAOYSA-N 442.516 2.061 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1 797745188 XPMFRYUSJHQPQF-ASSNKEHSSA-N 434.514 2.033 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803146770 UNEPZAWCHVGHGT-QGZVFWFLSA-N 426.517 2.201 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(-n4ccnc4)cc3)CC2)cc1 803346011 LIQKWERGEVSQOF-UHFFFAOYSA-N 433.512 2.236 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@@H]3COC(=O)N(C)C)CC2)cc1 806620513 YKZJNLOIGARZBR-HXUWFJFHSA-N 447.580 2.080 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1(CN2CCOCC2)CCCCC1 807097761 RGDNGEYGXSPWBZ-UHFFFAOYSA-N 430.593 2.076 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1)c1ccc(N(C)C)cc1 807378855 NEEKGEINUCFAEQ-INIZCTEOSA-N 428.508 2.222 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3ccc(-n4ccnn4)cc3)CC2)cc1 809613266 PUQAGBNTMVZEOO-SFHVURJKSA-N 448.527 2.192 10 20 IECD Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NCc1cc(Cl)cc(Cl)c1O 813684435 QSXVPWYJBHLXEF-UHFFFAOYSA-N 447.286 2.193 10 20 IECD O=C(CN1Cc2cnn(-c3ccccc3)c2C1)NCc1ccc(N2CCOCC2)c(F)c1 815309271 CXUWKKUVLIUDJS-UHFFFAOYSA-N 435.503 2.480 10 20 IECD C[C@H](OC(=O)Cn1ccccc1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 916537342 KQYAAEJKMZBGSM-AWEZNQCLSA-N 430.416 2.194 10 20 IECD COCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917386603 GEFOLPSZMKTKMI-UHFFFAOYSA-N 449.598 2.095 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCOc3ccccc3[N+](=O)[O-])cc2)C1 917836593 QELHMWGRZFCEPT-KRWDZBQOSA-N 426.473 2.382 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 920865606 GYBXOYGAAPXDOU-HNNXBMFYSA-N 437.587 2.303 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(N2CCOC2=O)ccc1F 1321362136 YHGYWWIKSJEDQD-INIZCTEOSA-N 432.404 2.098 10 20 IECD COCCN(CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(OC)c(OC)c1 1324300143 WNHYHPKMFQVBGW-UHFFFAOYSA-N 437.537 2.236 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 1338534407 BZQFTSOJUBLHJA-KXNSMUHISA-N 448.516 2.335 10 20 IECD CCOC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1800745051 DTKIHHZNRXRPEQ-BCDXTJNWSA-N 439.468 2.235 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1O)C1=NN(c2ccccc2)C(=O)C1 1801717804 AZZHFSFGXIREQE-FNLKRUPLSA-N 446.507 2.366 10 20 IECD CCn1nc(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285855 IIWRQFSIBYNKMS-FJXIAYRNSA-N 440.500 2.293 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(F)cn1 1805985136 YGJHHRUXYWMSQK-VLIAUNLRSA-N 437.431 2.055 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)C1 1810543004 HZGVXOXXBOLYTD-UHFFFAOYSA-N 443.479 2.391 10 20 IECD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)on1 1827423943 LAGCJHLORSJNST-GOSISDBHSA-N 428.489 2.265 10 20 IECD C[C@@H](Cc1ccccn1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846525525 RSZJWCMUHQSITR-DYLHUKMJSA-N 437.496 2.294 10 20 IECD C[C@@H](NC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1ccc(N2CCOCC2)cc1 109180480 IMPXLJZNFCUNNL-QGZVFWFLSA-N 435.532 2.055 10 20 IECD COC(=O)Cn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)cnc21 731565976 NNDMHJQDJLIXHE-UHFFFAOYSA-N 437.431 2.196 10 20 IECD COCCCn1c(S)nc2cc(C(=O)NCc3cc(OC)ccc3O)ccc2c1=O 734019133 YNDPLTMKUDPWSN-UHFFFAOYSA-N 429.498 2.366 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(NC(=O)c3cc(O)cs3)CC2)cc1OC 735522748 XLNSDTLDLYGUGR-UHFFFAOYSA-N 426.516 2.054 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(N4CCOC4=O)ccc3F)nc12 745130175 DDDKKFSLILCHSM-UHFFFAOYSA-N 444.375 2.064 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 754140346 MXHMCZWRDWQYEX-PGRDOPGGSA-N 438.572 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1 755703601 KLNSCKQIUNQCNT-IRXDYDNUSA-N 449.548 2.436 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CC(=O)N(Cc4ccco4)C3)CC2)cc(OC)c1OC 759223943 XBJLMZPKYQIZSY-INIZCTEOSA-N 443.500 2.003 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccnc3OCC(F)F)CC2)cc1 765859330 OJQHHMKMPVFKMX-UHFFFAOYSA-N 434.443 2.458 10 20 IECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C(=O)N(C)C4=O)c2)CC1 768014930 CHKMSQRUZJCHMP-UHFFFAOYSA-N 442.541 2.244 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cnc2c(c1)c(O)nc(=O)n2C 769291325 MOVGONBSCLVJKM-UHFFFAOYSA-N 433.262 2.165 10 20 IECD Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc(O)n1 777137821 SPVFIBQQZSACHB-UHFFFAOYSA-N 443.481 2.190 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](CN(C)CC4CC4)C3)CC2)cc1 778299639 LOZQIBMVKAEJJR-GLCJEOIMSA-N 440.588 2.090 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3([C@H](C)CCO)CCC3)CC2)cc1 778419538 LTFYCDZIUJOQPJ-OLHLWXQYSA-N 429.561 2.205 10 20 IECD O=C1CN(c2ccnc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)CCN1 787081265 QXNLNQMHRNWPES-OAHLLOKOSA-N 445.470 2.018 10 20 IECD C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789802353 XDTYXWOCWHIJMK-MDRHQERFSA-N 447.551 2.067 10 20 IECD CCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826214 OZUBZIYBWDBCGK-CALCHBBNSA-N 428.508 2.499 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3C(F)(F)F)CC2)cn1C 792838879 QXYMUPYTSLHXHE-UHFFFAOYSA-N 445.511 2.320 10 20 IECD Cc1ccccc1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793671702 HINZTWQIHUYROR-RXVVDRJESA-N 436.556 2.060 10 20 IECD COCc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 795804367 YJSRCNXWLBSSLS-GOSISDBHSA-N 447.557 2.022 10 20 IECD O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803623815 MLVOYMGSUAIMFK-LJQANCHMSA-N 440.496 2.378 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(C(F)F)cc3)cc2)CC1 804985066 ULULDMCHPKJOFE-UHFFFAOYSA-N 430.498 2.338 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC3(OC)CCC(C)CC3)cc2F)CC1 805008412 JSGZVNPVAWRTMA-UHFFFAOYSA-N 448.583 2.295 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1 806426439 FTEHHYXDNXZZOA-NRFANRHFSA-N 436.556 2.267 10 20 IECD O=C(CN1CCN(C[C@@H]2CCCO2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 916150084 SVYAVGFUWYODDT-SFHVURJKSA-N 433.508 2.197 10 20 IECD O=C(NCc1ccc(N2CCOCC2)nc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 917998274 HJZLPTJGNRRZHI-UHFFFAOYSA-N 443.523 2.018 10 20 IECD COCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442608 LFWOIXJWEZDPNQ-UHFFFAOYSA-N 441.528 2.175 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cccnc34)cc2)C1 918464412 VHUNABAGRALNBD-GOSISDBHSA-N 431.496 2.191 10 20 IECD C[C@]1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CC1(F)F 1782007080 BAEOHUWDQFGNLP-QZTJIDSGSA-N 430.835 2.240 10 20 IECD Cn1nccc1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787411832 UDBGYBGEXNRDRV-UHFFFAOYSA-N 443.554 2.028 10 20 IECD CNC(=O)CC(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788671524 VDGZGXWTZGQACP-UHFFFAOYSA-N 447.495 2.050 10 20 IECD C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)NC(=O)OC(C)(C)C 1796831818 KEPOJTCQKGYPOE-DMRZNYOFSA-N 448.520 2.048 10 20 IECD Cc1nscc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805185367 NCJORRLFAGPRKY-AUUYWEPGSA-N 439.497 2.286 10 20 IECD Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995180 DSWBAHVUFDUOME-IIBYNOLFSA-N 433.468 2.225 10 20 IECD CN1CC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)C1 1821295228 IUTCIDZVLJKBGC-HNNXBMFYSA-N 433.896 2.342 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(O)cc1 1822233719 NVNAJQWIWKYEMV-LBPRGKRZSA-N 426.454 2.195 10 20 IECD Cn1cc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827426408 UFUSGRMOCIRNPF-LJQANCHMSA-N 441.532 2.092 10 20 IECD CC[C@@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)N(CC)CC 1841677037 KTSFDFZARSZFHM-KAMXEHQASA-N 431.533 2.140 10 20 IECD COc1ccnc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1OC 1844842176 QSUNZPCDLZBRBZ-UHFFFAOYSA-N 447.875 2.294 10 20 IECD COc1ccc(F)cc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037902 YWMYFMSKHKOUNL-XBXARRHUSA-N 442.443 2.482 10 20 IECD CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S)c1ccccc1 1847615442 GTBZMTBLCSQUNF-ABSDTBQOSA-N 445.610 2.488 10 20 IECD Cc1c(CNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)n(C)c2ccccc12 473268329 HQCVHZIBFZGXAD-LJQANCHMSA-N 432.480 2.033 10 20 IECD Cn1ccc2c(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cccc21 727037788 JPCLEGQCUHFJNI-KRWDZBQOSA-N 433.512 2.135 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1 727361151 BLILMRAKIXXNHF-UHFFFAOYSA-N 434.543 2.202 10 20 IECD C[C@H](NC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1)c1ccc(N2CCOCC2)cc1 732571483 DSUFQGJORJMILL-PKOBYXMFSA-N 437.544 2.261 10 20 IECD CCC[C@@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748321530 FDRBBBDVSFPVKI-LJQANCHMSA-N 437.474 2.382 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O[C@H]4CCOC4)CC3)cc2F)C[C@@H](C)O1 748833294 RUQRHGWOBVLFAT-UEXGIBASSA-N 449.567 2.325 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCNC(=O)Cc3cccc(F)c3)CC2)cc1 749014272 GARUCDFWWXNJAO-UHFFFAOYSA-N 428.508 2.415 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)Cc3nnc4ccccn34)cc2F)C[C@@H](C)O1 750822355 SBEKMNFGNTZTQR-IAGOWNOFSA-N 440.523 2.230 10 20 IECD COC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCCC1 753514821 BYQNYXQOGZPNKE-UHFFFAOYSA-N 434.514 2.427 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](c3nc(C4CC4)no3)C(C)C)CC2)cc1 754181623 DXGFRBJVRUQKJN-FPOVZHCZSA-N 429.565 2.425 10 20 IECD CCn1cc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c([N+](=O)[O-])n1 754804469 ZVWMXAKGMOUAJX-UHFFFAOYSA-N 445.448 2.360 10 20 IECD Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 758457404 OSTXAYGDJBPPBS-KRWDZBQOSA-N 446.529 2.392 10 20 IECD CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 760886994 QIOIXTQEOAHCFA-INIZCTEOSA-N 446.573 2.225 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 762416751 WHLAFICYSYEZKJ-MRXNPFEDSA-N 430.432 2.464 10 20 IECD COC(=O)c1cn([C@H]2CCCN(Cc3cc(Br)cc(OC)c3O)C2)nn1 762793001 ASQZOTAPHYEYEI-ZDUSSCGKSA-N 425.283 2.379 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN([C@H]2CCOC2)CC1 773480332 CFTHDNGPSWMSTR-AEFFLSMTSA-N 433.508 2.196 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)C[C@@H](O)c3ccco3)CC2)cc1 778326349 NZVMMCQYGUUIIE-DSHSFFHVSA-N 427.501 2.121 10 20 IECD CCOc1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1CO 778390232 YTMSVQIDJVPAPN-ZHACJKMWSA-N 439.512 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3(c4ccc5c(c4)OCO5)CC3)CC2)cc1 778392024 ZTQAJXYUMZBMGB-CMDGGOBGSA-N 449.507 2.434 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C3)nc12 778983485 QQIZYBCCFARVHT-UONOGXRCSA-N 433.509 2.347 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NCc3cc(Br)ccc3O)C2)cc1 779171784 MTQLNFPVLOLQNL-UHFFFAOYSA-N 427.320 2.326 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 781502842 GKULKHNRALPRBN-LLVKDONJSA-N 432.429 2.021 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 785529218 VZZXFGAWROYTBC-PMOLBWCYSA-N 430.593 2.264 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](Oc4ncccc4F)C3)CC2)cc1 785839223 SGFJKHRGFXXVHO-HXUWFJFHSA-N 428.508 2.421 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 787203514 QUTPDALPFRYNHR-GOSISDBHSA-N 440.544 2.457 10 20 IECD C[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C[C@H](CO)O1 787480429 YDVUNMJNBDYPQT-FCOKVBTJSA-N 426.585 2.338 10 20 IECD CCc1cc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(CC)CC)cc3)C2)ncn1 788977910 SQOKORSFIJMBHK-FQEVSTJZSA-N 438.576 2.287 10 20 IECD CSc1ccc(F)cc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800292 NBQDQCSHDGYXIO-UHFFFAOYSA-N 435.496 2.456 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@@]4(CCO[C@H]4C)C3)cc2F)CC1 790717604 DLVRVZVHZVIJLK-BSRJHKFKSA-N 434.556 2.446 10 20 IECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NCc2ccc(OC)cc2O)n1 797389774 XQOHLXTXGICEKN-UHFFFAOYSA-N 438.440 2.018 10 20 IECD CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 805006726 COVIBLBEYGLLTJ-RTWAWAEBSA-N 448.583 2.246 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@H]3COC(=O)NC)cc2F)CC1 806750215 NGVDHAAODPPRSO-SFHVURJKSA-N 435.544 2.388 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccccc1N1CCOC1=O 807385314 IEVZQRLHGBYDKK-UHFFFAOYSA-N 434.246 2.366 10 20 IECD COC(=O)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 914353808 IVOCJXVFZRYICD-WQLSENKSSA-N 443.344 2.330 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)C[C@@H](C)O1 917710830 XSJIQAABVWYRRU-ZHALLVOQSA-N 440.519 2.499 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)ccc2C)cc1OC 917757949 CQKNPMWNGRVPCR-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 917955045 VUHHDLIKGNJEAO-UHFFFAOYSA-N 435.521 2.233 10 20 IECD CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 918788676 CCUJNDGRTNTTAM-UHFFFAOYSA-N 431.464 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc5c(cn4)OCCC5)n3)CC2)cc1 1321226939 UICWNIBQJHOJCA-UHFFFAOYSA-N 435.484 2.357 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3c(Cl)ccc4nonc34)C2=O)cc1 1326697787 HOINTJXWNDLGKQ-LJQANCHMSA-N 429.820 2.291 10 20 IECD CN1CCN(c2ccc(CN[C@H]3CC(=O)N(CCOc4ccccc4)C3)cc2F)CC1 1339507843 DONQNYUZGJEECL-FQEVSTJZSA-N 426.536 2.347 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C 1342915943 NJMIPIPDJPPGIS-XHSDSOJGSA-N 436.505 2.382 10 20 IECD CNS(=O)(=O)C1=CC(C(=O)Nc2c(-c3ccc(F)cc3)nc3ccccn23)=S=C1 1640825661 ZXOJGGSCBVXCAK-UHFFFAOYSA-N 430.486 2.233 10 20 IECD Cc1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782004434 DRNKHGFCAUUZCR-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccccc1 1802211559 SKUMVKFGSDQVKX-CWQOZTLDSA-N 443.594 2.289 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1coc(Cl)n1 1804283970 SCVIYRRJOGAQRN-JHURRJJJSA-N 433.848 2.410 10 20 IECD Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1825872368 AZMDQNFOWYMDFM-GOSISDBHSA-N 425.489 2.138 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cccc(F)c3)CC2)CC1)c1cc(O)nc(O)c1 1834988668 BHXSBMWCHLPYIA-UHFFFAOYSA-N 442.491 2.131 10 20 IECD CN(C)c1ccc(CNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 15135092 FQJYLSHEJWFUMP-UHFFFAOYSA-N 447.557 2.289 10 20 IECD COCCOCC(=O)NC1CCC(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 726563242 XJEGDFVEITYART-UHFFFAOYSA-N 447.576 2.118 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(-c2ccccn2)s1 727673170 LFLBWXNMFLVEJP-UHFFFAOYSA-N 428.539 2.370 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 730369229 QGKQIBIRUNDLNW-KRWDZBQOSA-N 427.476 2.446 10 20 IECD O=C(CN(CCO)[C@@H]1CCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 733995180 CQHAIYVNLZJKRH-JOCHJYFZSA-N 427.520 2.260 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc21 734495582 QUNCZPCQQJVWPA-MRXNPFEDSA-N 429.542 2.472 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)cc1 734843939 TUHVYZZOJALKCU-BJKOFHAPSA-N 443.613 2.301 10 20 IECD O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804820 BQHPJYSPTDLXGT-BBRMVZONSA-N 434.530 2.293 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)NCC1CCN(S(=O)(=O)C(F)F)CC1 743623887 DFOVUHHGTOGDQZ-UHFFFAOYSA-N 431.505 2.335 10 20 IECD COCCN1CCC[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751060278 AOVOXHFFGJQUSM-OAHLLOKOSA-N 439.559 2.095 10 20 IECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc(F)c1F 756181789 PPZDHYZTUGHGHO-UHFFFAOYSA-N 444.431 2.410 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C[C@@H](O)COc3ccccc3)C(C)C)CC2)cc1 770044700 SBBURCBNUBAEBZ-JOCHJYFZSA-N 441.572 2.494 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c1 771019886 GAWYUHRXQQQGAC-LLVKDONJSA-N 432.420 2.403 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773740783 SYCTVNUAIPMNET-HNNXBMFYSA-N 448.541 2.449 10 20 IECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cc(C(=O)NCC(F)(F)F)n(C)c2)cc1 775685282 FNBMQACJQJBYAI-UHFFFAOYSA-N 432.468 2.204 10 20 IECD C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc([S@](C)=O)cc1 782502884 XWEHQSZYSQGENH-DFYVNMARSA-N 433.549 2.367 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910436 BOKMOFARNBACIQ-OAQYLSRUSA-N 449.599 2.230 10 20 IECD Cc1csc(CCCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789848136 ZYZFYRYXNLIWNY-UHFFFAOYSA-N 448.564 2.307 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1[C@H]2CC[C@H]1[C@@H](CO)C2 794108374 GKJSJWTXPOLKEU-IAISJRAMSA-N 447.469 2.087 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(OCC)cccc3[N+](=O)[O-])nc12 795712339 WOFGCTKVIZKPHK-UHFFFAOYSA-N 430.373 2.276 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)cc1 797431456 PFWCIHGSLULZPH-UHFFFAOYSA-N 439.437 2.305 10 20 IECD CN1C(=O)COc2cc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 799246153 PRTJNOWUOVTYHL-INIZCTEOSA-N 437.500 2.065 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCc3cccc(F)c3)cc2F)CC1 805007202 HFWNATYOTOCFDR-UHFFFAOYSA-N 444.526 2.472 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3cc(C)on3)cc2F)CC1 805009904 PXLAKMFRFMFBET-NRFANRHFSA-N 443.523 2.244 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 806164768 CCUVADARWVVCIX-QHCPKHFHSA-N 447.539 2.236 10 20 IECD CC(C)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1=O 806259741 BVRNOZGILBXOGE-QAPCUYQASA-N 434.968 2.318 10 20 IECD C[C@H](O)CN1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H](C)C1 806683708 BNPPBLGQZZPYKN-CVEARBPZSA-N 426.508 2.353 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3c(C)cccc3F)CC2)cc(OC)c1OC 807520390 XOQGFOYITDSPIH-UHFFFAOYSA-N 445.491 2.125 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCn4cnnc4[C@H]3C)cc2Cl)C1 807952340 LGATZCIXWIBJES-LSDHHAIUSA-N 430.940 2.387 10 20 IECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 808835453 CCHPHYNZTXBXNM-FPOVZHCZSA-N 431.577 2.384 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 809456567 TUOHONHIBRNZBJ-LJQANCHMSA-N 447.601 2.043 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)CC2)cc1 809522558 GYJUJLFBDIKDNE-QYZOEREBSA-N 435.615 2.230 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)cc(F)c3F)cc2)C1 815401581 DTBBLJDTYRYZJQ-ZDUSSCGKSA-N 434.418 2.061 10 20 IECD CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cn2)CC1 916245691 RQZXILYQLZSEJA-OAQYLSRUSA-N 439.560 2.430 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)Nc4ccccc4O)CC3)nc12 917068069 NSSISFRFXLNHKS-UHFFFAOYSA-N 439.472 2.168 10 20 IECD CN(Cc1ccccc1O)C(=O)NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 918218191 PWJONSIQWCEMRT-IBGZPJMESA-N 427.501 2.408 10 20 IECD O=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970695 VSSJBQZOBJEZIZ-UHFFFAOYSA-N 436.487 2.327 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2cccc(C)c2C)C1 1321366880 PTFWEXMAMAFOGH-MSOLQXFVSA-N 440.496 2.358 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCC(=O)Nc3ccc(F)c(F)c3)CC2)cc1 1324606275 WLFNQFQDOKDQTK-UHFFFAOYSA-N 432.471 2.240 10 20 IECD Cc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785507316 NMCYHFZOTFJCEB-RXVLNYDTSA-N 438.480 2.269 10 20 IECD O=C(COc1cccnn1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791847356 WQYJNVXUYDMEQC-UHFFFAOYSA-N 435.440 2.110 10 20 IECD CC(C)OCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314761 UOBWGRPKGGAKRK-UHFFFAOYSA-N 435.571 2.406 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc(Br)c1 1796600749 ITHXIRZVJTYTKQ-BTTYYORXSA-N 447.289 2.216 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798692006 WIPWWFOYHVLUIP-VBUUOAMHSA-N 434.500 2.071 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc(C)c1C(=O)O 1800860446 WDUYOXKMKZCTTB-BJWYYQGGSA-N 439.468 2.373 10 20 IECD CC(C)(C)OC(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804282755 CCKAQAQTTIXGTE-BEVBHUTCSA-N 446.500 2.187 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812477970 WDRMEAPCMZKYDH-PGVBMLAISA-N 449.486 2.238 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2ccnn2c1 1821509920 LRABLQPJXYCEKI-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CC(C)/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823089349 PPNYEZXJYJWYMQ-PSKZRQQASA-N 435.575 2.474 10 20 IECD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1846917105 KXWSQRURCAROQG-UHFFFAOYSA-N 444.875 2.235 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cccc(S(=O)(=O)N(C)OC)c3)CC2)cc1 110360694 NLOUXHOPOYVDLF-UHFFFAOYSA-N 433.530 2.276 10 20 IECD Cc1cc(OCCN2CCNC2=O)ccc1NS(=O)(=O)c1cccc2nsnc12 572202649 UPHOXFDOZNXLJP-UHFFFAOYSA-N 433.515 2.205 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c1 729063938 LVLKQSMKARLPTL-JTQLQIEISA-N 428.413 2.213 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3nnc4n3CCCCC4)cc2F)CC1 730112984 KYTJSANNLDYWGL-UHFFFAOYSA-N 429.544 2.285 10 20 IECD CCOc1ccc(N(CC)CC(=O)NN2C(=O)N[C@@](C)(c3cccc(OC)c3)C2=O)cc1 733794318 KHOULZIZVQLKPC-QHCPKHFHSA-N 440.500 2.419 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)c1 734073846 XNDXMWZTMDFDAV-IYBDPMFKSA-N 427.501 2.265 10 20 IECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 734124091 ZSMRFNWIERGPME-IBGZPJMESA-N 425.620 2.450 10 20 IECD CCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 737139140 LWVRUUHEXGJNMY-SFHVURJKSA-N 448.527 2.013 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1C(=O)O 737756905 JRMSSUREHBINCP-UHFFFAOYSA-N 440.286 2.259 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(NC(=O)N(C)C)c3)nc12 740372197 IQONIDIBBKBNQF-UHFFFAOYSA-N 427.417 2.062 10 20 IECD CCNC(=O)N1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 741804680 JUXOZBHNDJIHAV-OAHLLOKOSA-N 434.496 2.136 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCc2c[nH]nc2C1 742573798 NYVVPXNUBVDBFY-KRWDZBQOSA-N 435.507 2.087 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743735449 HPLXZLGPSSWLDJ-AWEZNQCLSA-N 445.474 2.252 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCC[C@@H](O)C1 745738088 SQLZZLWPTRTHJD-PKOBYXMFSA-N 442.539 2.293 10 20 IECD COC[C@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 749792501 RVBDLBBVYDKIQS-IBGZPJMESA-N 428.512 2.167 10 20 IECD O=C(NCCNS(=O)(=O)Cc1ccon1)N(Cc1ccccc1O)C1CCCCC1 750660559 NXEJLEJFXNXFTL-UHFFFAOYSA-N 436.534 2.344 10 20 IECD CCc1nc([C@@H]2CCCCN2C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)no1 754013313 ROIZMTNCDUNWDX-CTNGQTDRSA-N 429.565 2.351 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1 755792419 YJECZJQGYYKWKI-IBGZPJMESA-N 435.546 2.417 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CCSC)c3nnc4ccccn34)nc12 763022006 SXIMLFCAMFMTCO-OAHLLOKOSA-N 441.517 2.238 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3C[C@H](O)c3ccccc3)CC2)cc1 763431877 XENKSLXVQLJTMB-VWNXMTODSA-N 439.556 2.168 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCS(=O)(=O)C[C@H](C)C1 763902000 SHSXJVQLJQKQSV-CABCVRRESA-N 440.521 2.156 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)Nc1nc(CS(C)(=O)=O)no1 765240164 JAHOKTURUBQCGJ-UHFFFAOYSA-N 433.284 2.136 10 20 IECD CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 768559965 JZVXGDKXZRUUKG-QHCPKHFHSA-N 446.523 2.169 10 20 IECD O=S1(=O)N=C(N2CCN(Cc3cccc(Br)c3O)CC2)c2ccccc21 768804908 RZXDVPJYYHEKFE-UHFFFAOYSA-N 436.331 2.421 10 20 IECD O=C(O)[C@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 769523565 ZUDGSIBRGJAMCW-AUWXEVLLSA-N 426.541 2.042 10 20 IECD C[C@H]1CN(C(=O)c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@@H](C)O1 769710190 ILASPWMSZGSDGU-OKILXGFUSA-N 447.513 2.265 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1F 773252171 RFSLMJUFCBYBMU-UHFFFAOYSA-N 435.477 2.082 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCC(C)(C)C3)CC2)cc1 785530319 NSBNMRRCGUFWAZ-LJQANCHMSA-N 430.593 2.409 10 20 IECD COC(=O)CCc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 786293861 YYUJCLZVWLZLKK-KRWDZBQOSA-N 439.512 2.445 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@@H](N2CCCC2=O)C1 791081878 MUHHMSZUNBUNDJ-CQSZACIVSA-N 435.527 2.091 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C[C@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1Br 795141869 YMYPVOYFLQJGFT-ZJUUUORDSA-N 433.259 2.165 10 20 IECD Cc1csc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 804502570 VEJUOMHFZNVTEN-QGZVFWFLSA-N 441.601 2.477 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCCCN1CCCCC1 805819483 RZPQPBXWZWIDEE-UHFFFAOYSA-N 430.593 2.254 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](CCCO)c3ccccc3)CC2)cc1 807432068 JPCFKAMYFIZBKL-QFIPXVFZSA-N 425.529 2.364 10 20 IECD C[C@@H]1N(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCOC1(C)C 807768355 HQHZPSVCFCQEQF-LSDHHAIUSA-N 425.476 2.399 10 20 IECD CCN(CC)[C@H](C)CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771403 UUTLHBREVRWHBM-HZPDHXFCSA-N 426.508 2.220 10 20 IECD CCN(CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)CCC(F)(F)F 809066864 BBMGXXHXWPUJIV-UHFFFAOYSA-N 444.498 2.124 10 20 IECD CC(=O)N(c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1)C1CC1 815410289 YAOMGLFQTXYTQU-UHFFFAOYSA-N 436.512 2.293 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(N(C)C)c3)cc2F)C[C@@H](C)O1 919154009 UONCMDHAANOGKG-IYBDPMFKSA-N 444.507 2.374 10 20 IECD COCCOCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920710740 OMFJPNVYLOOADD-AWEZNQCLSA-N 425.437 2.385 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc(NC(=O)C2CC2)cc1 1342914442 FZFPMEZNXDZUSB-SFHVURJKSA-N 426.469 2.279 10 20 IECD COC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781119619 QRJNCSVBJGBQPP-IIBYNOLFSA-N 440.924 2.304 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2[C@H]1O)c1cc(O)nc(O)c1 1793181604 YQFTYKGGDPWEAK-XQYWQHOKSA-N 437.496 2.041 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc2cccnn2n1 1800716718 YEGMFAOQWVTTMH-BTTYYORXSA-N 441.875 2.360 10 20 IECD CC(C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992895 DIGIRXDNDWAPRB-QRWLVFNGSA-N 428.489 2.023 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820363152 AERYOYZBYQKCKV-ZDUSSCGKSA-N 441.404 2.072 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CC2)CC1 1824216858 UEEOCKUJCVCTLS-DKRLNXSXSA-N 435.615 2.433 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCN(C(=O)N2CCCC2)C1 195641095 ACZOWYQLCKBBSK-SFHVURJKSA-N 432.540 2.331 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 732243078 MBZFJHOGUSSHTI-QGZVFWFLSA-N 446.573 2.479 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CCO1 737146467 PZYNKHDOJPNJFR-SFHVURJKSA-N 438.528 2.003 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c1O 737285555 HEJZKLUUWTYCJH-UHFFFAOYSA-N 435.362 2.255 10 20 IECD COc1ccc(C)cc1NC(=O)CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 741734645 HPCKYPCRHQSSBO-UHFFFAOYSA-N 440.544 2.027 10 20 IECD O=C(Nc1ccn(-c2ncccc2F)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 758966860 OKDJKIPXDDXXIL-INIZCTEOSA-N 439.447 2.258 10 20 IECD CCS(=O)(=O)CCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759366128 KQHUCMGXJZVPIJ-CQSZACIVSA-N 428.510 2.156 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](N2CCCC2=O)C1 761114755 OUHUSGDQKGRQNF-HOTGVXAUSA-N 431.492 2.486 10 20 IECD Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc2nc(O)nc(O)c12 761981837 IOOIYLBBNTUORV-CQSZACIVSA-N 443.891 2.498 10 20 IECD COC(=O)c1cn([C@@H]2CCCN(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)C2)nn1 763034692 HWARMXQVEAQUNM-GOSISDBHSA-N 442.520 2.089 10 20 IECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCN(C(=O)OC(C)(C)C)CC1 769688766 DHWSYQACKRVXCF-UHFFFAOYSA-N 427.523 2.235 10 20 IECD C/C=C/C[C@H](CO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770349857 HWKHYGQTMFNIAT-ZMUQKWFASA-N 428.512 2.069 10 20 IECD C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1Cl 772982168 UFKYIXVQSOEYCG-SJLPKXTDSA-N 446.013 2.316 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1 774363023 HIOUDAWQWOMZIF-UHFFFAOYSA-N 438.509 2.414 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC(C)C)nc3)CC2)cc1 778235089 VCDSZHUDQBCOBT-PKNBQFBNSA-N 438.528 2.399 10 20 IECD CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NCc2ccc(O)c(O)c2)c1 778925550 LJMINTMKKXUQRG-UHFFFAOYSA-N 433.530 2.268 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H]3CC=CC[C@H]3C(=O)N3CCOCC3)CC2)cc1 784392520 IDKDARLQTAAXLF-FCHUYYIVSA-N 427.545 2.221 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CN3[C@H](C)CC[C@H]3C)cc2F)C[C@@H](C)O1 785742126 OHLSUUZXUURZNG-BRSBDYLESA-N 435.540 2.472 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)c2nnc3n2CCCCC3)cc1F 786056013 WFSWQAUOWDGPEP-OAHLLOKOSA-N 430.528 2.483 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3ccc4c(C)cc(=O)oc4c3)cc2)CC1 786255182 KRDMHARSWJMJPB-UHFFFAOYSA-N 449.507 2.465 10 20 IECD CC[C@](C)(O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788320916 RKNANSJXKBFQAY-VWLOTQADSA-N 439.556 2.329 10 20 IECD Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 788931867 JXVWOSYALVHIPI-JOCHJYFZSA-N 434.540 2.129 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O 788933223 PBHJQWVEELWIDT-HXUWFJFHSA-N 438.503 2.354 10 20 IECD CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933768 XQUCJPKOMJXRPK-IBGZPJMESA-N 443.569 2.272 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)cc1F 788990248 PNNQWDGTVJNZGI-QGZVFWFLSA-N 426.558 2.381 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)OC4(CCOCC4)C3)cc2F)CC1 790719350 SSQGLJFLCHZXFD-SFHVURJKSA-N 434.556 2.447 10 20 IECD CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 791915430 ZRNZSNVLVUVLDL-CQSZACIVSA-N 439.515 2.374 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 793907168 AHNYAZUNFRCCJR-ZCNNSNEGSA-N 430.593 2.217 10 20 IECD CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCN(C2CC2)C1 803448480 RXKDBAFSVXRPNR-SFHVURJKSA-N 436.503 2.068 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 803661005 MLHBFMWOBYQXPY-GOSISDBHSA-N 429.492 2.421 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1)C1CCCCC1 803676600 ARPXVDXPENYDEF-FCHUYYIVSA-N 428.577 2.051 10 20 IECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 804650968 CXUDSDSZXOVDGD-SFHVURJKSA-N 430.476 2.406 10 20 IECD COc1cccc(Cl)c1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806267078 PTPTXHMAVDQVOX-UHFFFAOYSA-N 431.920 2.460 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 807023835 FITQCXNSUCLMBN-HNNXBMFYSA-N 442.516 2.064 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@](CO)(C(C)C)C3)CC2)cc1 819036308 DHTNBGQGZRRWHW-GTCGAKFVSA-N 429.561 2.157 10 20 IECD Cc1cc(C(=O)COC(=O)CSC(F)F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 899266605 DKJBFBSIAGZMQV-UHFFFAOYSA-N 432.470 2.423 10 20 IECD C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1)n1cccn1 915732144 VOESIRQWMYGNFM-MRXNPFEDSA-N 434.500 2.404 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(N(C)C)cc3)CC2)cc1 915744493 LNENCXYWXNRXOL-UHFFFAOYSA-N 439.560 2.028 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CSc3nnc4ccccn34)CC2)cc1 917176577 KNHCRHFZFBKNIR-UHFFFAOYSA-N 440.573 2.159 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc1 1341342633 RIJVKOZHPSKPML-UHFFFAOYSA-N 432.546 2.160 10 20 IECD Cc1ccc([C@H](C)C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1783309323 AJZHKMHOVNHONP-HJPURHCSSA-N 425.485 2.048 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1ccccc1)C1=NN(c2ccccc2)C(=O)C1 1795812738 QDTLPWBTXMJKRU-USKVXJDGSA-N 446.507 2.151 10 20 IECD Cc1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)s1 1796934236 FDSIXWRVQGOAJQ-ACHSLPGTSA-N 437.525 2.496 10 20 IECD Cc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1807992734 ACFOWDGLPALROH-SBUREZEXSA-N 447.495 2.154 10 20 IECD Cc1cc(/C=C/C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1807994300 GJYMPASCKKRXQB-MQGGFDMLSA-N 449.467 2.217 10 20 IECD CC(C)N[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C(C)C 1816722847 ZLROBRJCTRUAMF-FZKQIMNGSA-N 447.561 2.198 10 20 IECD CN(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708562 HAHJZSHZWMIMFH-NSHDSACASA-N 438.937 2.385 10 20 IECD COCCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1837765437 XWVYPYMVAYOJFS-UHFFFAOYSA-N 440.924 2.400 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4c(C)nn(C)c4s3)CC2)cc1 21697430 FONPUURHTHOYAO-UHFFFAOYSA-N 428.514 2.457 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1 729056003 MMHGTGLARFCXRE-UHFFFAOYSA-N 444.557 2.133 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(N4CCCC4=O)CC3)cc2F)C[C@@H](C)O1 729481903 ILUVEQWRWRLVPO-HDICACEKSA-N 446.567 2.142 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCC1(N2CCCC2)CCOCC1 729596523 JEIXXALFHSYRDH-UHFFFAOYSA-N 434.556 2.231 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)cc2F)C[C@H](C)O1 734842788 XNALKHCNWQTCIE-GJZGRUSLSA-N 447.532 2.204 10 20 IECD Cn1cc(N2CC[C@@H](NC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C2=O)cn1 735579329 DKEMZOBZMGDJQE-GOSISDBHSA-N 448.474 2.095 10 20 IECD O=C(CN1C(=O)NC2(CCCC2)C1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800310 HWFVKUTZABRYMR-AWEZNQCLSA-N 436.459 2.238 10 20 IECD CCN(C)C[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 744423305 CRCCTSLJSCAIJL-SFHVURJKSA-N 432.590 2.198 10 20 IECD COc1ccc(CC[C@@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3)C2=O)cc1 749601122 CFNCTZGWEGWPMC-XMMPIXPASA-N 438.528 2.321 10 20 IECD C[C@H](C(=O)N(C)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)n1cccn1 750873970 CDNAPGAUIHZQIM-NQIIRXRSSA-N 427.549 2.176 10 20 IECD CC(=O)N(C)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751228385 QCXFVCROOHRCIY-UHFFFAOYSA-N 435.521 2.248 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(NC(C)=O)c(C)c3)CC2)cc1F 754210782 DNGZDFPUQKTMEE-UHFFFAOYSA-N 428.464 2.388 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C4CCN(C)CC4)C3)CC2)cc1 756055628 WYEXNHBNWMPZQN-OAQYLSRUSA-N 429.609 2.191 10 20 IECD COc1ccc(C)cc1NC(=O)CNC(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 756337350 UQSOPEJLUMOXPV-LJQANCHMSA-N 441.528 2.445 10 20 IECD CN(C)c1ccc(CNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1F 760810411 TWCXAMFVONEEDP-SFHVURJKSA-N 436.528 2.414 10 20 IECD CC(C)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1CCCS1(=O)=O 761984459 ZATTUELSDHZNMJ-MJGOQNOKSA-N 443.997 2.186 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773844145 CLOSCISDKZPPPC-CYBMUJFWSA-N 425.518 2.266 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]3C)nc12 778293886 WQHFKZWYPJJEAY-OKILXGFUSA-N 433.509 2.441 10 20 IECD CO[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 788313723 VEYHAEKSVHWMTB-HXUWFJFHSA-N 431.920 2.297 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(O)cc3)cc2F)C[C@H](C)O1 789821332 RZUKHZATIIUOLP-HOTGVXAUSA-N 429.492 2.420 10 20 IECD CCC[C@@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842231 CBWLTQKFEUHIGW-QHCPKHFHSA-N 435.540 2.211 10 20 IECD CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795360980 RZICTGOSSYPIQO-QGZVFWFLSA-N 437.512 2.305 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(CCC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 803303069 GWDBSULJGMOZHM-LJQANCHMSA-N 430.593 2.281 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803306661 VSJYNDCXHCALDU-QGZVFWFLSA-N 448.564 2.026 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1F 803664922 SXCYFNLMUHRRAT-QGZVFWFLSA-N 432.883 2.083 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1F 804851687 LEZSNUAMGCUOBU-MRXNPFEDSA-N 436.528 2.414 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1C 807512207 ODLZTLYPHAGGCK-UHFFFAOYSA-N 446.312 2.170 10 20 IECD O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NCc1cc(Cl)cc(Cl)c1O 807838086 KGUADNOHSGFULT-UHFFFAOYSA-N 434.279 2.387 10 20 IECD O=C(CNC(=O)NCc1ccc(N2CCSCC2)cc1)NCCN1CCCCCC1 814283413 FJWWUAHXXPEMCR-UHFFFAOYSA-N 433.622 2.031 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@](C)(O)c3ccc(Cl)cc3)CC2)cc1 815499159 WCBMUMXNZOZSNM-QFIPXVFZSA-N 432.904 2.448 10 20 IECD CCOc1ccccc1CS(=O)(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 912934699 NTKMZNLJCGURRR-UHFFFAOYSA-N 432.542 2.358 10 20 IECD CC(C)CN1C[C@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 914676067 KNWZIMFULCSJJZ-OAHLLOKOSA-N 448.475 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cc(OC)ccc3OC)CC2)cc1 920254385 IUYQJTWCUNTBPG-ZHACJKMWSA-N 439.512 2.234 10 20 IECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CC12CCS(=O)(=O)CC2 1323043400 VCWSDGIULZHEPZ-DLBZAZTESA-N 426.966 2.341 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCSC1)C2)c1cc(O)c(O)c(Cl)c1 1799770342 OHTFGOKLTGILFX-MBMVNNNZSA-N 440.949 2.098 10 20 IECD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)ccn1 1827428273 MAEIZYLUAXGLNV-GOSISDBHSA-N 440.500 2.444 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCO1)CC2 1828197560 BBELVPQQXOEAJX-DCXQYXQDSA-N 445.497 2.064 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2sccc2F)C1 1841726204 WAOGVNDAAPJJCE-UHFFFAOYSA-N 426.473 2.497 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CS[C@@H]2CCCCO2)C1 1844293456 LLIRVVZNRUBRGO-ZLQZBKBYSA-N 448.541 2.280 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1-c1cccc(C(C)C)c1 97513156 OWFRFKZFECKPMX-UHFFFAOYSA-N 435.532 2.189 10 20 IECD COc1ccc(N2CCCN(C(=O)Cc3c(C)nc(-c4cccnc4)[nH]c3=O)CC2)cc1 108689463 AHILYRZFDLIFOI-UHFFFAOYSA-N 433.512 2.430 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCc3ccccc3)cc2F)CC1 303335332 UOFDLVJECQRHCY-UHFFFAOYSA-N 426.536 2.333 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1C(=O)O 728015221 MJNNQJYPIFSWHM-UHFFFAOYSA-N 449.304 2.320 10 20 IECD CCN1CCC[C@H]1CN1C[C@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 729626727 DFIJJDGDRFRKSU-CTNGQTDRSA-N 428.577 2.067 10 20 IECD CCN(C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1)S(C)(=O)=O 731361460 KCOVMZMNFWYVJZ-KRWDZBQOSA-N 438.594 2.040 10 20 IECD COc1ccc(O)c(CNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N2CCOCC2)c1 734064357 FNTUCXZRERXBKR-IBGZPJMESA-N 445.516 2.291 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 740813081 RLHXMSGQOJJUFN-UHFFFAOYSA-N 439.515 2.474 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c(C)c1S(=O)(=O)NC1CC1 741095979 VTWHLXHLYRVIAU-UHFFFAOYSA-N 431.514 2.047 10 20 IECD CCCNC(=O)c1cccc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1 741368071 LZVPZFYWYJFBFH-UHFFFAOYSA-N 426.429 2.108 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 742939865 KEMNIECWGGOOQF-UHFFFAOYSA-N 443.504 2.233 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2n1C 743893535 YGZOGOYAHXBMAU-UHFFFAOYSA-N 435.528 2.345 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCC(=O)N3CCCCCC3)CC2)cc1 748343752 NSKNWQMJLIMMCR-UHFFFAOYSA-N 445.608 2.299 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@@H]4CCCO4)CC3)cc2)C1 751783872 XJATVPHBPIZQRZ-KNQAVFIVSA-N 444.576 2.258 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1F 754212595 MQIRVNKJYVRCOR-UHFFFAOYSA-N 433.411 2.047 10 20 IECD CCn1cc(C(=O)C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 758857267 DOSUWZNEZCJHPR-CYBMUJFWSA-N 445.431 2.432 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1F 759101844 KNSDGLIMHKJAHQ-UHFFFAOYSA-N 440.493 2.371 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 759238734 CERIRBKKZSMNOU-UHFFFAOYSA-N 445.491 2.320 10 20 IECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1 759299169 ZFXDOEZIPYPSIL-SBUREZEXSA-N 428.508 2.234 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cccc(OC)c2O)c(OC)c1 761290801 SCSAJPQGSTYRAR-UHFFFAOYSA-N 444.531 2.040 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1 761967094 HJSKRMYDCQRQPC-NSHDSACASA-N 435.433 2.388 10 20 IECD CCn1c(SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)nnc1-c1cnccn1 765360904 WREDXYGIZDUUFJ-UHFFFAOYSA-N 439.545 2.205 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc5c(c4)OCO5)n3)CC2)cc1 771054477 ATEZHNWGWZVXPN-UHFFFAOYSA-N 436.468 2.289 10 20 IECD CS[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H]1N(C)C 775997477 BEJWQQDUAKAEAF-SNHGZMDHSA-N 438.613 2.033 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ncccc3Cl)CC2)cc1 778328056 KWBUODWTDLMFHV-CMDGGOBGSA-N 444.919 2.144 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(NC(=O)OC(C)(C)C)CC3)CC2)cc1 779222652 UFPOXNDAOPZQHM-OAQYLSRUSA-N 448.608 2.167 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 779589471 HDFRTBUDSMMXQL-LNENJAERSA-N 428.510 2.495 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(N4CCCS4(=O)=O)c3)c2)CC1 781045424 JXSPTXGBRFIMPI-UHFFFAOYSA-N 442.541 2.147 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 785390016 QFRAQVPPBXCNPR-PZJWPPBQSA-N 436.556 2.315 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4c(C)cnc4O)cc3)cc2)CC1 787320408 TWFFFDZVESPYOB-UHFFFAOYSA-N 433.512 2.485 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/C(=O)Nc3ccc4n[nH]cc4c3)cc2)CC1 787321785 JSJAJNIZAKFUTF-CMDGGOBGSA-N 446.511 2.043 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCO[C@@H]3CCCC[C@H]3C)cc2F)CC1 787990691 SNEJQMXCUQEIEG-XMSQKQJNSA-N 448.583 2.295 10 20 IECD COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 788498802 OTVHTLRIDPEAGS-TZIWHRDSSA-N 444.553 2.359 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@H](c2ccccc2)C1 789841044 QTUFCLMSJBCGRF-IBGZPJMESA-N 425.504 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3N(C)CCCC3(C)C)CC2)cc1 791146363 QEPILCHBTULBPO-KUFMOJEASA-N 428.577 2.137 10 20 IECD Cc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C2CC2)o1 793733180 LQFJVNLJAJPQFV-GOSISDBHSA-N 438.528 2.097 10 20 IECD COc1ccc(CNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)c(O)c1 794388296 VYFVHYNVDRAXQM-UHFFFAOYSA-N 443.319 2.344 10 20 IECD O=S(=O)(Cc1ccon1)NCCNCc1ccc2c(c1)CCN2Cc1ccccc1 796315687 KGJXVCHYDNNEAY-UHFFFAOYSA-N 426.542 2.447 10 20 IECD COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NCc1ccccc1O 796769059 GZVPQYTVOBCWAM-UHFFFAOYSA-N 425.210 2.335 10 20 IECD NS(=O)(=O)Cc1cccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 799887362 VOQPQBUQSCQNTE-UHFFFAOYSA-N 434.587 2.028 10 20 IECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 806634330 JPVCEDPZVRCMHO-OAHLLOKOSA-N 428.574 2.483 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C 807095921 CEZPSKGEAGXOTR-KXBFYZLASA-N 432.565 2.439 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1F 810371285 XNDIOACNMAVGPC-UHFFFAOYSA-N 435.521 2.469 10 20 IECD C[C@H](OC(=O)[C@@H]1CCN(C)C(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 912704736 WBEHYXSRVAUKSI-UONOGXRCSA-N 434.448 2.201 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1Cc1cccnc1 1116669575 VAGAHXAXAAEFDM-RBUKOAKNSA-N 427.501 2.138 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2 1785509831 GTOIDZJMDQDBDB-NRDKSBKSSA-N 428.485 2.003 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)O)[C@H]3C2)cc1 1791051821 IYAGHCHWCDYNSB-UDDWMFPDSA-N 425.529 2.068 10 20 IECD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)n1cccc1 1791516795 AZVGSENIUOQSQR-PWDMQXDWSA-N 447.919 2.407 10 20 IECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C(F)(F)F)o1 1796601276 OHBQPLYNDGFKSA-ZSBIGDGJSA-N 440.378 2.374 10 20 IECD O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1815606074 LUEQZJDVWUFAIV-GFCCVEGCSA-N 430.511 2.479 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc[nH]2)CC1 1825890311 XGGHAOMIYNNVFN-FZMUQLTDSA-N 440.500 2.473 10 20 IECD O=C(c1cc2n(n1)CCC2)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428505 SCXLYEAFYGGGAK-IBGZPJMESA-N 439.516 2.183 10 20 IECD Cc1nc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(C)s1 1847034026 VQMOKWREVAAIHP-FNORWQNLSA-N 443.525 2.336 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 735390772 XRIPNMPCVZCLIQ-IBGZPJMESA-N 441.484 2.395 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](CN2CCOCC2)C1 741811428 ZNLBDDVEMJMGRX-MSOLQXFVSA-N 447.535 2.443 10 20 IECD CN(C)c1ccc(CNC(=O)c2cc(I)ccc2-n2cnnn2)cc1 744382838 YYARBSPJOBVGFK-UHFFFAOYSA-N 448.268 2.263 10 20 IECD CN(C)C(=O)Cn1cc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 747552494 JSGAXUKZWOYSTF-CQSZACIVSA-N 436.463 2.363 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)cs2)cc1OC 749153744 FNAHOIZNOLKPBH-UHFFFAOYSA-N 434.517 2.106 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3sc(C)nc3C)CC2)cc(OC)c1OC 759099647 LMIPROJRFROXGZ-UHFFFAOYSA-N 427.548 2.297 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 759370812 QITFRCIVBJDCEV-UHFFFAOYSA-N 431.558 2.275 10 20 IECD COCCCn1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 759987288 NFATUEQKISXAQG-UHFFFAOYSA-N 433.509 2.300 10 20 IECD CS(=O)(=O)c1ccc(N(Cc2ccccc2O)C[C@@H]2CCCO2)c(S(C)(=O)=O)c1 762176115 IPTHJZHQMOFRTG-INIZCTEOSA-N 439.555 2.385 10 20 IECD COc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCCC1 763284727 UNBSNDGWMKZOKM-CQSZACIVSA-N 434.514 2.252 10 20 IECD COc1cc(O)c(CN2CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)cc1OC 768443597 HFZYYBXKCXCXBR-HNNXBMFYSA-N 437.537 2.262 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1 771553470 QNEDJMRCZVBSTO-LJQANCHMSA-N 436.512 2.268 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1 774861426 NXWXAMOESPZIHI-JOCHJYFZSA-N 442.535 2.006 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 775043208 ORHCPCIMKINYST-NRFANRHFSA-N 438.597 2.247 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccccc3CN3CCCC3=O)ccc21 787431029 JHIZGMXCUIDJIH-UHFFFAOYSA-N 434.540 2.124 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCc3nc4ccccc4[nH]3)CC2)cc1 788462690 ZICLRSFARXZWEA-UHFFFAOYSA-N 435.528 2.406 10 20 IECD C[C@@H]1[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC[C@H]1C 793731888 GEEZJHCWCFKZRF-PIKOESSRSA-N 428.577 2.193 10 20 IECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 794863481 HSKKPORJGKHJHB-UHFFFAOYSA-N 435.867 2.429 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C(=O)NC)Oc2ccccc21 802610232 WOGGWLQCTQSTGX-HXUWFJFHSA-N 425.485 2.061 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCN(C4CCCCC4)C3=O)ccc21 803687189 WWWMMLIDDVZCGH-FQEVSTJZSA-N 426.561 2.125 10 20 IECD C[C@H](OC(=O)[C@@H](O)c1cccnc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803955506 LVHNBHXOXNUNJC-RBZFPXEDSA-N 430.416 2.461 10 20 IECD CC[C@]1(C)CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768802 BQEJOMHJFUFXGE-YCRPNKLZSA-N 425.476 2.401 10 20 IECD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915699683 LRYKVSWVPDXHEC-JOCHJYFZSA-N 438.507 2.400 10 20 IECD COc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2C)cc1 917708602 KUBPVWQWVCJMLV-UHFFFAOYSA-N 425.464 2.490 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 917710464 JFTTWUDRMIYLHH-IYBDPMFKSA-N 446.523 2.310 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)/C=C/c3cnn(C)c3)cc2F)C[C@@H](C)O1 918996618 FURXOWUBOLEWDX-HIFBNBFRSA-N 430.480 2.046 10 20 IECD N[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccnc1 1796135576 YAHSHNRAAUQESH-KYHPRHEASA-N 444.919 2.488 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CCCC1)C2 1802079577 KQZOMKYZFFKUQI-ZEIRRLMLSA-N 442.512 2.153 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccccn2)CC1 1825812824 LHIJKVFNWZSAGU-KRWDZBQOSA-N 446.598 2.175 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCOc2ccccc2)C1 1842640491 BDGYSBAHUNJCGJ-UHFFFAOYSA-N 446.507 2.452 10 20 IECD Cc1ccncc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848212167 JGIRYTUTUCYUDW-YROIDETFSA-N 437.496 2.355 10 20 IECD COc1ccc(N2CCN(CN3C(=O)C(=O)N(CCC4=CCCCC4)C3=O)CC2)cc1 38383562 NZSAPTCIBFRYSW-UHFFFAOYSA-N 426.517 2.456 10 20 IECD CCCOc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OC 727177844 PFJHEVIHRHKTGZ-RVDMUPIBSA-N 430.573 2.234 10 20 IECD COc1cccc(CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1O 727761204 NTIWIWKCZOBXGK-GJZGRUSLSA-N 434.514 2.129 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C4OCCO4)C3)cc2F)C[C@@H](C)O1 728053419 JUBOYPHTABAEDI-ZIFCJYIRSA-N 435.540 2.140 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3c(=O)n(CC)c4ccccc43)cc2F)CC1 730192562 GWLWAMKLNGVCLM-UHFFFAOYSA-N 439.535 2.420 10 20 IECD CCCNC(=O)CN(C)C(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036923 SMAAURRJUYJKFC-UHFFFAOYSA-N 432.565 2.449 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)c1 737184703 VBBAQFWMGJRBOT-CQSZACIVSA-N 428.489 2.107 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1C 737206541 AYAFRORVJYCAOA-UHFFFAOYSA-N 435.502 2.116 10 20 IECD Cc1cc(C(=O)COC(=O)CNC(=O)c2ccccn2)c(C)n1-c1ccc2c(c1)OCCO2 740338175 ORBNYGCSAXPTIA-UHFFFAOYSA-N 449.463 2.416 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 743179662 ZNZSKDFHSQUDKQ-GOSISDBHSA-N 448.531 2.383 10 20 IECD COc1ccc(N2CCN(C(=O)CCc3c(C)nc4[nH]n(C)c(=O)c4c3C)CC2)cc1F 753737712 CKLYBWTZDSDUNA-UHFFFAOYSA-N 441.507 2.308 10 20 IECD C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 755128219 SHDPIDPNNGRFFS-LJQANCHMSA-N 445.633 2.078 10 20 IECD CCOC(=O)c1cccc(OC[C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755303573 KCDNKCVDWVMKDJ-NRFANRHFSA-N 442.512 2.351 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)nc2C(=O)OC)cc1C 755962866 PWSTUTWUTRFDST-UHFFFAOYSA-N 447.922 2.392 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756711114 IGELPENGVWLANO-FUHWJXTLSA-N 441.532 2.125 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3c(=O)c4ccccc4n4nc(C)cc34)CC2)cc1 758196568 IMASJLMVRGPPIJ-HXUWFJFHSA-N 447.539 2.149 10 20 IECD CCOC(=O)C1(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCC1 759265826 DNXHSBUNNAOUQS-UHFFFAOYSA-N 435.521 2.277 10 20 IECD CCn1c(COC(=O)/C=C/c2ccc(O)c(O)c2)nc2cc(S(=O)(=O)N(C)C)ccc21 759592409 GQUADCRHDWJROF-UXBLZVDNSA-N 445.497 2.474 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1F 762416440 UHFWOGAEIWCDJT-UHFFFAOYSA-N 431.489 2.420 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1)c1ccc(N(C)C)cc1 773854008 AIZQNGPZVMSZAE-AWEZNQCLSA-N 443.935 2.158 10 20 IECD O=S1(=O)CCN(c2ccc(CN[C@@H]3CCS(=O)(=O)c4ccc(F)cc43)cc2)CC1 775508279 SVBWCUKHIMSUGP-LJQANCHMSA-N 438.546 2.069 10 20 IECD CC(C)(C)OC(=O)Nc1cccc2c1N(C(=O)C1=CC=CN3CCS(=O)(=O)N=C13)CC2 776403715 CZCJIOYKZAAYAQ-UHFFFAOYSA-N 444.513 2.420 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)ccc21 778609833 PKFUQQJEBMJWQN-UHFFFAOYSA-N 438.528 2.242 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1 785292867 BKQFOFZSMWFNOJ-SNVBAGLBSA-N 445.369 2.458 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1 785298533 VQGNNBFELIKICJ-CQSZACIVSA-N 435.484 2.379 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3ccc(-n4cncn4)cc3)CC2)cc1 785400685 VFRLTFORABTQQQ-GOSISDBHSA-N 448.527 2.192 10 20 IECD C[C@@]1(c2ccccc2)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 789799601 KHFWLBCPIYTYDS-DEOSSOPVSA-N 441.503 2.053 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCN2CCCC[C@H]12 790293089 SVCNVBMDBRJUGA-RTBURBONSA-N 436.503 2.116 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C 801545905 FYJJUXKJWSBSMY-UHFFFAOYSA-N 434.504 2.399 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@H](c4ccsc4)C3)CC2)cc1 804317059 RTPPINXBANZKNV-FQEVSTJZSA-N 429.542 2.442 10 20 IECD COc1ccc(N2CCCN(C(=O)NC[C@H](N3CCOCC3)C(F)(F)F)CC2)cc1 805844303 HFSDYHKAWQINHC-SFHVURJKSA-N 430.471 2.180 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 806281986 DIHQLAMAGQELNK-CQSZACIVSA-N 438.962 2.317 10 20 IECD CNC(=O)c1ccc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 916196827 QBWWCDQDXZQZAP-UHFFFAOYSA-N 439.560 2.066 10 20 IECD CN1CCN(c2cc(CNC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccn2)CC1 916389605 AHHXAPMHPYXQPK-OAQYLSRUSA-N 439.560 2.430 10 20 IECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1Cl 917833006 KDZDUPYEDUCYDA-MRXNPFEDSA-N 449.960 2.375 10 20 IECD Cc1nc2ccnn2c(C)c1CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917836706 RRFHXRGMCLSBOU-IBGZPJMESA-N 434.544 2.297 10 20 IECD CN(Cc1ccccc1)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918091294 ZTPWIGSCENPUBP-UHFFFAOYSA-N 428.508 2.245 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] 918442941 YJUCHFRODBHFEO-UHFFFAOYSA-N 426.473 2.367 10 20 IECD CCOC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 918670844 AVNRGBCJLYHLJZ-QGZVFWFLSA-N 426.517 2.440 10 20 IECD C[C@H](NC(=O)NCCNS(=O)(=O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 920867408 SMZODYOKBJFTNX-SFHVURJKSA-N 446.573 2.003 10 20 IECD CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(OCC)cc3)CC2)n1 1320532747 DTQWIAHOWKDRJK-UHFFFAOYSA-N 432.546 2.408 10 20 IECD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1)c1ccccc1 1777851168 CSBGKWFXBBAJRR-SWWFSWNPSA-N 439.512 2.424 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)CC1CCCC1)CCO2 1785508727 JZVVFPINUJMWJC-DRGXBFSJSA-N 430.501 2.227 10 20 IECD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)nc1 1790242195 UGHQPSNNVKSIMC-RFUYNDQBSA-N 445.903 2.362 10 20 IECD O=C(Cc1cscn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931981 XNCOIWDYRJJVJB-GBEXYDAJSA-N 437.525 2.117 10 20 IECD COC(C)(C)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1804963691 VLGOCDJWVFWXQT-UHFFFAOYSA-N 440.544 2.436 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3nnsc3C3CC3)CC2)C1 1810551928 NVMGVDIDBGTNSE-UHFFFAOYSA-N 443.529 2.380 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1 1814165208 CQUDTPJTMGOMJV-KHIHDDCBSA-N 441.459 2.420 10 20 IECD CNc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843442109 YRWMLLPOMILNLC-UHFFFAOYSA-N 431.496 2.338 10 20 IECD NC[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1ccccc1 1845500886 ABGZOWFADASIMB-MRXNPFEDSA-N 429.904 2.311 10 20 IECD CN(C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)C(=O)OC(C)(C)C 729537393 DHASCXNRFMHAON-ZDUSSCGKSA-N 427.523 2.093 10 20 IECD O=C1CN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c2ccncc2N1 746408364 DVSMLSIQZOHHOE-UHFFFAOYSA-N 428.360 2.364 10 20 IECD Cc1ccc(NC(=O)CN2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)N(C)C 746492746 KYCFHWDVCPFELE-UHFFFAOYSA-N 432.546 2.149 10 20 IECD C[C@H](NC(=O)CNS(=O)(=O)c1ccc(Cl)s1)c1ccc(N2CCOCC2)cc1 749852375 YZNYLVMXLAQDSI-ZDUSSCGKSA-N 443.978 2.394 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3csc([C@H](C)OC)n3)CC2)cc1 752360429 LGFTUUUIIWVKDO-INIZCTEOSA-N 433.578 2.481 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)[C@@H]3CCCN(C4CCC4)C3)CC2)cc1 754462287 DMSGPAXFLCCUMU-PQNGQFLHSA-N 430.637 2.421 10 20 IECD C[C@@H](O)CN(C)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 755440838 MFMNZMHHITVRPQ-SRMXYGTFSA-N 429.361 2.490 10 20 IECD C[C@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1cc(Br)ccc1O 756738871 LZMCUHQVFLKLGN-LBPRGKRZSA-N 443.367 2.392 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cncc(Br)c1)c1ccc(N2CCOCC2)cc1 757161796 ZJNQXWDMPDPFML-ZDUSSCGKSA-N 433.306 2.497 10 20 IECD COc1ccc(N(C)CC(=O)c2c(N)n(Cc3ccccc3)c(=O)n(C)c2=O)cc1Cl 757857089 JADWXWICGWYPPL-UHFFFAOYSA-N 442.903 2.159 10 20 IECD O=S(=O)(NCC(F)(F)F)c1ccc(S(=O)(=O)Nc2ccc(O)cc2F)cc1 758168921 HFBIWQPXCOGLFR-UHFFFAOYSA-N 428.385 2.173 10 20 IECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](C)S(=O)(=O)CC2)c([N+](=O)[O-])c1Br 758224239 AOHFGROLHPWQBZ-MRVPVSSYSA-N 438.256 2.288 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(S(C)(=O)=O)CC1 760934418 ZQGAWNKCBDXAJT-AWEZNQCLSA-N 440.521 2.298 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4cc(F)ccc4F)C3=O)cc2)C1 761117632 GRYSFQZSQJWPDT-LIRRHRJNSA-N 428.439 2.460 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](c1ccc(C)cc1)n1cncn1 770116390 MPYYMNXPRNUMSG-QUCCMNQESA-N 443.529 2.462 10 20 IECD CN1CCN(CCC(C)(C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 771302437 RLAGUTCTWNDNRS-UHFFFAOYSA-N 435.588 2.002 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CO)[C@H](C)c3ccccc3)CC2)cc1 771425262 YUYKOXFHDIYAMY-AUSIDOKSSA-N 426.561 2.281 10 20 IECD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)O1 774773828 ZEHRGWSMCAUOPD-MSOLQXFVSA-N 440.491 2.192 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cnc4scc(C)n4c3=O)cc2F)CC1 776322520 MJDHHKPJUADUGZ-UHFFFAOYSA-N 429.521 2.275 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ncn(C)c2=O)c(C)n1-c1cccc(C(F)(F)F)c1 779128723 XUMQQHUMXOYNGN-UHFFFAOYSA-N 436.390 2.434 10 20 IECD CCc1noc2ncc(S(=O)(=O)Nc3cccc(N4CCN(C(C)=O)CC4)c3)cc12 780408604 KBZKGMRZKYNFOE-UHFFFAOYSA-N 429.502 2.255 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CCO)c2ccccc2Br)c1 782061445 JXZIVIVGUUPZOQ-HNNXBMFYSA-N 443.319 2.380 10 20 IECD COC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 784071498 QFKXTBHJBJXZRQ-RHSMWYFYSA-N 431.455 2.487 10 20 IECD O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 786009396 ZIVFSFDPYHBFQH-UHFFFAOYSA-N 431.452 2.411 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)sc1C 789821662 UKPLPRMXRBJUHM-CHWSQXEVSA-N 434.537 2.445 10 20 IECD C[C@H]1CSC[C@H]1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977643 VMMSRKIYIVENBZ-MAUKXSAKSA-N 430.553 2.493 10 20 IECD C[C@@H]1CN(CCCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CCCO1 807929926 FWKKGIASKXEQGN-HXUWFJFHSA-N 430.593 2.252 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)nc12 919013214 QPNYFJGTKIXVLM-CFYSCFQDSA-N 429.473 2.376 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 921265905 ABYRPIWHOPVKGZ-UHFFFAOYSA-N 446.479 2.450 10 20 IECD Cc1cc(-c2nnc(CCn3cnc4c3c(=O)n(C)c(=O)n4C)o2)c(C)n1-c1ccccc1 1322720764 LNVZEKWZQYLNSY-UHFFFAOYSA-N 445.483 2.134 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(c2ccccc2)C1=O 1324540251 GIFQGTHAGGKQNT-MSOLQXFVSA-N 426.469 2.131 10 20 IECD CCOC(=O)c1c(NC(=O)COC(=O)C2(CO)COC2)sc(C)c1-c1ccccc1 1344478162 JDYRQMSMQZSUMB-UHFFFAOYSA-N 433.482 2.391 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4c[nH]c5cnccc45)n3)CC2)cc1 1347678936 SAXUVMIAEDJIQA-UHFFFAOYSA-N 432.484 2.437 10 20 IECD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)ccc1F 1780943825 VPLSKTGEQHIYHA-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2 1782009246 VCYTVDFJVDIUSW-CNOZUTPLSA-N 433.263 2.119 10 20 IECD CC(C)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1788700071 DSACWQFYFKRCLK-ATZCPQFDSA-N 440.924 2.158 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)n[nH]2)C3)cc1 1799620571 SRRNOMYLTSFYAJ-OPMZPASUSA-N 449.511 2.040 10 20 IECD Cc1cnn([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1802933599 RHBUKTLLPFBDSE-RYFIZMMISA-N 440.500 2.221 10 20 IECD Cc1nn(C)c(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283330 RRZOKJUXNFJAFS-FJXIAYRNSA-N 440.500 2.119 10 20 IECD Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1807994803 BVLUBAICMZCJNO-IFXJQAMLSA-N 439.497 2.286 10 20 IECD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccn1 1807999827 WNANBONJIHZWNC-JIGPKXGUSA-N 447.495 2.406 10 20 IECD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cc1 1816727258 JORZRVPPHXDANT-ZDUSSCGKSA-N 440.481 2.498 10 20 IECD CN1CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827425180 ZRWUMONUAXSLMO-FQEVSTJZSA-N 444.576 2.458 10 20 IECD O=C(c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898145 BGKGFQDQFHENRN-HNNXBMFYSA-N 435.571 2.373 10 20 IECD O=C([C@@H]1CC1(F)F)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902063 IRTKZEBBQJAOJA-UONOGXRCSA-N 445.557 2.122 10 20 IECD CC(=O)c1cc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)ccc1[N+](=O)[O-] 553248323 OYWQYFOSHORGKV-UHFFFAOYSA-N 447.498 2.313 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)n(C)c2ccccc12 576811463 GHRRXLATBSJMTA-ZHALLVOQSA-N 426.561 2.203 10 20 IECD C[C@H](C(=O)N(C)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)n1cccn1 726567553 QIRODFGHCYJTGN-OAHLLOKOSA-N 435.475 2.289 10 20 IECD CC(=O)N1CCCc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 736329744 LHZMLJKGKLJSLI-UHFFFAOYSA-N 447.532 2.440 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c1O 737286205 SJWCAPLWLFGHGJ-UHFFFAOYSA-N 426.517 2.186 10 20 IECD Cc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1NS(C)(=O)=O 739768977 YPHWGLXLPZDHEH-UHFFFAOYSA-N 430.530 2.321 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(O)c(Br)c3)cc2)C1 742049894 HKMQQCKOGNPNJN-CYBMUJFWSA-N 433.306 2.181 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743735454 HPLXZLGPSSWLDJ-CQSZACIVSA-N 445.474 2.252 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(F)cc2I)c1O 750254765 HRCTYHNJPNSCSI-UHFFFAOYSA-N 444.200 2.399 10 20 IECD CO[C@@H](C)c1noc(CN2CCCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)n1 750639703 UTFUOTYIWLWELH-HNNXBMFYSA-N 434.516 2.400 10 20 IECD COCCCS(=O)(=O)N1CCN(Cc2ccc(OCc3ccccc3)cc2O)CC1 753551073 YBBGINKVORXIIQ-UHFFFAOYSA-N 434.558 2.455 10 20 IECD C[C@@H]1Cc2cc(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)ccc2N1S(C)(=O)=O 759591222 GEADIDLJBJBPGJ-IBSXUBTNSA-N 431.466 2.248 10 20 IECD COc1cc(N2CCN(Cc3cccc(NS(C)(=O)=O)c3)CC2)cc(OC)c1OC 761220093 UGEZBAFINBKJBT-UHFFFAOYSA-N 435.546 2.406 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@H]3CC(=O)N(Cc4ccccc4)C3)no2)c1 762343478 VTABJFAPIJTEIO-AWEZNQCLSA-N 428.470 2.330 10 20 IECD Cc1onc(-c2ccccn2)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 764939911 PCKSNUINXMSTFT-UHFFFAOYSA-N 426.498 2.210 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765904763 UXIYGASODYMRBY-UHFFFAOYSA-N 430.262 2.299 10 20 IECD COc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc(F)c(F)c3F)CC2)cc1OC 768437696 CZGPQJSQMMMAHA-UHFFFAOYSA-N 446.447 2.333 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccs1 774862207 WGTWASNSQBZEAQ-ZWKOTPCHSA-N 431.558 2.380 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(CC(C)C)nn3C)CC2)cc1 778252890 VHDWZHKNESKFLP-MDZDMXLPSA-N 425.533 2.471 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCCn3ccnc3C)CC2)cc1 778289398 LIEDRUQVDATTAK-MDZDMXLPSA-N 425.533 2.002 10 20 IECD CC[C@@](C)(CCO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 778435938 NNIIXXWVBBYBSU-IBGZPJMESA-N 437.474 2.382 10 20 IECD Cn1nc(Br)cc1/C=C1\SC(=S)N(CCCN2CCOCC2)C1=O 779204135 OVBSMRASSCPRGA-XFXZXTDPSA-N 431.381 2.106 10 20 IECD COc1cc(CN2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc(OC)c1OC 779530612 SZWFMLSMQRTKHH-ALCCZGGFSA-N 428.485 2.481 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnc(-c2ccccc2)nc1 780050495 LDVYKHOCZGTZFB-UHFFFAOYSA-N 435.459 2.374 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)c1 785506181 SRPHEPFNIGBIOO-UHFFFAOYSA-N 438.477 2.140 10 20 IECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 786290514 UNTRMOMHWQBTQH-UHFFFAOYSA-N 436.541 2.290 10 20 IECD COc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1OC 787015370 GBTAZCZSIGEUBY-UHFFFAOYSA-N 429.542 2.190 10 20 IECD CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788070164 IYNAZEWGENXWFX-OXQOHEQNSA-N 440.544 2.322 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC3C[C@@H]4CCC[C@H](C3)N4C)cc2F)C[C@@H](C)O1 789823317 DEOGXNRYCMVPAJ-GYMWCJPTSA-N 446.567 2.187 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@@H]1CCCC(F)(F)C1 789834214 KNLXAQKOWGCPGR-OAHLLOKOSA-N 427.467 2.345 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC([C@@H]2CCOC2)C1 792051711 OBTHLSHXRCQPDL-GOSISDBHSA-N 440.523 2.120 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)c(F)cc3C)c2)CC1 793410157 RLFODFQVVJSDDM-UHFFFAOYSA-N 435.477 2.302 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1OC 796710318 TZJBAEAGHMOWEB-UHFFFAOYSA-N 441.484 2.168 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2ccc(Cl)cc2F)c1O 799736497 VOXULKFNQNEROM-UHFFFAOYSA-N 433.845 2.170 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H](c4ccnn4C)C3)CC2)cc1 801518185 YZSKRJZHPGJBPB-ZBTAVZRMSA-N 437.544 2.040 10 20 IECD COc1ccc(CN2CC[C@H](NC(=O)NCc3ccc(N(C)C)cc3)C2=O)c(OC)c1 806026553 FHRNDJFSXVQVNT-FQEVSTJZSA-N 426.517 2.370 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807617318 MIFUDCIAHUDFNF-NHCUHLMSSA-N 426.513 2.274 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(N(C)C)cc1 807674800 RAUGPGSQIUONJG-SFHVURJKSA-N 438.572 2.203 10 20 IECD C[C@H](OC(=O)CN1CCCCC1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915455624 VCTOALYAJBTDDJ-AWEZNQCLSA-N 434.448 2.345 10 20 IECD C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3nc(C4=S=CC=C4)n[nH]3)cc2)C1 917127288 BCXAGQLCCHXYLY-KBPBESRZSA-N 445.570 2.349 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCCN3C(=O)NC(C)(C)C3=O)cc2F)C[C@@H](C)O1 917708340 AKTCUTLUWAHAPM-HUUCEWRRSA-N 434.512 2.166 10 20 IECD CCNC(=O)COc1cccc(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)c1 918303381 HNMMIHRQRSADKF-UHFFFAOYSA-N 426.517 2.255 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1325913534 JPZJYVCAVAAEMW-KRWDZBQOSA-N 437.949 2.105 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1OCCc2ccccc21)c1cc(O)nc(O)c1 1793485629 HCDQLWRFTCXUMF-AJYBTWMASA-N 437.496 2.449 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccoc3C2)C1 1841450161 NNBFQFBKKOBCCP-GOSISDBHSA-N 446.507 2.381 10 20 IECD CC(C)c1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n[nH]1 1847038708 NWKSATWKGLKDBR-FNORWQNLSA-N 426.473 2.180 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(O)cc2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 21463540 SNEJSUSREBLZPY-UHFFFAOYSA-N 444.465 2.192 10 20 IECD NC(=O)CN1C(=O)/C(=C\c2cc(Br)c3c(c2)OCCCO3)SC1=S 727176669 XOXQSSQHMHITLT-IZZDOVSWSA-N 429.317 2.297 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 728947929 VFMGZWLXSKHTEG-INIZCTEOSA-N 426.517 2.349 10 20 IECD CCN1C(=O)C(=CNCCCc2nnc(SC)n2CC(C)C)C(=O)N(CC)C1=S 730982273 SPECFGHHUMQJEX-UHFFFAOYSA-N 438.623 2.058 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 741698554 YSXOOOXNUHQOQB-UHFFFAOYSA-N 445.585 2.265 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4nc(C)oc4c3)CC2)cc1 743432214 JKFQDWOQVNWQQI-UHFFFAOYSA-N 437.500 2.022 10 20 IECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCc1c(O)ccc2c1CCCC2 743716291 OFWLTFUFTKCKBY-UHFFFAOYSA-N 426.517 2.161 10 20 IECD COCCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 743859679 ZJYVYCIHLVRRHL-WSTZPKSXSA-N 437.556 2.040 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc4c(c3)CCCN4C)C2=O)cc1 746812154 YQAHZZXGTPXSKS-DEOSSOPVSA-N 436.512 2.161 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(c4ncccc4F)C3)cc2)C1 755309181 UDXMGXAOABAACZ-MSOLQXFVSA-N 440.523 2.001 10 20 IECD C[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)cc(Cl)c1O 756739062 QYSRKCKSULTICY-OCCSQVGLSA-N 446.773 2.392 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](C)S(=O)(=O)CC1 759986832 CZFYHAXEYGLZCO-HUUCEWRRSA-N 440.521 2.298 10 20 IECD COC(=O)[C@H]1CCN2C(=O)N(C3CCN(c4ccc(OC(F)F)cc4)CC3)C(=O)[C@@H]2C1 761158213 JJPAMMUVUDGIJC-GUYCJALGSA-N 437.443 2.473 10 20 IECD COc1ncc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769026637 YPLUERBZJHTCGJ-UHFFFAOYSA-N 437.544 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 778412057 WTDHHLBHFKECQT-ZNFPLGDCSA-N 426.521 2.019 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(Cc3ccccc3C)CC2)cc1 784560934 ZTLWRRXUSMLXKK-UHFFFAOYSA-N 425.529 2.327 10 20 IECD COc1cccc([C@@H]2[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)CCN2C2CC2)c1 785443553 NIIAGQGIROGLGA-DHIUTWEWSA-N 436.556 2.472 10 20 IECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cn2)n1 787500211 KDOVFWSJFQZVCG-UHFFFAOYSA-N 432.528 2.199 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N2CCOCC2)c1 787611148 GFCXRHRQEBNBAA-QHCPKHFHSA-N 438.572 2.175 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc4c(c3)CCO4)cc2F)C[C@@H](C)O1 788345717 ZIUYTARLLGCVDC-HZPDHXFCSA-N 441.503 2.307 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cc(Cl)cc(C(N)=O)c3OC)CC2)cc1 789695755 FQJKDMYXPORRGA-UHFFFAOYSA-N 432.908 2.217 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789824111 GMCGOPPLBLBVSX-YOZRSPHLSA-N 433.524 2.129 10 20 IECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789825270 LHAWEPCWMXYNMU-HCXYKTFWSA-N 448.583 2.292 10 20 IECD Cc1cccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789833661 IBYMXOCVRIMKAJ-QFIPXVFZSA-N 440.519 2.470 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3C3CCCC3)cc2)C1 793716423 BMHGRAIMWXAGRU-FPOVZHCZSA-N 426.561 2.186 10 20 IECD C[C@@H]1CCc2ccccc2[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793735911 ZPJRCAWSPIQKGY-MONBJTKQSA-N 448.567 2.444 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 793907892 DQUVHSLWZBPQDH-IYWMVGAKSA-N 430.593 2.183 10 20 IECD C[C@@H](NC(=O)C(=O)N(CCN(C)C)Cc1cccs1)c1ccc(N2CCOCC2)cc1 803303502 OKPAQRIANBVSBK-GOSISDBHSA-N 444.601 2.352 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)C(=O)NCCCSc1nccs1 804262875 CJORUYWLPUECAM-ZDUSSCGKSA-N 428.580 2.257 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC(=O)N(C4CC4)C3)cc2Cl)C1 805755400 DAHSYIKSSPXQMG-DOTOQJQBSA-N 446.979 2.320 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCN1C(=O)OC(C)(C)C 806276584 QUEMOLWZEOFNRV-ZDUSSCGKSA-N 428.580 2.209 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807771906 YZLHHKUEJOFGOC-NVXWUHKLSA-N 425.476 2.401 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1 809795250 OJONXAPZRWAVPA-BDTNDASRSA-N 425.529 2.452 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2c(O)cccc2Br)C1=O 864042987 BTEJBAYEPDCVCK-UHFFFAOYSA-N 447.289 2.260 10 20 IECD COc1cc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(OC)c1 916676338 IDKJDDPKMIPZNS-UHFFFAOYSA-N 432.542 2.188 10 20 IECD CN1CCN(c2ccc(CNc3cc(S(=O)(=O)N4CCCC4)ccn3)cc2F)CC1 1116875104 AOYAEWRYIUYJLC-UHFFFAOYSA-N 433.553 2.369 10 20 IECD O=C(COC(=O)C1(O)Cc2ccccc2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1322016728 QNLJGHQYHYEGFT-UHFFFAOYSA-N 441.439 2.474 10 20 IECD CSCC[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791616273 LABBIQCPWJRTET-INIZCTEOSA-N 431.514 2.355 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H](O)c3ccccc3)CC2)C1 1810543913 QEQQQJMJHMDFGZ-HXUWFJFHSA-N 425.485 2.071 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ncc(Cl)cn1 1816278037 XJHAHZOOIZHSFJ-CYBMUJFWSA-N 443.851 2.279 10 20 IECD CCOCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823474714 AEOVBOJIZADSLF-HEWZJLJBSA-N 430.461 2.269 10 20 IECD O=C(Cc1cccs1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837953796 IVJDGFFKBWUNEG-UHFFFAOYSA-N 445.541 2.409 10 20 IECD O=C(c1cc2cn[nH]c2cn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501460 QZEDXWGLTRTDNA-UHFFFAOYSA-N 427.848 2.153 10 20 IECD O=C(c1nc2ccc(F)cn2n1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502031 HCQCRAZUMBANHM-UHFFFAOYSA-N 445.838 2.064 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2cccnc2)=NN1c1ccccc1 1848237522 MLMSKJBUEUXCMP-DRJJXNLZSA-N 429.480 2.090 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(N2CCCS2(=O)=O)c1 105535135 KMJBFZXYRCHFLL-UHFFFAOYSA-N 445.541 2.108 10 20 IECD Cc1c(CNC(=O)C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)n(C)c2ccccc12 517255863 ADIHVJOGYLSEQX-HXUWFJFHSA-N 433.556 2.478 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(C(=O)NC4CC4)c3)CC2)cc1 726726164 OENOZWFAJAYFJB-UHFFFAOYSA-N 436.512 2.311 10 20 IECD CCN(CC(=O)NCc1cccs1)C(=O)CN1CCN(c2ccc(OC)cc2)CC1 727111349 YNPIDBRLJWTQEN-UHFFFAOYSA-N 430.574 2.044 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(Cl)nc3Cl)CC2)cc1 732923092 NQGOVFIPJRMVPP-UHFFFAOYSA-N 445.372 2.498 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C(=O)N(C)C)c(C)c3)CC2)cc1 741095427 DCOQWMLAEFAQAS-UHFFFAOYSA-N 438.528 2.429 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(Cc3ccccc3)C[C@H](C)O)CC2)cc1 741411580 NRDLGNMVXVVZMQ-FQEVSTJZSA-N 426.561 2.410 10 20 IECD CN1C(=O)CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc21 745985618 PEWUDNXGFSKWAD-UHFFFAOYSA-N 426.492 2.152 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1CCc1ccccc1 746376384 FJVRSUNQQYFCFU-UHFFFAOYSA-N 433.512 2.217 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 751137320 PTWKACCHMLMXFG-HNNXBMFYSA-N 443.518 2.305 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3cccc(OCC(=O)N(C)C)c3)CC2)cc1F 753843415 GQPJONWXODUEAO-UHFFFAOYSA-N 444.507 2.333 10 20 IECD O=S(=O)(c1c(F)cccc1F)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768159443 FWINYXISVBABAP-UHFFFAOYSA-N 437.512 2.308 10 20 IECD Cc1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(=O)N(C)C 772910108 NBCQWRAPUAYSHL-UHFFFAOYSA-N 428.508 2.401 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(C(=O)OC)s1 773089730 UYOXUHICLPWUHH-NSHDSACASA-N 426.516 2.427 10 20 IECD CNC(=O)c1cccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784766002 FVJNSWRFZAVTKU-SFHVURJKSA-N 444.919 2.125 10 20 IECD COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785293734 ICOMWMDFVGGTFF-CYBMUJFWSA-N 430.457 2.358 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)nc2)cc1 785862912 YHJKDWWOUHLNQG-UHFFFAOYSA-N 439.560 2.039 10 20 IECD COc1ccc(CCS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 788599581 FGWGPFRRCGRQGT-LJQANCHMSA-N 431.558 2.059 10 20 IECD Cn1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(-c2ccoc2)n1 789259082 KIJQNEPKZQLTFW-UHFFFAOYSA-N 442.447 2.129 10 20 IECD CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793726145 RXZIKYAMNWFEML-LEWJYISDSA-N 436.556 2.142 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)NCCCSc3nccs3)c2)CCO1 803131625 RXNDDXIOZBLCSG-INIZCTEOSA-N 448.614 2.279 10 20 IECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448398 QJFHDBIAXRFQIO-SFHVURJKSA-N 425.476 2.401 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 806288725 UVKOEOOAPARDJI-GMAHTHKFSA-N 437.540 2.376 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1F 806546119 ODCJLIYSNKFKMX-UHFFFAOYSA-N 436.509 2.487 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290802 AAYFWKVFUNAIEE-HKUYNNGSSA-N 442.560 2.441 10 20 IECD CN(CCCN1CCCC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768060 BAHBVDMSPJBRAF-QGZVFWFLSA-N 438.519 2.317 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(OC)nc3OC)CC2)cc1 811971566 CAUSGEHCMKMXBF-UHFFFAOYSA-N 443.548 2.119 10 20 IECD CCOCc1nc([C@H](C)NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)no1 812565869 UCDFWTRZSWOYEE-AWEZNQCLSA-N 449.508 2.225 10 20 IECD COc1ccc(N2CCCN(CC(=O)N(CCC(N)=O)c3ccccc3OC)CC2)cc1 917087800 HAUMKQGOIHPQKI-UHFFFAOYSA-N 440.544 2.125 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)COc1cccc(F)c1 918206892 QAVQVCITNHOGKU-SFHVURJKSA-N 435.471 2.165 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3N3CCCC3)cc2)C1 918464770 ZTEQOMMCCQJSRN-IBGZPJMESA-N 449.555 2.243 10 20 IECD COCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795351867 TWEFMFZVLQJNCT-JHDGKUDLSA-N 425.529 2.334 10 20 IECD C[C@H](Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1802647438 PJVANINMZLGTAK-NRSFXHEJSA-N 445.610 2.364 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@]3(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826266447 RKKUBPKNFSYXKE-KSRUKNBBSA-N 426.857 2.100 10 20 IECD Cc1ncc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1826731029 FPFYRUYCWYPPFT-NSHDSACASA-N 445.526 2.183 10 20 IECD CC[C@@H](NC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1827043348 JXESYUUHQZWJOV-HLKZIGTNSA-N 445.560 2.434 10 20 IECD O=C([C@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248975 XYECXGRNQLCYLA-CABCVRRESA-N 429.423 2.392 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(O)cc2F)C1 1845362110 PUXPQRJBRJDKSX-UHFFFAOYSA-N 436.443 2.141 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 15134620 KHUVJZUUBJGNSX-CALCHBBNSA-N 431.558 2.481 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2csc(Br)c2)SC1=S 727176342 KAFODYRCLOURBG-YWEYNIOJSA-N 427.392 2.261 10 20 IECD C[C@@H]([C@@H](C)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)S(C)(=O)=O 733341544 AGASSLMAVRODKI-FPCVCCKLSA-N 429.558 2.402 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(CNC(C)=O)cc3)CC2)cc1 733634822 VBRPBKFLDRHKGA-UHFFFAOYSA-N 425.533 2.275 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1=O 735517203 HSTZHIUZGQGPCI-NJDAHSKKSA-N 429.561 2.233 10 20 IECD COc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1OC 740610288 WIFWSDHZVJMTBE-UHFFFAOYSA-N 437.493 2.345 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)CCC(=O)N2CCOCC2)NC(=O)OC(C)(C)C)cc1 742748991 CCFXZMIBCGJTTA-LJQANCHMSA-N 448.564 2.074 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(C[C@@H]4CCCO4)c3)CC2)cc1 743363553 UBMMNHNHSXAXPF-NRFANRHFSA-N 428.537 2.014 10 20 IECD CNS(=O)(=O)c1csc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 748698069 IQQSFNRAMZVTRN-STQMWFEESA-N 441.550 2.339 10 20 IECD O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 751213627 SMAJCYXABLMHRO-UHFFFAOYSA-N 445.906 2.284 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]nc1-c1ccccc1F 755199830 XOSYPPLUJJCOAL-UHFFFAOYSA-N 428.489 2.381 10 20 IECD O=C(COC(=O)CSc1ccc(O)cc1)NCc1ccc(N2CCOCC2)c(F)c1 757110531 AYBUISIVAFRXAA-UHFFFAOYSA-N 434.489 2.320 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 760206330 YCPWEJWZNKQQNT-SFHVURJKSA-N 435.484 2.428 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Br)c(N)c3)nc12 760547894 GGPQJIUJEWHYBX-UHFFFAOYSA-N 435.234 2.313 10 20 IECD NC(=O)c1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761272339 BPOJCNMYJRFOIW-OAHLLOKOSA-N 428.876 2.188 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H](C(N)=O)c3cccc(Br)c3)cc2)C1 763376413 LGGALIPWOZAKTQ-QFBILLFUSA-N 445.361 2.467 10 20 IECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2cccc(Br)c2O)cc1 764760636 JYMLVWZAXVOUER-UHFFFAOYSA-N 442.335 2.241 10 20 IECD COc1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cnc1Cl 767789421 UYKMBELPNYAXTO-UHFFFAOYSA-N 425.938 2.431 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NC(=O)NCCCSc3nccs3)C2)cc1 768395358 YVYBNDUIPJCANG-UHFFFAOYSA-N 442.588 2.006 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccnc1Br 774146930 RAOBHOWBVYHDRO-UHFFFAOYSA-N 447.333 2.308 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3COC4(CCCCC4)O3)CC2)cc1 778419561 MCLQQRBQBQZIBD-GLCJEOIMSA-N 443.544 2.092 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@@H](C)CO1 779335160 CYPIWBQMXRSUAV-IRXDYDNUSA-N 428.512 2.261 10 20 IECD COc1cc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)c(O)c(C(C)(C)C)c1 779869144 FBGWOXQIQDVWJH-GOSISDBHSA-N 426.579 2.325 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1 785296111 BQFUVRTYHZQXBB-CQSZACIVSA-N 448.541 2.497 10 20 IECD C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 787327748 MVUPNYYDCLSTOG-RDTXWAMCSA-N 429.492 2.436 10 20 IECD COc1ccc(F)cc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789078252 ZAPUKDYPOHQASC-CQSZACIVSA-N 447.482 2.428 10 20 IECD CC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 803298791 DWSKURPOOSDDJU-QRWLVFNGSA-N 427.549 2.318 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H]1Oc1ccccc1 803665213 ZCPAALYRTHBTHL-CEWLAPEOSA-N 429.492 2.249 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 810351818 VKYUAQWMISFVRW-UHFFFAOYSA-N 443.475 2.354 10 20 IECD COc1cc(N2CCN(CN3C(=O)C4(CCC4)[C@H]3[C@H]3CCCO3)CC2)cc(OC)c1OC 811763993 MPDLRSQTMJVXDR-XMSQKQJNSA-N 445.560 2.352 10 20 IECD CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284698 OUGGHQNMRALPDL-UHFFFAOYSA-N 429.448 2.094 10 20 IECD COc1ccc(N(C)CCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OC 920418797 JOVMCBGZVZLUKI-UHFFFAOYSA-N 436.530 2.240 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNS(=O)(=O)c2ccccc2)cc1 1326357586 ZQRDPAQUMJMGQF-HXUWFJFHSA-N 431.558 2.239 10 20 IECD CC1=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)CCO1 1787163628 RXYBOIMWWTYCSX-QITLCBANSA-N 436.892 2.039 10 20 IECD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)ccn1 1788885452 QAOJPCSBLVIOKQ-QOKNQOGYSA-N 445.903 2.362 10 20 IECD CSCC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719008 QHGDJVXKSRWZRG-XFMPKHEZSA-N 428.938 2.117 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cccc(F)c1F 1804336128 XTWRHKRYXRDLNX-ZSBIGDGJSA-N 439.509 2.077 10 20 IECD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813627576 RYBHJGQXHXCCBE-ZWWNWMABSA-N 440.500 2.024 10 20 IECD CC(C)c1nc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)no1 1841997681 PAASWVBICSKICR-UHFFFAOYSA-N 434.880 2.317 10 20 IECD COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(Cl)c1 1843249020 OLBLTPXCJBRHSL-UHFFFAOYSA-N 431.876 2.215 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@](C)(c4ccc(C)cc4)C3=O)CC2)cc1 3555656 KUBLSUSDYAKTHG-XMMPIXPASA-N 436.512 2.119 10 20 IECD Cc1c(CNC(=O)C(=O)N(C)CCN2CCN(c3ccccc3)CC2)n(C)c2ccccc12 564365742 YWRVFMFMAHGFSQ-UHFFFAOYSA-N 447.583 2.384 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cnc4c(c3)c(O)nc(=O)n4C3CC3)CC2)cc1 726562783 PGZNTIBBOZEIBD-UHFFFAOYSA-N 435.484 2.239 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1=O 729627515 MPAQGMQVROAKKJ-WIYYLYMNSA-N 428.577 2.113 10 20 IECD CN1CCCc2cc(CNC(=O)NCC3CCN(S(=O)(=O)C(F)F)CC3)ccc21 733038921 ONNGWIPTNMYIPZ-UHFFFAOYSA-N 430.521 2.133 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CS(C)(=O)=O)cc2)cc1 734807213 VNDJLHAJRDOFRP-UHFFFAOYSA-N 446.572 2.184 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1C 749730089 IMOBKFCGMXLAQK-UHFFFAOYSA-N 442.588 2.450 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C3=NN(c4ccccc4)[C@@H](C(C)=O)C3)CC2)cc1 751386980 YDTOKKOITDSEJN-XMMPIXPASA-N 449.555 2.157 10 20 IECD O=C(COC(=O)C(F)(F)C1(O)CCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753406982 MSQJOVBTYADXJO-UHFFFAOYSA-N 429.375 2.494 10 20 IECD CCn1c(N2CCOCC2)nn(CN2CCN(c3ccc(OC)c(F)c3)CC2)c1=S 754011433 HBNVHUAVCGSZGD-UHFFFAOYSA-N 436.557 2.198 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ncn(C2CCCCC2)n1)c1ccc(N2CCOCC2)cc1 755214188 XDXNGKVSNMRYRH-INIZCTEOSA-N 426.521 2.436 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 755257301 RSTDEENKTCSLRH-UHFFFAOYSA-N 447.495 2.119 10 20 IECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NCc2cccc(Br)c2O)n1 765904783 VXXFEJYUDQWKMY-UHFFFAOYSA-N 445.277 2.002 10 20 IECD COC(=O)[C@@H](CC(F)F)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770149912 SKOJHOPVNPMIMW-LLVKDONJSA-N 434.442 2.181 10 20 IECD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(OC)c(Cl)c1 771663818 SQMJRSKBQWOUAL-INIZCTEOSA-N 442.877 2.070 10 20 IECD C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)n(C)c2)C1 773761557 SLEVUABCYGQIMZ-HUUCEWRRSA-N 435.546 2.218 10 20 IECD CS(=O)(=O)C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 774173302 WBIFGKNRCDRRHR-LJQANCHMSA-N 435.521 2.247 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 774856367 GRIGSYRZTMBTOV-IAGOWNOFSA-N 434.556 2.045 10 20 IECD O=C(NCCCN1CCCCCC1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 775097452 QMASOLPKDZLQLV-UHFFFAOYSA-N 427.501 2.423 10 20 IECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)C1 775675918 FVELZFHEWWMLOU-GGAORHGYSA-N 427.637 2.251 10 20 IECD Cc1nn(C(C)(C)C)c(=O)n1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 783911866 RIKMNTUVUVDMIY-GJZGRUSLSA-N 433.528 2.177 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@H](C)c3ccco3)CC2)cc1 785529040 UQCGOWMDPFIMEP-GOSISDBHSA-N 428.533 2.136 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(CN2CCCCCC2)CC1 788321293 URVAUCVXKRFRLA-UHFFFAOYSA-N 442.604 2.254 10 20 IECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1ccccc1 789856141 OWPQKMHCFYMBKO-FGZHOGPDSA-N 438.597 2.418 10 20 IECD CCN1CCN(C[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 790216549 XWASVJSKGUETRX-NRFANRHFSA-N 443.636 2.025 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)ccc1O 790405516 KXUZZRHMBUIVCM-UHFFFAOYSA-N 442.849 2.356 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(N4C(=O)CCCC4=O)c3)ccc21 792340831 DZEDITDRDPQIBO-UHFFFAOYSA-N 434.496 2.367 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1 792955643 HWWDIIMKYRTUJE-GJZGRUSLSA-N 445.495 2.271 10 20 IECD Cc1cc(C)cc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 793716268 AGNJHXBVOLBUDK-ICSRJNTNSA-N 436.556 2.499 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)c3ccc4c(c3)OCO4)nc12 796536191 LARFDSYVWYFBOL-UHFFFAOYSA-N 427.413 2.361 10 20 IECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 799817954 NUDCIVALYNMWSE-UHFFFAOYSA-N 445.541 2.010 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3S[C@H](C)C(N)=O)CC2)cc1 801089695 QUYFVQRRQWHKRH-QGZVFWFLSA-N 442.585 2.213 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2cnn(C)c2)n1C[C@H]1CCOC1 802761742 URSNNBGMKLKFCP-LJQANCHMSA-N 437.548 2.188 10 20 IECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803297759 GCRCVFUJJFQRSJ-IBGZPJMESA-N 442.560 2.192 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(N2CCOCC2)cc1 803312058 UFDRKHNCWDNMIS-SIKLNZKXSA-N 428.577 2.177 10 20 IECD CC1(C)C[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806806465 NGVPFHZIBWVQPK-CABCVRRESA-N 425.476 2.447 10 20 IECD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)n1 807096058 ROYVRHNXNXIXAP-LJQANCHMSA-N 437.544 2.258 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCN(C(=O)N2CCCC2)C1 807458657 GRERVOVOUCERBD-FQEVSTJZSA-N 429.565 2.345 10 20 IECD COCCn1cc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cn1 807954572 VXUAHRJGHGHWCG-MRXNPFEDSA-N 447.967 2.352 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCc2ccnc(N(C)C)n2)cc1 808869961 PYLVVLXZNUQKAR-UHFFFAOYSA-N 436.516 2.047 10 20 IECD CCOC(=O)c1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 811275664 DNBXERAZZFCHCF-UHFFFAOYSA-N 426.469 2.378 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccc(C(=O)NCc3cc(OC)ccc3O)nc2)c1 813489125 PLQIFQGMKHTPTM-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](NCc2ccccc2)C(F)(F)F)c1 816752393 BFFVKNSPTBFSRL-INIZCTEOSA-N 431.436 2.214 10 20 IECD CN(CC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C1=NS(=O)(=O)c2ccccc21 914480959 LSSMQMHRLPSRJS-UHFFFAOYSA-N 426.542 2.325 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 915269445 ZSXFRZDNIRGVIT-MRXNPFEDSA-N 425.528 2.166 10 20 IECD O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)OCC(=O)c1ccc(O)c(O)c1 916601134 BOZUSZKHIMXODQ-UHFFFAOYSA-N 448.280 2.499 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCCN3C(=O)NC(C)(C)C3=O)cc2F)C[C@H](C)O1 917708337 AKTCUTLUWAHAPM-GJZGRUSLSA-N 434.512 2.166 10 20 IECD CCc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)no1 1779697379 DFOJRVNZFDAJGE-FQEVSTJZSA-N 435.864 2.059 10 20 IECD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)c(C)n1C 1779928303 ITQFJAZQSPDYDM-QFIPXVFZSA-N 447.919 2.464 10 20 IECD O=C(CCc1ccc[nH]1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002572 UHKXKTLXLNJHBX-NRFANRHFSA-N 433.892 2.156 10 20 IECD CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1O 1800693514 QHKMAFLCNDZKTB-QDMKHBRRSA-N 427.457 2.163 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H](O)c1ccccc1 1804285057 BWBGYSGNUULUMP-JEWCPBCISA-N 438.480 2.188 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804649672 ALUBCELFEWMEBS-UHFFFAOYSA-N 430.417 2.153 10 20 IECD CN(C)CC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811798613 SCMLMJVRNJTLLB-KUHUBIRLSA-N 432.908 2.027 10 20 IECD O=C(COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O)NC(=O)NC1CC1 10732231 PIBJLYIELWNNQM-UHFFFAOYSA-N 426.812 2.260 10 20 IECD CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 729525194 GJRCTTAMJXNPNM-MJGOQNOKSA-N 431.581 2.127 10 20 IECD CC(C)(C)NC(=O)CNC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036751 OZZVGZMFNRUZRQ-UHFFFAOYSA-N 432.565 2.495 10 20 IECD CCn1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1=O 737173455 HCLOGJYRZXRUSP-UHFFFAOYSA-N 434.443 2.193 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccccc3N3CCOC3=O)CC2)cc1 737174009 KKXHVQOMQXWIRE-UHFFFAOYSA-N 438.484 2.376 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)c3c(F)cccc3F)CC2)cc1 740909954 MDITUPMVCSGUBM-HXUWFJFHSA-N 434.487 2.128 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3OC)c2)cc1 743253660 FTAVZTJTZJWMRA-UHFFFAOYSA-N 436.515 2.443 10 20 IECD CCS(=O)(=O)c1ccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 745838965 RIKWDTDYIZITHS-UHFFFAOYSA-N 445.585 2.431 10 20 IECD NC(=O)CCCOC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 747793246 KCKSEQXPCXJJBK-WQLSENKSSA-N 443.344 2.459 10 20 IECD Cc1c(NC(=O)C(=O)NCCCSc2nccs2)cccc1C(=O)N1CCOCC1 749731555 SKZSWRNWCQDPLL-UHFFFAOYSA-N 448.570 2.161 10 20 IECD O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)cc1 754159053 LDXQJHRQBVXXTI-UHFFFAOYSA-N 432.502 2.468 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(NC(=O)C4CC4)c3)CC2)cc1F 754214546 MTJQESYYYPUQPH-UHFFFAOYSA-N 440.475 2.470 10 20 IECD CC(C)c1nnc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1C 758593123 AQBDMQFYGGSESH-UHFFFAOYSA-N 435.531 2.436 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(F)cc(Cl)c3)CC2)cc1 764254855 SPBANHUNXWRCGD-UHFFFAOYSA-N 434.899 2.365 10 20 IECD C[C@@H]1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cc(Br)ccc2O1 767312184 QBTDXSPVTXNKRL-LLVKDONJSA-N 438.303 2.061 10 20 IECD O=C(NC1CC1)[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769702211 UPCDLEBNDUAVQX-OAHLLOKOSA-N 435.527 2.138 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCc3cccc(Cl)c3)CC2)cc(OC)c1OC 774554762 YLCYCQADYGEZPS-UHFFFAOYSA-N 447.919 2.331 10 20 IECD CCCOc1ccc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 778259809 CIFLTADPHJFYNX-LUAWRHEFSA-N 438.528 2.400 10 20 IECD COC(=O)[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 778320327 YAYCVJNEJGJEEC-MDRMPYQZSA-N 443.544 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4cccc(C)c4n3C)CC2)cc1 778348246 ROWRQCAJXJXHRR-VAWYXSNFSA-N 447.539 2.412 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN(C)Cc3ccccc3)CC2)cc1 785529821 YOFUCPCIXCHBJQ-UHFFFAOYSA-N 438.572 2.419 10 20 IECD COc1cc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccn1 786583081 LTWOOMIPVCVZII-OAHLLOKOSA-N 434.443 2.093 10 20 IECD CN(CCOc1ccccc1Cl)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313023 NWTHIHCYIAGYCI-UHFFFAOYSA-N 431.920 2.330 10 20 IECD COC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1OC 790140787 YAYBRLQYZYLSTM-GOSISDBHSA-N 430.501 2.052 10 20 IECD C[C@H](N[C@H](C)c1nnnn1C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792474220 PJEKHBZMBVEVIX-OLZOCXBDSA-N 430.468 2.461 10 20 IECD O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NCc1c(O)ccc2c1CCCC2 799673828 PSFUDXDQCZUMQL-UHFFFAOYSA-N 439.484 2.327 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1F 802575526 RMZMZMPEZDIFQR-UHFFFAOYSA-N 443.200 2.474 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(OC(F)F)cn1)c1ccc(N2CCOCC2)cc1 803301678 WFWDAYMQWDZEEE-AWEZNQCLSA-N 434.443 2.013 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(N2CCOCC2)cc1 803308773 JSLAYSOCSDMORU-MRXNPFEDSA-N 428.508 2.222 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCC[C@@H]1CCO 803451723 UNYUMMABIHYASY-KDOFPFPSSA-N 425.476 2.040 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1nccs1 805007881 TVLGKDLDLFHWKI-QGZVFWFLSA-N 433.553 2.308 10 20 IECD CCc1ccc([C@@H](O)CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 805013974 LSXIXLHPXLONAT-QHCPKHFHSA-N 426.561 2.412 10 20 IECD CC[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 807166107 BQKDJYCJFOEAOS-DLBZAZTESA-N 433.549 2.446 10 20 IECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc21 807387101 ZHXXKJJJYUVYHE-UHFFFAOYSA-N 447.289 2.406 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCC2(CCOCC2)C1 807771532 VNEPELWSJNOKAH-MRXNPFEDSA-N 437.487 2.402 10 20 IECD C[C@H]1c2nncn2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807952333 LGATZCIXWIBJES-CABCVRRESA-N 430.940 2.387 10 20 IECD NC(=O)COc1ccccc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916457614 IONPRMLJJSXOGZ-UHFFFAOYSA-N 437.418 2.336 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cc(F)ccc4OC)CC3)nc12 917047355 CBABFFVCWVIRTE-UHFFFAOYSA-N 443.479 2.077 10 20 IECD Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(C)c12 917708697 NTKXRPVYHVQXBT-UHFFFAOYSA-N 441.507 2.103 10 20 IECD Cc1nc(C)c(-c2csc(NS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)n2)s1 917902864 WDBLJXHCGYSEOZ-UHFFFAOYSA-N 430.558 2.332 10 20 IECD CNC(=O)COc1cccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918095927 KITWNHKBPKHNJM-HXUWFJFHSA-N 427.501 2.408 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918438364 NEELTTPRPVZBTG-UHFFFAOYSA-N 445.491 2.067 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(CCNC(C)=O)s3)CC2)cc1 918728950 TZAIMLZMNVWTSA-UHFFFAOYSA-N 437.587 2.336 10 20 IECD Cc1nn(C)c(C)c1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918929187 WSWJSDQQEWUJAE-OKILXGFUSA-N 432.496 2.263 10 20 IECD CC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n(C)c1 919028235 NRZIKKLJNLQNFH-HUUCEWRRSA-N 445.491 2.454 10 20 IECD C[C@@H](Oc1ccccc1F)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919069458 GSRFBTYVEFGZND-OAHLLOKOSA-N 434.439 2.428 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919970527 ISMYBWIIIRDHSI-UHFFFAOYSA-N 449.548 2.323 10 20 IECD C[C@@H](NC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 920882078 MECXVMYOWUXLEX-OAHLLOKOSA-N 435.521 2.404 10 20 IECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920925874 MCUMRANXZPFIMG-INIZCTEOSA-N 445.541 2.133 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCC(=O)N[C@@H](C)c3ccc(F)cc3)CC2)cc1 1320365068 GMWOFHGHHUJPQP-SFHVURJKSA-N 442.535 2.340 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)Cn4c(cc5ccccc54)C3=O)CC2)cc1 1341406719 KXTHDWWHSBDEDX-UHFFFAOYSA-N 446.507 2.371 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)C3CCSCC3)C2)C1 1785636349 DPBIAMIZIHCNSV-FQEVSTJZSA-N 440.949 2.338 10 20 IECD Cc1nc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)o1 1788921861 ZCMPKQFFKDEABZ-JDFRZJQESA-N 449.891 2.263 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(C(F)(F)F)nc1 1796599470 MZRRBFVSJDCEMO-BTTYYORXSA-N 436.390 2.472 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H]1CCc2ccccc2[C@@H]1O 1796601116 VPVXIJILJAWHLK-UGPLMPIKSA-N 437.496 2.041 10 20 IECD CC(C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804081847 YRGVIEAXGVOVQY-FOIQADDNSA-N 428.489 2.023 10 20 IECD O=C(CC[C@H]1CCOC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291954 ZXPGBIHFEXCGOL-OCJHLRLVSA-N 430.501 2.272 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)[C@H]1C[C@H]1F 1807848737 ORXUOJBLVQGREL-XKUHRKSTSA-N 441.459 2.276 10 20 IECD CN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843597 SFFXFRAETWVYDU-HZPDHXFCSA-N 428.493 2.006 10 20 IECD O=C1CC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1832818854 PFKFBEJIXVYKGL-XZXOBPBMSA-N 442.512 2.415 10 20 IECD Cc1c(F)ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1N 1842989129 UPXZVIHLGLSDGF-UHFFFAOYSA-N 449.486 2.326 10 20 IECD CCN(CC)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1845838529 AXXQOECCGHJJOM-OAQYLSRUSA-N 438.528 2.393 10 20 IECD O=C(c1cc2ncsc2[nH]1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038848 SARVEYDIVMQLMY-HWKANZROSA-N 440.481 2.272 10 20 IECD Cc1cccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1Cl 1847056710 YUXRPBHBYZBFNA-UHFFFAOYSA-N 437.974 2.326 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)n(C)c2ccccc12 573636659 QASSLQOKSABBSP-RTBURBONSA-N 439.604 2.120 10 20 IECD Cc1cc(C(=O)CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C)n1-c1cccc(F)c1 727297384 JWBCDGCYTMXWAJ-FQEVSTJZSA-N 433.549 2.221 10 20 IECD COc1cccc(CNC(=O)c2cncc(C(=O)NCc3cccc(OC)c3O)c2)c1O 729859372 NIMYLNBJTPCUSB-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CN(C)c1ccc(CNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1F 733351197 UFGNRKJTALYESZ-UHFFFAOYSA-N 433.572 2.415 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 734557591 IEHZEWROGLYNHY-FQEVSTJZSA-N 431.558 2.448 10 20 IECD O=C(Cc1csc(-c2ccoc2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 737807945 QUTAZYFNWDTWTL-UHFFFAOYSA-N 431.539 2.497 10 20 IECD Cn1c(=O)nc(O)c2cc(S(=O)(=O)Nc3nc(-c4ccccc4F)cs3)cnc21 740758398 HLBQWYNIKILRKW-UHFFFAOYSA-N 433.446 2.098 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] 743340671 LSUPSACSCZXATL-UHFFFAOYSA-N 434.518 2.318 10 20 IECD C[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 749125493 HJAKAJSLERBTAZ-XLIONFOSSA-N 444.601 2.489 10 20 IECD O=C(NCCOC[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067851 BZTWKNFETIBBCJ-CYBMUJFWSA-N 426.516 2.037 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 754180281 SYERWSSBBVMIGX-NRFANRHFSA-N 441.503 2.083 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3CC(=O)c3ccccc3)CC2)cc1 757640449 VVHHZVOSCJVRBW-JOCHJYFZSA-N 437.540 2.318 10 20 IECD COc1cc(N2CCN(C(=O)NCc3ccc4c(c3)OCO4)CC2)cc(OC)c1OC 758830129 OEQNASFNFVNSEJ-UHFFFAOYSA-N 429.473 2.473 10 20 IECD C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1 764444889 XDGCHZRZHZXMJO-CABCVRRESA-N 431.505 2.333 10 20 IECD COc1cc(N2CCN(c3cc(N4CCCC[C@H]4CO)ncn3)CC2)cc(OC)c1OC 764883506 DTXDWQXVKWYHTJ-KRWDZBQOSA-N 443.548 2.180 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)NC(=O)c4ccoc4)n3)CC2)cc1 771064505 DDNCMFRYFQRRIZ-HNNXBMFYSA-N 439.472 2.054 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@H]3C(=O)Nc4ccccc43)CC2)cc1 778222186 VNJCUQPLALRJOF-ZJVMWOEPSA-N 448.523 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccccc3[N+](=O)[O-])CC2)cc1 778288156 HEPAQRXTLJSJMZ-KHPPLWFESA-N 438.484 2.167 10 20 IECD COC(=O)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1F 778342040 AMKKHUWYGCGHTH-KTKRTIGZSA-N 441.459 2.464 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2ccccc2C1 787633986 XSQLEPOBWVKMLW-HXUWFJFHSA-N 426.536 2.461 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)c1 788317946 BOHKGTQMXAWQDN-UHFFFAOYSA-N 431.920 2.160 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(Cl)c(OC)c3)CC2)cc1 789406368 YSNOTKCMBRAZKN-UHFFFAOYSA-N 446.935 2.234 10 20 IECD CC(C)N1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789824581 JJMWUTRITCUIPH-QWFCFKBJSA-N 448.583 2.292 10 20 IECD Cc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832556 AHHLAEZKPAYSDI-UHFFFAOYSA-N 443.519 2.297 10 20 IECD COc1cc(Cl)ccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840152 FPHXWIMIVBVCAL-UHFFFAOYSA-N 449.910 2.381 10 20 IECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)CC2 789860686 MYJFGBYKIOTQOP-LJQANCHMSA-N 441.601 2.307 10 20 IECD C[C@H]1OCC[C@@]12CN(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCO2 792542104 VJPVLIVYPXLRJY-BFUOFWGJSA-N 438.527 2.275 10 20 IECD O=C(NCc1cccc2c1OCCCO2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793750278 UPMSNJLZGQXKKG-LJQANCHMSA-N 440.496 2.378 10 20 IECD O=C(NCc1cccc(Cn2cccn2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793810124 JFCPHOPCIWAXDC-QFIPXVFZSA-N 448.523 2.461 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)NC)cc2C)cc1F 796808745 NPRQTZNDKIIJBC-UHFFFAOYSA-N 444.507 2.360 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803299836 OEKLNXQEKCIDPA-NMNUPHIUSA-N 436.556 2.262 10 20 IECD Cc1nn(C)cc1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 805085047 FFEIOURQNAJQOF-QGZVFWFLSA-N 437.566 2.339 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)C2CC2)cc1 807173316 ZTYSRYGQDSHOEU-UHFFFAOYSA-N 436.472 2.345 10 20 IECD C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288866 AVZKSKZHSYSMLF-IEBWSBKVSA-N 442.560 2.441 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(OC)c(S(N)(=O)=O)c2)cc1F 808268707 XBWOCSLKWHEPAN-UHFFFAOYSA-N 438.525 2.327 10 20 IECD O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 808344213 QYENRWUGVDPPEV-IRLDBZIGSA-N 441.528 2.008 10 20 IECD O=C(COC(=O)c1cnc2[nH]c(O)nc2c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808638142 KFSYVGYPOAHLAG-UHFFFAOYSA-N 442.387 2.234 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)cc1 915313593 XDZSJYWKJAFMPN-UHFFFAOYSA-N 446.573 2.433 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccc(F)cc3)cc2)C1 919817310 VEQXHBREWISEPP-IBGZPJMESA-N 440.519 2.354 10 20 IECD COC(=O)N1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 1116219913 PZGWUPZEBKJDMK-UHFFFAOYSA-N 439.515 2.169 10 20 IECD C[C@]1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CC=CCC1 1777851962 VQGHVDQUGHRJRO-MQNAVGNWSA-N 429.517 2.367 10 20 IECD Cc1cc(Cl)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787291838 HGHIBRKDLYSLOW-KKXDTOCCSA-N 445.903 2.362 10 20 IECD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1795033050 NRCMTTMHVMFIBZ-GGPHIMKMSA-N 431.496 2.435 10 20 IECD COCc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1797168206 LOWXWAOJRFUWLF-CLLJXQQHSA-N 435.864 2.451 10 20 IECD NC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1 1803493435 FNGBHNJDZOXVJV-MUJYYYPQSA-N 443.887 2.416 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncc(F)cc1F)CC2)c1cc(O)nc(O)c1 1816720047 DKZKYUPATQLHGO-SNVBAGLBSA-N 447.423 2.162 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1 1824854062 JTOGIUBJCYIYSL-GSQGTZRGSA-N 433.461 2.387 10 20 IECD CCc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cn1 1843441253 HMICCCZGISHTGH-UHFFFAOYSA-N 431.496 2.254 10 20 IECD CO[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)c1ccccc1 1843441758 CWHLLKNHMUWSDE-JOCHJYFZSA-N 446.507 2.370 10 20 IECD Cc1c(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nc2ccccn12 1847037718 RWEWUJZCLVWNCM-VQHVLOKHSA-N 448.479 2.290 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccco4)C3)cc2F)CC1 303292438 LDNZKPQHCWKBDQ-SFHVURJKSA-N 428.508 2.226 10 20 IECD O=C1C[C@H](N(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C2CC2)C(=O)N1 726942371 DYPLKSBMGHADQE-GFAPJHNFSA-N 449.579 2.136 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cc2F)CC1 730391274 LLASHEASRNPIIM-UHFFFAOYSA-N 443.479 2.439 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C 737116619 GUOFISQEAUUYPU-UHFFFAOYSA-N 432.546 2.004 10 20 IECD COc1ccc(C[C@H](CO)CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1O 745778359 BCZQQTRKVAERIQ-HKUYNNGSSA-N 443.544 2.449 10 20 IECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)c2)CC1 751128096 WEKQOGIMTDWQPY-UHFFFAOYSA-N 426.498 2.031 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCN(c4ccccn4)C3)CC2)cc1 753126798 LXJICLYVHXDSPE-HXUWFJFHSA-N 438.576 2.180 10 20 IECD CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 755329700 ZOIBKIFPGVWWTA-SCLBCKFNSA-N 449.485 2.334 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3Cc4ccccc4C(=O)O3)CC2)cc(OC)c1OC 759240483 YCAXIWMBQUGRGZ-FQEVSTJZSA-N 426.469 2.143 10 20 IECD C[C@@H](CO)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 759303757 MVEADUKDRKZVOB-QGZVFWFLSA-N 430.528 2.150 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](S(C)(=O)=O)C1 763913846 BPUJPKBMONTQFC-GJZGRUSLSA-N 440.521 2.298 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc4c(c3)ncn4C)CC2)cc1 772920003 XYTRTJMCIHVMGW-UHFFFAOYSA-N 443.573 2.073 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CCC(=O)N4C)CC2)cc1 778261203 BBYMLZZGOPUINS-ZRDIBKRKSA-N 448.523 2.448 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)[C@H](C)C3)cc2F)C[C@@H](C)O1 780313050 UWSWFKYXRLSKPY-KURKYZTESA-N 436.572 2.426 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3[C@@H]3CCCC3=O)cc2F)C[C@@H](C)O1 784355116 DNNKCRUXMXDLIA-KZFRKFNSSA-N 447.551 2.126 10 20 IECD O=C(OCCn1ccc([N+](=O)[O-])n1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785414423 WSFLLRBUHIHZKN-UHFFFAOYSA-N 438.443 2.216 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccccc1CN1CCOCC1 785444317 SBLDWSFRWOZLHF-UHFFFAOYSA-N 438.572 2.250 10 20 IECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ncnn1CC(F)F 786216676 LSYITWSZHHCULQ-UHFFFAOYSA-N 439.422 2.389 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](NC(N)=O)c3cccc(C)c3)cc2)CC1 786258741 GVEQDSZPHRLJOF-QFIPXVFZSA-N 437.544 2.079 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1=O 788932306 JVSRYNOTILSAIU-JOCHJYFZSA-N 434.540 2.163 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 789848069 YJKMLVVWIYQHIM-JAXLGGSGSA-N 442.629 2.189 10 20 IECD CC(C)(C)n1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nn1 790488550 SMGYIGSNLLROSF-UHFFFAOYSA-N 438.511 2.219 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)NCCOC)c3)c2)CC1 795570066 CKWMWRDKLJJYPU-UHFFFAOYSA-N 446.573 2.006 10 20 IECD C[C@](O)(CCc1ccccc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 801491038 DRTYSHSEFXPMJL-DEOSSOPVSA-N 444.503 2.206 10 20 IECD CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCO1 802681436 CJCQILFXHNIQHF-HXUWFJFHSA-N 442.564 2.068 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 803400568 GNLZQBCCLVTBRW-JOCHJYFZSA-N 442.535 2.006 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)cc1F 804851551 GFWFYMBQQIAFIM-WWTSWKCXSA-N 425.570 2.484 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(NC(C)=O)s2)cc1 808094512 RKRJONLIUHPFPN-UHFFFAOYSA-N 432.549 2.444 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 808295162 OYCHROLPXRDAPM-UHFFFAOYSA-N 449.548 2.357 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 810368744 FYIIOQJDVFMNIY-IBGZPJMESA-N 446.525 2.081 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)cc1 906378831 YXDKQTRCTYNLQZ-UHFFFAOYSA-N 437.524 2.411 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccc(N2CCOCC2)nc1 917999578 UYWWENIHAFLDHX-UHFFFAOYSA-N 439.560 2.126 10 20 IECD COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918017765 GEQJEXJMPITMMO-INIZCTEOSA-N 441.488 2.305 10 20 IECD CS(=O)(=O)CCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 919887745 QKYJNQXCZUJWHV-QBFSEMIESA-N 432.614 2.280 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1C[C@H]1F 1780633694 NYIHHWXNWCDGFZ-WMHAJJRKSA-N 426.872 2.237 10 20 IECD CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007292 OUOSUGDWHQKCMG-ZUOKHONESA-N 426.897 2.008 10 20 IECD Cc1c(F)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1792758727 DOUCCERDYRSPPX-BTTYYORXSA-N 435.546 2.246 10 20 IECD Cc1cnn([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1802923616 BTHOVOZFJKXHPD-IZBJGVDFSA-N 448.527 2.184 10 20 IECD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1ccccn1 1816728487 QMEISJLWTMKGPP-DGCLKSJQSA-N 439.497 2.374 10 20 IECD Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1817469484 QKRFDIBYVIKRDK-GFCCVEGCSA-N 425.470 2.192 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)C2(F)CCC2)CC1 1832507198 MBRPCLWKYMXKOZ-OAHLLOKOSA-N 441.594 2.359 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CNC(=O)N(C)C)C3)cc1 1845397776 QUTMLUZGIUSLJX-UHFFFAOYSA-N 437.544 2.182 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2nc3n(c2=O)CCCCC3)cc1 105956291 OKCBXWAMDZJWHX-FQEVSTJZSA-N 427.549 2.045 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)CC2)cc1 110355356 ZSNZYDBOQLVCMO-UHFFFAOYSA-N 429.542 2.416 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1 725824547 XDACCERDLKGBGC-UHFFFAOYSA-N 437.587 2.452 10 20 IECD COC(=O)C[C@H]1C(=O)NCCN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 727230042 MCGJMCMQVDHXNY-SFHVURJKSA-N 449.454 2.242 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)c1 728983364 YQSOVEPWEZKUME-KRWDZBQOSA-N 447.557 2.038 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(C(=O)OC)c3)cc2F)CC1 730269084 NNPKXQKEQNAUOP-UHFFFAOYSA-N 435.521 2.233 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(F)c(F)c3F)CC2)cc1 732923053 KDUIEXDJGLUIGD-UHFFFAOYSA-N 429.464 2.213 10 20 IECD Cc1cc(C(=O)COC(=O)CN2C(=O)C(=O)N(C)C2=O)c(C)n1-c1ccc(C(C)C)cc1 733571210 NYFJCZLUAAHGKM-UHFFFAOYSA-N 439.468 2.364 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)c1 734072533 FRVVJHLCIXLWFJ-UHFFFAOYSA-N 443.525 2.153 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)Cc3cccc4cccnc34)CC2)cc1 735500899 NLHGRKFLIRDNDM-UHFFFAOYSA-N 440.569 2.485 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccccc1N1CCOC1=O)c1ccc(N2CCOCC2)cc1 737158185 OJZWFGCXRHLPLS-MRXNPFEDSA-N 438.484 2.296 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)NC4CC4)c3)c2)CC1 739768659 VNTSUQFWHCUFBU-UHFFFAOYSA-N 442.541 2.081 10 20 IECD CCC(CC)[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCOCC1 742049898 HMACMLJIYPPRFL-IFMALSPDSA-N 430.593 2.142 10 20 IECD COc1ccc(N(CC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)C(C)C)cc1F 744394059 YGKVLXRYKDNQNM-ROUUACIJSA-N 442.553 2.244 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 746497451 NYQSKLYJQFQDNC-UHFFFAOYSA-N 425.489 2.208 10 20 IECD COC(=O)c1ccsc1N1CC[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)C1=O 746753716 HIXFVGUXHKYAPW-HNNXBMFYSA-N 434.493 2.345 10 20 IECD C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 747301920 OBRKXVWINIYGAB-PXNSSMCTSA-N 438.528 2.319 10 20 IECD Cc1nc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cn1C 747709960 SOWSLBGJEWSJOD-UHFFFAOYSA-N 445.589 2.046 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C[C@H]2CCOC2)CC1 749852442 FYJQANBGLYTLNW-ZWKOTPCHSA-N 447.535 2.443 10 20 IECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 751239527 KNFIOGADTPMNQA-UHFFFAOYSA-N 449.573 2.495 10 20 IECD O=C(CN1CCO[C@@]2(CCc3ccccc32)C1)NCc1ccc(N2CCOCC2)c(F)c1 753271734 BULOLXJGDAHACP-VWLOTQADSA-N 439.531 2.452 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)CSc2nncn2C)c1 753637403 VMNLEAWZRSQKJD-CYBMUJFWSA-N 441.513 2.318 10 20 IECD COc1ccc(N2CCN(C(=O)CC[S@@](=O)c3ccc4c(c3)OCCO4)CC2)cc1F 753739467 STRZRBGDHZMMJJ-WJOKGBTCSA-N 448.516 2.452 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@H](c4ccccc4F)C3)CC2)cc1 754030178 LWXHEQSGJHHVDV-RDPSFJRHSA-N 429.536 2.391 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(N4CCCC4=O)cc3)CC2)cc1F 754045122 IHFLETKDRAXUOX-UHFFFAOYSA-N 433.505 2.472 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(Nc4ccccn4)CC3)CC2)cc1 754081712 NZNRUJBQLUOOJF-JOCHJYFZSA-N 425.577 2.150 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC3CCN(Cc4ccccc4)CC3)CC2)cc1 758184948 GRSWYYSDWIQHJA-RUZDIDTESA-N 438.616 2.432 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc4sc(C)c(C)c4c3=O)CC2)cc1 758196433 ZJFYKCYROFELFD-GOSISDBHSA-N 428.558 2.267 10 20 IECD O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 758536068 LTUXENROOWFPRJ-UHFFFAOYSA-N 442.497 2.170 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cc(C(N)=O)ccc3C)CC2)cc(OC)c1OC 759963357 RABCUSSCNHJGJV-UHFFFAOYSA-N 428.489 2.474 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3cnc4c(c3=O)CCCC4)cc2F)C[C@@H](C)O1 760330003 VPXGHVRVHUTAKS-HZPDHXFCSA-N 428.508 2.191 10 20 IECD COC(=O)CC1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCOCC1 761188517 NVTFVIOVXXBZJU-UHFFFAOYSA-N 436.464 2.102 10 20 IECD C[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(=O)(=O)C1CCOCC1 765687627 VALBFXXDVZQDEF-GJZGRUSLSA-N 446.516 2.355 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnn1C1CCOCC1 766818000 VVSAAHAAFBXMNM-SFHVURJKSA-N 425.533 2.175 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1 774751448 MSBDGTZUBQEILT-QGZVFWFLSA-N 449.598 2.229 10 20 IECD C[C@@H](NC(=O)N1CCOC[C@H]1c1noc(-c2cnn(C)c2)n1)c1ccc(N(C)C)cc1 776237223 FSKNHFIOZSZNOQ-KDOFPFPSSA-N 425.493 2.380 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 778637295 HKIIBNYTVIHMQW-UHFFFAOYSA-N 426.466 2.287 10 20 IECD CNC(=O)[C@@H]1CN(C(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)c2ccccc2O1 784109550 VMXIPBRFTGUPAZ-NRFANRHFSA-N 436.512 2.332 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(Cl)nc3C)CC2)cc1 789357343 LYCIIJGLCHPEBQ-UHFFFAOYSA-N 445.951 2.319 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](c4ncc[nH]4)C3)cc2F)C[C@@H](C)O1 789820923 QWPKZCPPLJETIC-NUJGCVRESA-N 443.523 2.185 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2F)C[C@@H](C)O1 789821532 TVWXRLLMPZNZCC-NROPHMHMSA-N 445.535 2.129 10 20 IECD CCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789953631 FRTSBWUXMWLVTO-KRWDZBQOSA-N 443.466 2.186 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 793135160 JRDZIPAHPWDCTE-QFIPXVFZSA-N 430.549 2.105 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCN3CCOC(C)(C)C3)cc2)CC1 805025590 QRVWDLBUODLUPP-UHFFFAOYSA-N 430.593 2.108 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1 807099595 AIDSYCAWSCPDBJ-OALUTQOASA-N 431.558 2.090 10 20 IECD Cc1cnn([C@@H]2CCN(CC(=O)c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C2)c1 810120413 CBKFBRAFNYBBEK-LJQANCHMSA-N 441.557 2.376 10 20 IECD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NCc2ccc(N3CCOCC3)cc2)c1C 810192061 CYQZCQLDNSMARC-UHFFFAOYSA-N 445.585 2.352 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCc3nnn(C)c3C2)NC(=O)OC(C)(C)C)cc1 810448167 WJHCIFLOVCCNID-LPHOPBHVSA-N 442.564 2.368 10 20 IECD CN(Cc1cc(Br)cc(Br)c1O)[C@H]1CCN(S(C)(=O)=O)C1 814171195 JINQQBWQFRQDPY-NSHDSACASA-N 442.173 2.383 10 20 IECD COc1ccc(N2CCCN(CC(=O)Nc3ccccc3SCC(N)=O)CC2)cc1 917089938 PVKBDVBJFKJVIL-UHFFFAOYSA-N 428.558 2.423 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)c(F)c3)cc2)C1 918462613 DDCOTHOWJHAWII-AWEZNQCLSA-N 432.883 2.436 10 20 IECD CN1CCN(Cc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2)CC1 919971731 UXCCJQWDHUKPLV-UHFFFAOYSA-N 440.563 2.464 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)NCC(F)(F)F 1337686459 UTXRQRSUMUPRDK-UPJWGTAASA-N 434.434 2.306 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cnccn3)cc2)CCC1 1787293024 HVAOMQDKMTTXNF-UHFFFAOYSA-N 441.538 2.085 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(C)c1 1799599631 PTOVTNKWUFEOKO-MUJYYYPQSA-N 431.583 2.416 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ncccn3)C2)CC1 1808493486 MAUDWBRPALXNKW-UHFFFAOYSA-N 446.511 2.114 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(Cl)nn1 1819685923 GTIPOCURMPEMPO-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD C[C@](O)(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1824832014 JTICGBWUJQISCY-LIRRHRJNSA-N 445.438 2.039 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3CCOCC3)C2)cc1 1842825941 LAZVRWGEQOVYEQ-UHFFFAOYSA-N 436.556 2.243 10 20 IECD O=C(c1cc2ccc(Cl)cc2nn1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249863 JHVQSEGQDSVJOW-UHFFFAOYSA-N 439.859 2.220 10 20 IECD COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 18195220 ZNYPWJDESAJUNU-GOSISDBHSA-N 437.448 2.323 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 109040091 IAOFYNBKHOXOHU-UHFFFAOYSA-N 433.486 2.107 10 20 IECD CN(CCN1CCOCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729594323 OLLDLTGSWPOHAX-UHFFFAOYSA-N 430.471 2.016 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)ccc3F)cc2F)C[C@@H](C)O1 733369982 YFPJOPNCZGGTFD-BETUJISGSA-N 439.484 2.156 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)c1 734072646 LPMGYLHLCYVEGH-UHFFFAOYSA-N 439.390 2.256 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](c4nncn4C(C)C)C3)CC2)cc1 735872591 MHENOSJBQHSHRP-IBGZPJMESA-N 426.565 2.396 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1cccc(C(F)F)c1 737244880 CTAXGJQODSEPAJ-UHFFFAOYSA-N 437.468 2.114 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(CCN2CCOCC2)cc1 741097128 BUDWMPFYFJOQMV-UHFFFAOYSA-N 434.540 2.192 10 20 IECD CN(c1ccc(CNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1)C1CCCCC1 742416215 OLWVWUMHGJTWQS-GHTZIAJQSA-N 447.601 2.107 10 20 IECD CS(=O)(=O)N1CCCC[C@@H]1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805189 IDNHRYKYJSCYFD-WMLDXEAASA-N 431.505 2.187 10 20 IECD Cc1nsc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 743553387 JVLGJZSUBMMTJF-UHFFFAOYSA-N 434.541 2.244 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(c2cnn(C)c2)CC1 746670119 XGWMZZMFSKSUBH-INIZCTEOSA-N 443.507 2.345 10 20 IECD COC(=O)c1cc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1C 751358110 ANFGHXHUICDEBG-HNNXBMFYSA-N 441.937 2.114 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 754234537 OTXHNTIUDXZUIM-NOZRDPDXSA-N 425.573 2.122 10 20 IECD C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nnc2ccccn12 754583353 LCVJKEHDZAFVGC-ZACQAIPSSA-N 440.523 2.449 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccn(-c2ncccc2F)n1 758969611 OHCPBHYYOCVAQV-UHFFFAOYSA-N 440.504 2.215 10 20 IECD COc1cc(N2CCN(C(=O)CSc3nncn3C(C)C)CC2)cc(OC)c1OC 759222910 MODXSWQPKJQGJR-UHFFFAOYSA-N 435.550 2.326 10 20 IECD CCOCCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccccc2C)c1C 767375556 FLNRIPPSMBAWKD-UHFFFAOYSA-N 436.530 2.084 10 20 IECD Cc1nn(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1-c1ccccc1 767662837 JCPBEICCUCEOPO-UHFFFAOYSA-N 438.553 2.410 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3cc(O)nc(OC)n3)c2C)cc1 770518702 QHOFMRNBVSNWDL-UHFFFAOYSA-N 439.424 2.425 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCc1cn(CC(=O)OC)nn1 772839296 TWUNJOMMENGEBI-UHFFFAOYSA-N 429.502 2.441 10 20 IECD CCNC(=O)c1cccc(C)c1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772883689 KVGWUPFSNXZXSS-UHFFFAOYSA-N 429.492 2.416 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3cc(OC)c(OC)c(OC)c3)nc12 774964332 UYGZJBPPORMICV-GFCCVEGCSA-N 430.461 2.488 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc(N4CCOC4=O)cc3)nc12 775263533 TXFDWMOBOUAPHG-ZDUSSCGKSA-N 425.445 2.419 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)C[C@H](O)c3ccco3)CC2)cc1 778326350 NZVMMCQYGUUIIE-IAJJCYPOSA-N 427.501 2.121 10 20 IECD CCCNC(=O)[C@@H]1CN(C(=O)C(=O)N(CCC)Cc2ccccc2O)c2ccccc2O1 784023325 BFLSPLQKVCBMJT-NRFANRHFSA-N 439.512 2.451 10 20 IECD O=C(NCCSCc1ccccc1F)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785415810 PWDAPSGEFLAWGY-UHFFFAOYSA-N 449.523 2.467 10 20 IECD CCOC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1C 787320464 VQHPLQPUFZZHKL-UHFFFAOYSA-N 426.517 2.407 10 20 IECD CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccccc1OCC(=O)NC 788071663 YXUDSVFYOLDDDD-FQEVSTJZSA-N 440.544 2.103 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)NCCCSc2nccs2)N2CCOCC2)cc1 793739409 BAYBTMHTFSKPTF-GOSISDBHSA-N 448.614 2.240 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 803132669 LOKQIUYFOGECHQ-KRWDZBQOSA-N 432.565 2.441 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1 803648217 VVBDTPQLPOUVQY-HSZRJFAPSA-N 432.568 2.360 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCC[C@H](C(C)C)C3)CC2)cc1 803751760 WLJFVLIIIOWESD-PMACEKPBSA-N 430.593 2.264 10 20 IECD CC(=O)NCC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 805825074 JHLXIOLEZRARAF-BJLQDIEVSA-N 448.583 2.294 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc1 807101454 LUAPBCRILDJZKB-FQEVSTJZSA-N 430.593 2.108 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@@H](C)S1 808855996 NIBMBVVACRKINO-HDICACEKSA-N 430.618 2.187 10 20 IECD O=C(NCCCN1CCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913640602 BRHWVWKDELXZSR-UHFFFAOYSA-N 448.501 2.317 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 917145357 YROYNPDIIPBESN-UHFFFAOYSA-N 443.500 2.260 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1C 917758247 MYFIOAZPTKUNTB-UHFFFAOYSA-N 429.476 2.474 10 20 IECD Cc1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934146 AEYJACPEPHSHPN-GGPHIMKMSA-N 431.496 2.435 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)N1C[C@@H]2C[C@H]2C1 1800718452 YNENQVZHHNNNFZ-SYHNYVLZSA-N 433.936 2.343 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1=CCCC1 1806221837 QOMDVRWFFMMSHV-LPHOPBHVSA-N 444.582 2.058 10 20 IECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c(C)n1C 1807994966 MBYPREZRVVQEBZ-VGOFRKELSA-N 449.511 2.477 10 20 IECD Cn1ccnc1C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1808623019 QNBLQIQNJMJHKI-UHFFFAOYSA-N 448.527 2.058 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2)[nH]n1)c1cc(O)nc(O)c1 1817845077 XJQWGJJGBVRXOY-MRXNPFEDSA-N 428.493 2.008 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848398 HHAVEALUUGUWIO-SJORKVTESA-N 442.520 2.395 10 20 IECD CN(C)C(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736345 CYDVIICIHKREPH-INIZCTEOSA-N 437.924 2.073 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)COc2ccc(F)cc2)C1 1842687929 LVWVZGVYFJNWKE-YCRREMRBSA-N 442.443 2.238 10 20 IECD O=C(Cn1nnc2ccccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848002851 SUHRWWVPTSHZMR-IRXDYDNUSA-N 441.875 2.012 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCO1 727601101 QGSNTKVJYVZUBV-QGZVFWFLSA-N 428.512 2.263 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3c(C)cc(C)nc3OC)CC2)cc1 727602641 UUHLMYKSRXIVRI-UHFFFAOYSA-N 427.549 2.337 10 20 IECD CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727993303 WQONYDDGXZSPBG-IEBWSBKVSA-N 432.590 2.096 10 20 IECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 729522962 BATPDSFJRYNAJQ-UHFFFAOYSA-N 441.507 2.103 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 731844375 FSDZNPIKAKYOQX-NRFANRHFSA-N 431.577 2.479 10 20 IECD CCCn1c(CCC(=O)NCc2cc(OC)ccc2O)nc2cc(S(N)(=O)=O)ccc21 734016972 SNFXAOUVFCIUBC-UHFFFAOYSA-N 446.529 2.057 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)c3cccc(F)c3)CC2)cc1 734655737 TXMRZAWAJWKGDI-JOCHJYFZSA-N 430.524 2.379 10 20 IECD CCC1(O)CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 743718259 MQNMSWSPMZMZRU-UHFFFAOYSA-N 449.485 2.478 10 20 IECD C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 746048833 JJPYAJRAAMVOMG-FXAWDEMLSA-N 444.601 2.489 10 20 IECD CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 750276505 JAPSQRNYCOIFJI-GPASJLMESA-N 436.622 2.196 10 20 IECD CNC(=O)C1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751060938 RKPISZIZUYKMTD-UHFFFAOYSA-N 437.543 2.289 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cnn(CC(F)(F)F)c3)CC2)cc1 763594678 LDMCCBTVSWSKAY-UHFFFAOYSA-N 440.470 2.075 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC2CCN(c3ccc(OC)cc3)CC2)c1 766064542 KZURQAHDYIPPGH-UHFFFAOYSA-N 433.574 2.379 10 20 IECD CCc1nn(C)c(Cl)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 767834492 IYPHZBKKFUJHLY-UHFFFAOYSA-N 438.887 2.085 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCOC4(CCOCC4)C3)cc2F)CC1 769102812 OJXVJTCJIVIPGP-IBGZPJMESA-N 434.556 2.495 10 20 IECD CCN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H](C)CS(C)(=O)=O 769838821 KPPCOQZEKOHNCW-GFCCVEGCSA-N 446.572 2.150 10 20 IECD O=C(NCCCSc1nccs1)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1 771554737 FKOAMFWNUBPZDE-CQSZACIVSA-N 446.554 2.332 10 20 IECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2)CN1 772474656 MSRVIFCWYOBYEO-UYAOXDASSA-N 437.496 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccccc3F)CC2)cc1 778227515 VYDZKEFXPCEFNA-ZHACJKMWSA-N 427.476 2.234 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)N3CCCC[C@H]3C)CC2)cc1 778234205 NPCJILPUEUGXGN-IWOAIWLDSA-N 428.577 2.279 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779221552 JTWSGPOEUWEKFG-XPNTWCBSSA-N 446.636 2.195 10 20 IECD CCC[C@@]1(C)C(=O)NCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782661097 HVRUSVBMIAQRDP-MFEFFIJZSA-N 434.556 2.046 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](C4(C)OCCO4)C3)CC2)cc1 784252774 WDROBVNPTGRIKB-LJQANCHMSA-N 432.565 2.002 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]c4c(F)cc(F)cc4c3=O)cc2)CC1 787322816 TYIJZHZHIGHRGD-UHFFFAOYSA-N 440.450 2.405 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O 808564441 SKXLWNKUSKYFMK-NRFANRHFSA-N 440.519 2.158 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cn2n1 810359931 YPKNYYMNHNDCHJ-UHFFFAOYSA-N 444.442 2.363 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCc2nc[nH]c2C1 929081720 UFDRQPVWIQRDET-UHFFFAOYSA-N 443.441 2.023 10 20 IECD CN1CCN(c2ccccc2CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 1318289433 IJYBGITWAUDMKT-UHFFFAOYSA-N 441.551 2.414 10 20 IECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1319687600 OFJHACSCSBFREW-UHFFFAOYSA-N 441.557 2.375 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3c3cccn3C)cc2F)C[C@@H](C)O1 1321602065 HRBGTYFYEMTBTI-PMAPCBKXSA-N 444.551 2.468 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)n[nH]1 1781122314 ZBKZARLDUBKBLV-DYESRHJHSA-N 448.907 2.224 10 20 IECD CN(C)C(=O)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc(O)c(O)c3O)CCC2)cc1 1787925168 DNWZKEILZOYCGH-VZUCSPMQSA-N 439.468 2.039 10 20 IECD CC[C@H](C)CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1803368046 HVYUFLANAHHTQR-DKICVRJWSA-N 448.614 2.384 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806234685 FOTYVCQHAOTJJT-LAUBAEHRSA-N 446.463 2.090 10 20 IECD CC(C)[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811796772 KZSLEQGMQKDKRM-ZMYBRWDISA-N 447.919 2.483 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)cn1)CC2)c1cc(O)nc(O)c1 1816722597 PVVIZOPQFLBXPX-NSHDSACASA-N 429.433 2.023 10 20 IECD Cc1ccoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818174317 JQQMYMCMXDSTJJ-ZDUSSCGKSA-N 447.542 2.477 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2O)CC1 1829176232 LUBSVXVOKLSCIW-KRWDZBQOSA-N 426.473 2.141 10 20 IECD Cc1cc(C(=O)CN2CCCC[C@@H]2C2OCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 110990492 VWSVMHBQWCFWMF-HXUWFJFHSA-N 447.557 2.152 10 20 IECD COc1ccc(N2CCC(NC(=O)CNC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 726561501 ASYHQBNETLGVIZ-UHFFFAOYSA-N 441.488 2.188 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(N4CCCS4(=O)=O)cc3)ccc21 726793440 DMCNJIWXISTHGA-UHFFFAOYSA-N 435.571 2.087 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(Br)s2)SC1=S 727177624 MITRXWSWQIYYCV-SOFGYWHQSA-N 427.392 2.261 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1-n1cnnn1 731131109 AGWHJACTXVHHFN-UHFFFAOYSA-N 433.516 2.462 10 20 IECD Cn1ccnc1[C@](O)(CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(F)(F)F 731857997 HWUJVQZBPPSARZ-HNAYVOBHSA-N 427.423 2.474 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(N2CCNC2=O)ccc1F 738692099 TZJDFDRTINDAPF-UHFFFAOYSA-N 428.464 2.237 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 742278105 DQENIPMPIAMDAG-UHFFFAOYSA-N 425.551 2.158 10 20 IECD CCO[C@@H](C)c1noc(CN(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n1 743566965 LWPXDWWLEFBFOX-KRWDZBQOSA-N 446.552 2.139 10 20 IECD CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H](C)CS(C)(=O)=O 744399356 KHATXZWEVKOUEO-CQSZACIVSA-N 428.510 2.156 10 20 IECD COCCN(CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccc(OC)c(OC)c1 746475786 YBNLVMNLFHRCAF-UHFFFAOYSA-N 445.472 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 749809972 KAVIRHVCMGPPKF-IBGZPJMESA-N 432.565 2.285 10 20 IECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753737691 IPMZIXDDPVLYPD-SFHVURJKSA-N 427.542 2.077 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)[C@H](C)N(c4ccccc4)C3=O)CC2)cc1 758192510 LPTYEPHYTWJAJQ-GHTZIAJQSA-N 438.528 2.035 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(S(C)(=O)=O)CC1 760934419 ZQGAWNKCBDXAJT-CQSZACIVSA-N 440.521 2.298 10 20 IECD CNC(=O)Cn1nc(N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 767574896 AWXSMSOPKOJOPA-AWEZNQCLSA-N 445.479 2.152 10 20 IECD CCOc1cccc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1O 768199131 BJRPOSSCBPTAGY-UHFFFAOYSA-N 435.502 2.425 10 20 IECD C[C@@H](NC(=O)c1cnn(CC(=O)NC2CCCC2)c1)c1ccc(N2CCOCC2)cc1 772071358 YKIOIYZQIRBFLY-QGZVFWFLSA-N 425.533 2.270 10 20 IECD O=C(N[C@H]1CCC[C@@H]1CCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 779354500 BKTLOWQLIHUNNV-ACJLOTCBSA-N 449.485 2.382 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc4c(=O)n5c(nc4c3)CCC5)c2)CC1 781046955 JSZAYZJIXKDAAV-UHFFFAOYSA-N 431.496 2.264 10 20 IECD CCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 787212734 DAHUWWFMJIUANY-UHFFFAOYSA-N 429.492 2.118 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N1CCN(c2ccccc2)CC1 788012610 DNERPLUVCSRGQI-VQTJNVASSA-N 437.588 2.257 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4ccn(C)c34)CC2)cc1 788328286 NGJLMRFSYBXVSC-UHFFFAOYSA-N 435.528 2.064 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCCNc3ccccn3)cc2F)C[C@@H](C)O1 788640570 BAXOCCQNYNFEIW-IAGOWNOFSA-N 443.523 2.069 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)OC(C)(C)C3)cc2F)C[C@@H](C)O1 789823355 DFZJLWWZHBHWFA-IYBDPMFKSA-N 435.540 2.472 10 20 IECD COCCN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789824900 LACYJKTZPQHEBL-IAGOWNOFSA-N 447.507 2.324 10 20 IECD COc1ccccc1CONC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789827364 SFEVLIVRXFARAZ-HOTGVXAUSA-N 445.491 2.312 10 20 IECD COCc1cccc(CS(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 799655211 PPAPSMNJEUHIEX-UHFFFAOYSA-N 444.534 2.309 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@H]1NC(=O)OC(C)(C)C 803686991 SLDUTVPJBDYEJW-QFBILLFUSA-N 444.576 2.447 10 20 IECD CCOC(=O)c1sc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nc1C 807289607 BDWVQTNCDLAGBO-HNNXBMFYSA-N 442.541 2.498 10 20 IECD COC[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@@H]1CCCO1 809451434 RLEMGHPFHDPJKN-SFTDATJTSA-N 429.517 2.185 10 20 IECD COC(=O)c1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c[nH]1 814531217 BVXUKQVOCHVJOR-UHFFFAOYSA-N 432.388 2.372 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnn1-c1cccc([N+](=O)[O-])c1 917708935 PBBRAOGLUGYHAN-UHFFFAOYSA-N 440.435 2.390 10 20 IECD COc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918220940 MQGCGVHPVVKLMR-UHFFFAOYSA-N 444.507 2.025 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cnccc34)cc2)C1 918464361 SVANVZNLCMAYRN-GOSISDBHSA-N 431.496 2.191 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cc3ccc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 918632652 AMGDSAJUHLCLAO-CHWSQXEVSA-N 441.550 2.007 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 919971832 ZADOOBONZXQNTJ-CQSZACIVSA-N 438.496 2.405 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 920195292 PFQYWTYERIVPGY-QFIPXVFZSA-N 439.512 2.336 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2CC(=O)C2)C3)cc1 1799622903 UKFNIZIHHGCJHI-JHDGKUDLSA-N 435.524 2.276 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1F)C2)c1cc(O)c(O)c(Cl)c1 1799769032 KRIDJFGEUGCLHA-IVWMJMPLSA-N 434.851 2.407 10 20 IECD Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1805509821 OUKXNPSTRPVPKO-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cnnc(Cl)c3)C2)CC1 1807269519 QNKAKPXZGPXROD-UHFFFAOYSA-N 431.880 2.095 10 20 IECD O=C(Cc1ccccc1O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1812701647 DHUSDENHUNWUGB-GAJHUEQPSA-N 448.479 2.156 10 20 IECD O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C1CC1 1824125376 DRHWIYGZCVUPLR-PDFOZTTASA-N 442.512 2.415 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1825921718 HWAFOHQXNFMYQI-KRWDZBQOSA-N 427.505 2.082 10 20 IECD CO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831913182 IMNBWVQRQPHMTC-DYBMROTFSA-N 432.517 2.471 10 20 IECD COc1cc2c(O)cccc2cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250701 FCUOTBQPFAHIGZ-UHFFFAOYSA-N 449.463 2.491 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502040 HXNQYPUEMOPLAO-NSHDSACASA-N 426.853 2.130 10 20 IECD O=C(COC1CCCCC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035101 SBYYKGHCSRHOTA-CSKARUKUSA-N 430.501 2.369 10 20 IECD CN(C)C(=O)c1ccc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 438816763 FRKCHZJMPHTKAT-UHFFFAOYSA-N 436.493 2.182 10 20 IECD CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1F 727611797 ADRHQIVFMVTGQA-UHFFFAOYSA-N 437.468 2.223 10 20 IECD CCN(CC)CCOc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 727858595 CLTQLJXFHSUXCK-UHFFFAOYSA-N 435.546 2.414 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H]1CN2CCC[C@@H]2CO1 729497334 SEDJJCUYZKFKOH-MSOLQXFVSA-N 442.482 2.204 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cc(S(=O)(=O)NC)ccc3C)cc2F)CC1 730234976 GWNNDRSOOJEPCI-UHFFFAOYSA-N 448.564 2.114 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(C(N)=O)c(F)c3)CC2)cc1 732432349 YPMGRGXZROHYGO-UHFFFAOYSA-N 429.496 2.267 10 20 IECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 736072438 KQDJZDWMOMTSQP-KNQAVFIVSA-N 445.608 2.154 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(-c4ccncc4)s3)nc12 745169175 INBGQYCVIWIVTR-UHFFFAOYSA-N 425.426 2.487 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnn(Cc4ccccn4)c3)CC2)cc1 746390711 IJJLGKTWBIUHSS-UHFFFAOYSA-N 434.500 2.059 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3cnn(CCN4CCOCC4)c3)CC2)cc1 747563053 PPJDBVPJSAFXBY-UHFFFAOYSA-N 428.537 2.014 10 20 IECD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1C 748676274 ZKIHSEFTJZFAQZ-UHFFFAOYSA-N 439.515 2.247 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN([C@@H](C)C(F)(F)F)CC2)c1 749965364 ZDQAHBMGZJULOA-INIZCTEOSA-N 429.483 2.495 10 20 IECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1C(=O)NCCCSc1nccs1 759579453 LRCLULXYHMKJHD-INIZCTEOSA-N 430.559 2.464 10 20 IECD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NCc1cccc(Br)c1O 765770895 RYPOULAIYSLFPL-UHFFFAOYSA-N 442.269 2.408 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)O[C@H]1CCNC1=O 769977838 GCWWPPBBGLJWNT-ZWIPKHHJSA-N 441.328 2.082 10 20 IECD O=C(CNC(=O)c1ccc2c(c1)OCO2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771059028 PDJWITQIVKHOPI-QGZVFWFLSA-N 445.903 2.285 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnn(CC(=O)NC2CCCC2)c1 772041717 HCUMOSQHBMMZOK-UHFFFAOYSA-N 425.533 2.051 10 20 IECD COC[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)OC 778501028 FJZUCGYZLQPOLV-FNWMBBJUSA-N 428.557 2.034 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 781517110 JEOIYYBZOPKIJU-UHFFFAOYSA-N 437.500 2.294 10 20 IECD Cc1cc([C@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CCO2)ccc1F 788324621 WNZVBPCNWRWLEF-JOCHJYFZSA-N 441.503 2.187 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788724191 JRNJDHVRQFTVCY-LPHOPBHVSA-N 426.521 2.295 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)cc1 791021796 RGHQEGAGBAMWHC-KHPPLWFESA-N 438.484 2.433 10 20 IECD C[C@]1(O)CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 792050981 JOBMZPBHOQAKOJ-QHCPKHFHSA-N 442.539 2.389 10 20 IECD C[C@@H](OC(=O)[C@H]1CCCN(C(N)=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792273174 QBUUXPSQDKETPW-KGLIPLIRSA-N 449.463 2.123 10 20 IECD CN(C)S(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 793733091 XDQCUHPHHSVQDH-LJQANCHMSA-N 432.542 2.393 10 20 IECD COCc1cc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc(C(=O)OC)c1 793879295 DEDBSZZGIIPNSQ-UHFFFAOYSA-N 427.501 2.389 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cn1 795608626 VCFYIEVGXIFQDI-UHFFFAOYSA-N 437.524 2.344 10 20 IECD COc1cc(N2CCN(C(=O)Cc3ccc([S@](C)=O)cc3)CC2)cc(OC)c1OC 797986072 HEOGCQTYPQFRDD-PMERELPUSA-N 432.542 2.341 10 20 IECD COc1ccccc1OCCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297484 XOZBHTIBHZNAAB-GOSISDBHSA-N 441.528 2.294 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1nc(O)c2ccccc2n1)c1ccc(N2CCOCC2)cc1 803302639 SFHRTJLOEOTQGP-MRXNPFEDSA-N 449.511 2.008 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCc4ccc(C)cc43)CC2)cc1 803747815 VTBLZPVMSVJFRQ-HSZRJFAPSA-N 436.556 2.046 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)CCC3CCCCC3)CC2)cc1 803747986 YZFCTRCAFXBVOK-UHFFFAOYSA-N 430.593 2.362 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(-c3ccc(Cl)cc3)n[nH]2)c1 816552421 LXCOGFGBNGJJFD-UHFFFAOYSA-N 435.893 2.175 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(C)cc(C)c3O)CC2)cc1[N+](=O)[O-] 915831328 GJDDTARXJWRDKK-UHFFFAOYSA-N 435.502 2.432 10 20 IECD Cc1nn(C)c2sc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc12 918925294 GDHNMIRLOHXQOB-UHFFFAOYSA-N 446.504 2.392 10 20 IECD COC(=O)c1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 919336645 MTGGUERTGUORPJ-UHFFFAOYSA-N 444.399 2.439 10 20 IECD CN1CCN(Cc2ccc(CNC(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CC1 919792093 TYQMOBGDCUGQFA-UHFFFAOYSA-N 437.588 2.270 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919969154 XHUIXNVEYZRWQK-UHFFFAOYSA-N 445.585 2.052 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3cccnc3)cc2)C1 1338887566 MPCJYFRTDTXQQK-FYYLOGMGSA-N 435.572 2.454 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cn4ccsc4n3)CC2)C1 1810546499 HEKNXLOMODBAMX-UHFFFAOYSA-N 441.513 2.361 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)c3cccc(F)n3)sc2C1)c1cc(O)nc(O)c1 1820442166 LIUMBRTZGUWNKA-JTQLQIEISA-N 429.433 2.023 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H](O)C1)CC2)c1cc(O)c(O)c(Cl)c1 1823710796 MHLUAVUGOYMOOR-IEBDPFPHSA-N 437.905 2.204 10 20 IECD CCN(CCCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)S(C)(=O)=O 726613795 RIYXDJWLWXQAAV-UHFFFAOYSA-N 448.536 2.228 10 20 IECD CCCOc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OC 727177843 PFJHEVIHRHKTGZ-PTNGSMBKSA-N 430.573 2.234 10 20 IECD COc1ccc(Cl)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 732747437 SWGFDUARKRJZCX-UHFFFAOYSA-N 434.879 2.219 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc1 734214232 USTBEYBSFKQUPN-WOJBJXKFSA-N 445.608 2.154 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCC(=O)N[C@H](C)c3ccc(F)cc3)CC2)cc1 744389738 YNGFLRRPILBLDB-GOSISDBHSA-N 442.535 2.340 10 20 IECD Cc1ccc([C@@H](C)[C@@H](O)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 745759511 TZBLYQIFHQANBM-UZUQRXQVSA-N 444.503 2.295 10 20 IECD C[S@](=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 747545048 RKDWNAPDDUDFRB-NDEPHWFRSA-N 439.534 2.120 10 20 IECD O=S(=O)(c1ccc(NC(=S)NNc2cc(F)c(F)c(F)c2)cc1)N1CCOCC1 747659270 IZYWKAJDTRPWIJ-UHFFFAOYSA-N 446.476 2.438 10 20 IECD C[C@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749847456 CIZSUSAAJNBMAM-KRWDZBQOSA-N 435.590 2.013 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)C[C@H](C)O1 753635702 HROWTICRNQQCNE-PMPSAXMXSA-N 448.541 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1F 753895009 OSFJBWHILCCHJJ-MRXNPFEDSA-N 440.475 2.394 10 20 IECD COc1ccc(N2CCN(CN3C(=O)N[C@@]4(CCc5ccccc5C4)C3=O)CC2)cc1F 754015044 VOGGALWTMDUCAJ-XMMPIXPASA-N 438.503 2.393 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](Oc4cccc(F)c4)C3)CC2)cc1 754268466 COZLARDDYZMLSE-ZJSXRUAMSA-N 429.536 2.471 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(OC(F)F)c(F)c2)SC1=S 754679492 FYMIKGRLZYZJES-XFFZJAGNSA-N 426.463 2.178 10 20 IECD CC(C)(O)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 758385590 UMWWIZIHFNEACD-FQEVSTJZSA-N 442.539 2.387 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnc(OCC(F)F)c3)CC2)cc1 758629876 MZOZGRYBWLYBOF-UHFFFAOYSA-N 435.427 2.240 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3cccc(F)c3C(N)=O)cc2F)C[C@@H](C)O1 758911444 INKUTXKMOVTSJF-ZIAGYGMSSA-N 433.455 2.373 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)CC3CCCCC3)CC2)cc(OC)c1OC 759402665 ARXQFHXYDBIFED-UHFFFAOYSA-N 433.549 2.448 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(Cl)nc3)CC2)cc(OC)c1OC 759413546 UVYMDIAUMCIWEH-UHFFFAOYSA-N 434.880 2.048 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)c1 759592828 AKZOCXFMZKIPGC-DJTUGOFGSA-N 443.408 2.255 10 20 IECD COc1ccc([C@H](CO)N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764351451 MNUSYVOQSBIZDU-UGKGYDQZSA-N 440.544 2.272 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(C(=O)NC(C)C)cc3)CC2)cc1 767798365 ZQDWSOAYFFKDPY-UHFFFAOYSA-N 439.512 2.339 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(O)(c4ccccc4)CC3)CC2)cc1 767858332 DMIUTMKPXWYRPW-QHCPKHFHSA-N 425.573 2.162 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](O)(c4ccc(F)cc4)C3)cc2)C1 777720091 DQAYCFLPFFQSRM-UUOWRZLLSA-N 440.519 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3ccc(Cl)cc3)CC2)cc1 778230490 BNICXKMLSAWURM-ZJVMWOEPSA-N 443.931 2.403 10 20 IECD O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 786647186 FRDPEZHMPUFVOT-UHFFFAOYSA-N 425.485 2.031 10 20 IECD COCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788432830 FDUZPKZIUANNKR-GOSISDBHSA-N 441.528 2.352 10 20 IECD Cc1csc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)n1 789814278 ZVNVAEUIWNOPDZ-SFHVURJKSA-N 432.521 2.311 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 789859698 FBJPGXWVCRDYQF-HXUWFJFHSA-N 447.601 2.438 10 20 IECD COC(=O)[C@H](CSCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C)NC(C)=O 790000000 QNIZSIUROWXIEZ-SFHVURJKSA-N 446.525 2.459 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(CC(=O)N3CCCCCC3)C(C)C)CC2)cc1 796603053 URHFDOAMHKMTBR-HSZRJFAPSA-N 446.636 2.291 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CC[C@@H]4NC(=O)OC[C@H]4C3)c2C)cc1 799180738 VOPUZXVWTTYFFO-XLIONFOSSA-N 425.485 2.494 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(N2CCOCC2)cc1 803312057 UFDRKHNCWDNMIS-KNQAVFIVSA-N 428.577 2.177 10 20 IECD CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665021 RSLOBSPXNUQJPM-HXUWFJFHSA-N 426.536 2.488 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)cc1F 804851549 GFWFYMBQQIAFIM-MVJQZIEYSA-N 425.570 2.484 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](CCOC)c3ccco3)cc2F)CC1 805007411 LDRUIOYUJCWUQD-IBGZPJMESA-N 446.523 2.071 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 806865492 ADEPJDONRHNDJM-CQSZACIVSA-N 431.514 2.496 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1Oc1ccccc1 807289205 LTUAPRGWTAOQAR-YTFSRNRJSA-N 435.524 2.420 10 20 IECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NCc2cc(Br)ccc2O)n1 807385301 HUHGIEIRPWUXFH-UHFFFAOYSA-N 445.277 2.002 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807632201 QIZUUQRJHVBVAG-GOSISDBHSA-N 441.528 2.074 10 20 IECD O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1ccc(S(=O)(=O)NC2CC2)cc1 913075092 KBCFWLREPBMBCY-UHFFFAOYSA-N 436.540 2.447 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cccc(-n4cnnn4)c3)c2C)c1 916172999 LGQBYSCTKJXPAI-UHFFFAOYSA-N 436.497 2.497 10 20 IECD Cn1c(=O)c2cc(NC(=O)N(Cc3ccco3)Cc3ccccc3O)cnc2n(C)c1=O 916681901 LYYCEUVJWYBMMO-UHFFFAOYSA-N 435.440 2.165 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(Cn4cncn4)cc3)cc2)C1 918003283 NDOMJIGBLDPBKP-NRFANRHFSA-N 447.543 2.028 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC)c(OC)c3)CC2)cc1 920255466 XMRUFHBAZPGHMR-ZHACJKMWSA-N 439.512 2.234 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cscn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242055 JKJXCZVLHBTOOV-PKWAYOAASA-N 437.905 2.115 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccnc(F)c1 1796931108 MGZNNSOGRAYBSW-VBUUOAMHSA-N 435.459 2.265 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1803124162 PGDNJNYVWSITQI-UUXHPUJUSA-N 448.527 2.184 10 20 IECD NC[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)c1ccccc1 1810543831 OMGIAWWBQIVNBD-LJQANCHMSA-N 438.528 2.080 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3ccccn23)[nH]n1)c1cc(O)nc(O)c1 1817845180 FCNGLXCMZNBLEK-HNNXBMFYSA-N 447.455 2.483 10 20 IECD CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)COC1 1823706828 VJDHUZVPOJALIU-JTQLQIEISA-N 437.905 2.470 10 20 IECD Cc1cccnc1CCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441383 PLTWMETYLOJSBS-UHFFFAOYSA-N 445.523 2.319 10 20 IECD O=C(c1cc2c(s1)CCCC2)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055580 IDTYFNKEYQCDEY-UHFFFAOYSA-N 449.623 2.304 10 20 IECD COCC(=O)N1CCC(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 444033552 STLOSXZPAYDNMF-UHFFFAOYSA-N 426.561 2.161 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3ccc4c(c3)C(=O)NCC4)n2)o1 734975498 JRGSJBTXQGMOKF-UHFFFAOYSA-N 446.510 2.126 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC[S@](=O)c1ccc2c(c1)OCCO2 740739491 DPNWOTGQEUPQTG-HKBQPEDESA-N 444.553 2.451 10 20 IECD COC(=O)CNC(=O)Cc1ccc(NC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743096571 DFVCEACENYEPRA-UHFFFAOYSA-N 425.485 2.424 10 20 IECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754948692 YECUPEIBAASDMZ-GFCCVEGCSA-N 443.401 2.473 10 20 IECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CN(Cc2ccccc2)CCO1 761608013 JREGAIFDEZRBRU-CTNGQTDRSA-N 447.557 2.173 10 20 IECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 765977709 IATDDCHWNZFBPC-HNNXBMFYSA-N 440.562 2.315 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(Br)nc1 766359914 IKSVLUNNZBRTDQ-UHFFFAOYSA-N 447.333 2.308 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)c1 769760045 SAYBFYMBXFXRKK-OAHLLOKOSA-N 439.490 2.057 10 20 IECD CS(=O)(=O)[C@@H]1CCCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 770002816 ZSCBXRQHOKCSJU-OAHLLOKOSA-N 440.521 2.300 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1 774362721 FJTPJCHYWVBEFZ-UHFFFAOYSA-N 441.871 2.259 10 20 IECD Cc1cc(Br)cc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)c1O 775723635 CJYDVUHLUWSUEH-UHFFFAOYSA-N 430.324 2.099 10 20 IECD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NCc1ccc(O)c(O)c1 778926406 UUBVAXZWPQVTKJ-QHCPKHFHSA-N 445.475 2.228 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)cc([N+](=O)[O-])c3C)cc2)CC1 786122684 WQRQTVXSADZXLU-UHFFFAOYSA-N 446.529 2.359 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCOCC3)cc2Cl)C1 787755911 JUWXPJSUYGNMPJ-DLBZAZTESA-N 436.984 2.029 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3N(C)CCCC3(C)C)cc2F)C[C@@H](C)O1 789827107 RKASCJOYFLQRJH-FVJLSDCUSA-N 448.583 2.292 10 20 IECD O=C(NCCc1ccc(F)c(F)c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845096 KAUQXPDNYMYBHA-UHFFFAOYSA-N 435.446 2.040 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CO)c3ccccc3OC(F)(F)F)nc12 796523783 HHWDICRLQLPWRL-CQSZACIVSA-N 440.378 2.333 10 20 IECD CO[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 798771395 LNPFAZBULXYCNI-XMHCIUCPSA-N 447.447 2.453 10 20 IECD CCCCN(CC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 801598014 SKRLGVWDPGBMCL-GOSISDBHSA-N 434.562 2.498 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2ccccc2F)CC1)c1ccc(N2CCOCC2)cc1 803309202 RKEADSXEXHXMLE-SFHVURJKSA-N 440.519 2.188 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(N2CCOCC2)cc1 803312196 WBCIDPKVVCYWDR-LJQANCHMSA-N 434.540 2.393 10 20 IECD CN(C[C@H]1CCCC[C@H]1O)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449009 LEBPIVBUAIHXAN-DNVCBOLYSA-N 439.503 2.383 10 20 IECD CCc1ccc([C@H](O)CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 804149365 LRIJPALSFSZDEN-MDRMPYQZSA-N 437.540 2.312 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 804317572 IACFZWPTQJRKSI-NJYVYQBISA-N 427.545 2.244 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(C4CCCCC4)CC3)CC2)cc1 804319255 MPVJXNYTNKAZIL-UHFFFAOYSA-N 428.577 2.257 10 20 IECD CC(C)(C)OC(=O)NC[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 807289788 JHCVEQDINVUJNK-LJQANCHMSA-N 428.533 2.099 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1 809678501 DPSSLCBXIWENQO-UHFFFAOYSA-N 444.507 2.208 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)N[C@@H](C(C)(C)C)C3=O)cc2F)C[C@@H](C)O1 810015134 IURMDNMAJDAVJL-BIENJYKASA-N 434.512 2.022 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCCS(=O)(=O)N3CCCC3)cc2F)C[C@H](C)O1 917710421 VANYKWYDFSTEED-IRXDYDNUSA-N 441.569 2.261 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(Cl)c(C(N)=O)c3)CC2)cc1 918461565 FXDCUOOGXKBTFK-UHFFFAOYSA-N 430.892 2.125 10 20 IECD Cc1nnc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)s1 1796259803 ATRNYYMNRBLNIY-CLLJXQQHSA-N 436.921 2.406 10 20 IECD Cc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1807992731 ACFOWDGLPALROH-GAJHUEQPSA-N 447.495 2.154 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1coc(Cl)n1 1816175423 WMTGSKHYJLJPSD-GFCCVEGCSA-N 432.824 2.477 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1824886330 CTYCEUROQMCXED-UBHSHLNASA-N 441.488 2.206 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCO1)CC2 1828197561 BBELVPQQXOEAJX-HGSIUPGCSA-N 445.497 2.064 10 20 IECD O=C([C@@H]1CCc2nc[nH]c2C1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502266 HEFLIDWEQKJWPS-GFCCVEGCSA-N 430.892 2.096 10 20 IECD Cc1nsc(N2CCCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)n1 563301838 SMMCSSSIQSQORY-UHFFFAOYSA-N 426.546 2.002 10 20 IECD O=C(c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1)N1CCC(CO)CC1 579157069 OJAGGWUOZIYWGS-UHFFFAOYSA-N 432.527 2.337 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3=Cc4cccc(OC)c4OC3)nc12 725976900 RIWPYHDEKQVNAG-UHFFFAOYSA-N 425.397 2.139 10 20 IECD O=C(CN1CCC(CN2CCOCC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 727833112 MDSNJNXSWKIKNE-UHFFFAOYSA-N 447.535 2.445 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc4c3COC4=O)cc2F)CC1 730268656 AWELNHRXYOCGKJ-UHFFFAOYSA-N 433.505 2.117 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 735091845 AHCMYNKCRLVOEI-UHFFFAOYSA-N 449.533 2.219 10 20 IECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](CN2CCOCC2)C1 741811015 XCBSGYCLYBOFCP-QZTJIDSGSA-N 447.535 2.443 10 20 IECD NC(=O)c1cccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743975749 UTIVSBSXZZEUPJ-HNNXBMFYSA-N 432.427 2.111 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1)c1ccc(N2CCOCC2)cc1 746382244 RBDCKRPHLLEPEB-CYBMUJFWSA-N 425.411 2.098 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)Nc4ccc(O)cc4)CC3)nc12 749396714 USFOUAQZFYXZQZ-UHFFFAOYSA-N 439.472 2.168 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3csc([C@@H](C)OC)n3)CC2)cc1 752360432 LGFTUUUIIWVKDO-MRXNPFEDSA-N 433.578 2.481 10 20 IECD COc1ccc(N2CCN(Cn3nc(N4CCOCC4)sc3=S)CC2)cc1F 754013906 OTERBRSZSPWEPE-UHFFFAOYSA-N 425.555 2.438 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1 755193743 UTSIZGFGNIRNDP-UHFFFAOYSA-N 444.557 2.181 10 20 IECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1 759299171 ZFXDOEZIPYPSIL-UZUQRXQVSA-N 428.508 2.234 10 20 IECD COc1cc(N2CCN(CC(=O)NC(=O)N[C@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 759872375 IIOFPJXXSVAXHX-AEFFLSMTSA-N 448.564 2.239 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3CC(=O)c3cccs3)CC2)cc1 771301904 KEXZTOHLFPAABG-LJQANCHMSA-N 443.569 2.379 10 20 IECD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774362151 KVDPQHWINYKOGH-UHFFFAOYSA-N 430.411 2.227 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnc4scc(C)n4c3=O)CC2)cc1 776294728 WFNZGBYUQUCNCX-UHFFFAOYSA-N 441.557 2.015 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 778252492 LEEZITRZFYOOGY-ZHACJKMWSA-N 440.519 2.422 10 20 IECD COC(=O)[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 778320330 YAYCVJNEJGJEEC-OTOIZHKDSA-N 443.544 2.138 10 20 IECD Cc1cnn(-c2c(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c(C)nn2C)c1 778935628 BDNTWOQKQRDSRW-UHFFFAOYSA-N 426.496 2.253 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(OC4COC4)cc3)CC2)cc1 782094289 JFWBAVJXRQRSHG-UHFFFAOYSA-N 426.517 2.417 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 782104531 GIQVGGVSATWOCM-UHFFFAOYSA-N 449.504 2.198 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1 788323669 NHFWYTDHIYTUKM-OAQYLSRUSA-N 445.466 2.018 10 20 IECD COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 788498800 OTVHTLRIDPEAGS-FPOVZHCZSA-N 444.553 2.359 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 788910468 LCZGQUMFCDXNSQ-XZOQPEGZSA-N 437.540 2.254 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 789653535 ZDILGMULKGKZCU-JYNAJPCDSA-N 448.523 2.281 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823170 ZFLPLZWAZBRMLG-GUDVDZBRSA-N 448.583 2.436 10 20 IECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H](C(F)(F)F)O1 795060589 IYSKOICWLYZCTH-QGZVFWFLSA-N 433.446 2.320 10 20 IECD Cc1cc(-c2nnc(N3CCN(S(C)(=O)=O)[C@@H](C)C3)n2C)c(C)n1-c1ccccc1 800742294 FSZFHQTULJAEQR-INIZCTEOSA-N 428.562 2.360 10 20 IECD Cc1nc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)sc1C 807291426 KAUUHANYQSWDIG-UHFFFAOYSA-N 425.558 2.101 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 808344517 XBYWSJAXGOASEK-PKTZIBPZSA-N 442.604 2.129 10 20 IECD Cn1c(=O)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc2ccccc21 813594108 GCLJJNKWQVOMFZ-IBGZPJMESA-N 447.539 2.240 10 20 IECD CC[C@@H]1CN(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818977738 LLCKUQWLFOZICZ-OAHLLOKOSA-N 448.501 2.267 10 20 IECD CC1=NN(c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)CC1 918337026 BOPPBXVYTUACFJ-UHFFFAOYSA-N 426.542 2.437 10 20 IECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1C[C@H](C)C[C@@H](C)C1 920636302 QRTUKXXGTGPUNG-HBUWYVDXSA-N 426.535 2.450 10 20 IECD CC(C)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1780763166 JGSZJRGNXYZIEA-QHCPKHFHSA-N 425.485 2.374 10 20 IECD CSCC[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429283 CKAPJLCIUDDQFE-INIZCTEOSA-N 431.514 2.355 10 20 IECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)C(=O)Nc1cccnc1 1789607018 LCLKTXYEXUYKFW-UHFFFAOYSA-N 447.451 2.274 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cnccc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992933 FBGIWSJFJYGLMM-JLTOFOAXSA-N 437.431 2.055 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc[nH]n1)CC2)c1cc(O)c(O)c(Cl)c1 1823708080 JDYFLHRGBBEQSZ-VIFPVBQESA-N 433.877 2.470 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc3cnccc3[nH]2)C1 1844111764 JNHKFYUVOJQHTI-UHFFFAOYSA-N 442.479 2.173 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1 22015368 PHXIOSUGJOFJTI-UHFFFAOYSA-N 447.532 2.120 10 20 IECD CCN1C(=O)C(=CNc2ccnn2Cc2ccc(N(C)C)cc2)C(=O)N(CC)C1=S 29009093 QKZXOOLPDDSWSE-UHFFFAOYSA-N 426.546 2.289 10 20 IECD C[C@@H]1CN(C(=O)Cn2cc(NC(=O)N3CCOc4cc(N(C)C)ccc43)cn2)C[C@@H](C)O1 543883274 FEEHVUVHCHAGPL-HZPDHXFCSA-N 442.520 2.016 10 20 IECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1 728839186 GHRFMQUTHWZRIO-UHFFFAOYSA-N 442.463 2.141 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 728980157 WUVGQYUAXOCRQN-PBHICJAKSA-N 434.514 2.349 10 20 IECD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729535286 PAFVMIUMXBETHQ-GFCCVEGCSA-N 442.921 2.470 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3CN(CC(C)C)CCO3)cc2F)CC1 730113047 MOEULVSVPOJGGC-HXUWFJFHSA-N 435.588 2.124 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](CNS(N)(=O)=O)C3)c2C)cc1 730570691 KLHYJWOCIRBYBM-GOSISDBHSA-N 448.589 2.181 10 20 IECD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)cc1 731052182 XIUALXMSTRUBTG-UHFFFAOYSA-N 432.864 2.131 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C\C2CCOCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 732686923 BYZNODRPPBOOHN-BAQGIRSFSA-N 446.525 2.450 10 20 IECD O=C(c1nc2ncc(Br)cn2n1)N(Cc1ccccc1O)C[C@H]1CCCO1 735520353 YRUZAZYWTWNYMW-CQSZACIVSA-N 432.278 2.414 10 20 IECD C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 739078505 CQJWPFHDRLOYEB-SFHVURJKSA-N 438.528 2.003 10 20 IECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN(C)c2ccc(OC)cc2OC)C1=O 752111102 LNWBTQYCKIXJTE-QFIPXVFZSA-N 426.473 2.029 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](CNC(=O)C(C)(C)C)C3)CC2)cc1 754043280 KJBIIFAOIFPEMB-IRLDBZIGSA-N 446.636 2.052 10 20 IECD COC(=O)C[C@@H]1CN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 754067279 NZCVOYVPKQBICT-TZIWHRDSSA-N 439.556 2.345 10 20 IECD COc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCCC[C@H]4O)CC3)CC2)cc1F 769164512 BNYHVWSTUVBZHF-LEWJYISDSA-N 434.556 2.434 10 20 IECD Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 781368760 UEWZMLVTFQZPOG-UYAOXDASSA-N 440.548 2.011 10 20 IECD O=C(OCC(=O)[C@@H]1CCCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785412378 IUGSXWYSVLVIDU-GFCCVEGCSA-N 425.484 2.407 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](c2ccsc2)O1 788324886 ZGBZNCXCMXUPDA-OXQOHEQNSA-N 429.542 2.190 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(Cn2cccn2)cc1 788460259 PPVPSIOUBXXNCV-UHFFFAOYSA-N 447.539 2.043 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(c4cn[nH]c4)CC3)cc2F)C[C@@H](C)O1 789816098 BULWVACZZAAPAV-HZPDHXFCSA-N 443.523 2.185 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC[C@H]1CCOc2ccccc21 789843030 HJDUQKUYQFGILK-QGZVFWFLSA-N 441.503 2.086 10 20 IECD C[C@@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845947 XKUAUPWSTZQZAG-MRXNPFEDSA-N 425.504 2.376 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc2c(c1)OCCCO2 789854232 FTCVEAZAAWFOBD-UHFFFAOYSA-N 441.553 2.334 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 792046038 ZZQNRFZSKVJLHT-RDJZCZTQSA-N 433.553 2.101 10 20 IECD Cc1cc(NC(=O)CN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)no1 795670556 XOYCYKQMQKIMPM-UHFFFAOYSA-N 432.436 2.267 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 798334121 OAUZAMBWQAENEC-AWEZNQCLSA-N 441.912 2.227 10 20 IECD CC(C)(C)OC(=O)CN(c1ccc2c(c1)OCO2)S(=O)(=O)c1cccc2nonc12 799187364 QDHWUIDJMVYLTE-UHFFFAOYSA-N 433.442 2.489 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC(CN2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 803307698 KVUUTDAFPDGEQL-IBGZPJMESA-N 428.577 2.035 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 803399381 PHJKWRKCKLIVDQ-NRFANRHFSA-N 443.519 2.460 10 20 IECD CN(C[C@@H]1C[C@H](F)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 803555609 YDEBWPSARQGPFU-JSGCOSHPSA-N 445.513 2.183 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(CCCN(C)C)CC3)CC2)cc1 804316841 LIDMDNFRGLSVES-UHFFFAOYSA-N 430.593 2.361 10 20 IECD CCO[C@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 805006727 COVIBLBEYGLLTJ-SFTDATJTSA-N 448.583 2.246 10 20 IECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 809719261 CWLXXPAAJWBDCA-HNNXBMFYSA-N 439.465 2.293 10 20 IECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)n1 815527239 WAACZHHDEXKJJI-UHFFFAOYSA-N 431.514 2.433 10 20 IECD CNC(=O)NC(=O)[C@@H](C)OC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 913362282 VLNMPUYVCVBFOC-WJEYQPDNSA-N 441.556 2.117 10 20 IECD CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)s1 917911283 FAOXPVXILPFYKS-UHFFFAOYSA-N 425.601 2.416 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc2)C1 918122891 NSRPOTKURASQQG-PXNSSMCTSA-N 426.521 2.086 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](CNC(=O)OC(C)(C)C)C3)nc12 920419550 IJWIUXKLUQKSFQ-CQSZACIVSA-N 433.509 2.348 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 1321367453 XBVUXJVBDMPCFT-MOPGFXCFSA-N 440.496 2.241 10 20 IECD Cn1cc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934777 XAONWISSSSZOGZ-VBUUOAMHSA-N 437.475 2.209 10 20 IECD Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1803799108 FNTYVPCDNABTKX-KKSFZXQISA-N 433.468 2.225 10 20 IECD CCc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)co1 1807996180 ZCZZWESUGBYIMW-XOBRGWDASA-N 437.456 2.072 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cncc(F)c1 1816529833 NZEFCUNMHRIOTQ-OAHLLOKOSA-N 426.408 2.370 10 20 IECD O=C(CCCn1cccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1826920139 UOXWBQGNRBITGC-AWEZNQCLSA-N 441.513 2.457 10 20 IECD C[C@H](Oc1ccccc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846060610 MBGFSJRITIHDLZ-SOGBHIHOSA-N 438.480 2.488 10 20 IECD O=C(c1ccc(Cl)s1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055935 QKTHVUFVRUCEFM-UHFFFAOYSA-N 429.976 2.079 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(C4OCCO4)CC3)CC2)cc1 726702518 MCABSHOCMFWHBZ-UHFFFAOYSA-N 432.565 2.002 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)c(NC(C)=O)c3)CC2)cc1 726728280 PJTMQBGIPZMRPE-UHFFFAOYSA-N 440.500 2.386 10 20 IECD O=C(CN1CCC[C@@H](N2CCCC2=O)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 732210634 AZBXESHVCXEJMV-QGZVFWFLSA-N 431.492 2.487 10 20 IECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)cc1S(=O)(=O)N1CCOCC1 734403093 VSFPBTGULBRGPX-UHFFFAOYSA-N 447.557 2.021 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O 734702991 GOAVALRLUTZZOK-UHFFFAOYSA-N 434.496 2.322 10 20 IECD CC(=O)c1cc(CN(C)Cc2ccc(S(C)(=O)=O)cc2)c(O)c(CN2CCOCC2)c1 740862787 GUXPIWIBLRNLJF-UHFFFAOYSA-N 446.569 2.463 10 20 IECD CC1CCN(c2ccc(CNC(=O)CCN3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2)CC1 742650170 XBROKJZQNSRWKO-CZAYHTPWSA-N 425.529 2.092 10 20 IECD C[S@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 752877480 CVADBJZOQIQCKL-PBYQXAPXSA-N 428.558 2.125 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc([S@](C)=O)cc3)CC2)cc1 754050943 NMNHLIYJIJSRRP-JRPXNJEYSA-N 431.602 2.048 10 20 IECD C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@@]1=O 760661387 QZNJMUFOBCNIAT-RYZVSIALSA-N 428.557 2.238 10 20 IECD CC(C)OC(=O)C[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 766924052 MYFIOUYNJJHPMG-LJQANCHMSA-N 435.540 2.332 10 20 IECD C[C@H]1CCCCN1CC(=N)NOCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 768516175 BBIRHNKUWUSWCP-RCCFBDPRSA-N 449.571 2.428 10 20 IECD CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769735259 IJVSKOVDFPWUBT-UHFFFAOYSA-N 427.473 2.246 10 20 IECD CC(C)(C)OC(=O)NC[C@@](C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 769783585 GNLNXAFTFNFUQL-LJQANCHMSA-N 427.523 2.187 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(N(C)C)cc1 773857684 NHALIUHOWRDQFX-INIZCTEOSA-N 444.557 2.353 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773859616 WRYMZKMUHPSPEO-NSHDSACASA-N 425.457 2.250 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCC2(N3CCOCC3)CCCCC2)C2CC2)cc1 774841517 HWBLUACXTPUGIS-UHFFFAOYSA-N 442.604 2.395 10 20 IECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cc([N+](=O)[O-])c1C 775286083 BXIMMHJSPPJDME-UHFFFAOYSA-N 438.414 2.373 10 20 IECD CCCN1CCC(N(C)C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778244386 KVNCCWPFWNOWCV-KTKRTIGZSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3OCCc4ccccc43)CC2)cc1 778275047 GTALUYUQIOICSA-JCKUYFFHSA-N 435.524 2.330 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1 778287923 BQPKRYLDOSAAJP-LMIGLLRMSA-N 427.545 2.220 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c1 783322222 YMEZFRHFTLSXTQ-UHFFFAOYSA-N 428.424 2.029 10 20 IECD O=C(COC(=O)[C@@H]1CCCN1c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 785131489 PFOZPXWVGBYWAK-QFIPXVFZSA-N 441.503 2.491 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 787202222 MADIEVGHMTWIKN-SFHVURJKSA-N 439.560 2.038 10 20 IECD CN(CCOc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840848 OPJTVMKNOXIGHX-UHFFFAOYSA-N 447.482 2.080 10 20 IECD COCCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC[C@@H](C)C1 789844250 FDSAJUVQNCXBPX-SJLPKXTDSA-N 435.540 2.067 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1c(C)nn(C)c1C 789856181 PUJDJKOKMLKLME-IBGZPJMESA-N 429.590 2.474 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Br)c(C)c2)ccc1O 790404722 GUAQOILTZYOWSG-UHFFFAOYSA-N 435.321 2.172 10 20 IECD O=C1CN(S(=O)(=O)c2cccc(NCc3ccc(N4CCCCC4)cc3)c2)CCN1 796418726 PDWXSEFESNFZDJ-UHFFFAOYSA-N 428.558 2.410 10 20 IECD C[C@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 803448359 PDGAFVYWONHKTL-MIFYACCESA-N 425.476 2.445 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCN(C(=O)c2ccsc2)CC1)c1ccc(N(C)C)cc1 807674931 SJSWZXWQAKBMST-INIZCTEOSA-N 428.558 2.366 10 20 IECD CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)[C@H]2C1 808357532 JNUFNTHOLYAOEK-HFSMHLIXSA-N 432.540 2.233 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808771320 WWNQXTWTPMXSBQ-LPHOPBHVSA-N 432.565 2.473 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 810349962 QIFVKSGPKWJHII-UHFFFAOYSA-N 447.438 2.151 10 20 IECD Cc1cccc2c(=O)n(CCC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cnc12 917832689 FRFSMZSSPYSUIB-LJQANCHMSA-N 447.539 2.113 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cc2)C1 917833987 FUIXLODUDHDESM-KRWDZBQOSA-N 448.483 2.412 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(OC)c1 918439507 MDCJSJWIFHUDAO-UHFFFAOYSA-N 431.464 2.059 10 20 IECD Cc1nn(C)c(C)c1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918929188 WSWJSDQQEWUJAE-ZIAGYGMSSA-N 432.496 2.263 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc2oc(=O)ccc2c1 920940249 ZSFSRWRZPYRXQX-UHFFFAOYSA-N 427.482 2.350 10 20 IECD O=S(=O)(c1ccc(NCc2ccc(N3CCSCC3)cc2)nc1)N1CCOCC1 1317895057 DAJAVMKNRWUWKI-UHFFFAOYSA-N 434.587 2.268 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1 1318605633 NHSVMVXHMZMXDA-GOSISDBHSA-N 444.963 2.410 10 20 IECD COc1ccc(N2CCC(NC(=O)c3cc4c(c(S(N)(=O)=O)c3)CCC4)CC2)cc1 1339296849 ILHBBPJAIBUDKI-UHFFFAOYSA-N 429.542 2.230 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCCCC3)C[C@@H]21 1792219020 YKELDPNUCUBYCB-RLTIEFLZSA-N 444.528 2.377 10 20 IECD Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805496113 QKAQCHRHVSCADS-HRAATJIYSA-N 433.468 2.225 10 20 IECD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)nc1 1808606154 JBMHQPAFYSDLNO-UHFFFAOYSA-N 446.598 2.095 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccc(Cl)nn3)CC2)C1 1810547201 RUBZLXPZANPXDF-UHFFFAOYSA-N 431.880 2.095 10 20 IECD COCc1c[nH]c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817846308 QCBUNSPDQUSBNL-INIZCTEOSA-N 440.460 2.310 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2cncn2c1 1819184307 TXAFPTHTTXZCKR-KRWDZBQOSA-N 447.455 2.483 10 20 IECD CC(C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824258119 NRVWRTGEBBVVFW-GYBSMXBJSA-N 446.544 2.453 10 20 IECD CO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1838687791 BOHGTDHCIRSBRL-CYBMUJFWSA-N 440.924 2.398 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)n3cnnn3)C2)cc1 1846647160 HUGZNQCLDNZLRI-GOSISDBHSA-N 433.516 2.159 10 20 IECD O=C(c1ncc(F)cc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034678 KLIMHEKUIROAIG-HWKANZROSA-N 431.395 2.007 10 20 IECD CC(C)N[C@@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)C(C)C 1847038763 IBXHUVOPJSHVFP-QRBZPYHOSA-N 431.533 2.043 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc(OCc2ncnn2C)cc1 533328947 KSNPQXQRKHZNNP-UHFFFAOYSA-N 429.502 2.048 10 20 IECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2)ncn1 568548141 WYXFTBODHAWHCE-GOSISDBHSA-N 434.544 2.241 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)c2ccc(F)cc2F)CC1 726972042 UACGARDDJUOHQY-UHFFFAOYSA-N 430.499 2.447 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CCC(N)=O)C3)cc2F)C[C@@H](C)O1 727157462 IUMIKFCUBAADTB-KZNAEPCWSA-N 434.556 2.033 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc2c(c1)CC(=O)N2C 728306765 CGWOFUWMYJRLRW-QFBILLFUSA-N 449.555 2.468 10 20 IECD CN1CCN(CC(=O)N(C)c2ccc(NC(=O)N(C)Cc3ccccc3O)cc2)CC1 728392163 AFIMBCHBKOSXLU-UHFFFAOYSA-N 425.533 2.266 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1 729065767 DTDFHFYRWOYVQU-AWEZNQCLSA-N 447.513 2.001 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C)C(=O)NCc3ccccc3)cc2F)CC1 730120647 SPJCTAIDPGHGHF-SFHVURJKSA-N 441.551 2.472 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCC4=O)C3)cc2F)CC1 732464125 ZOHQNROQQUIRQT-IBGZPJMESA-N 431.556 2.264 10 20 IECD Cc1cc([C@@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)o1 745691390 JWZCUPPHLIDZLN-MBSDFSHPSA-N 428.533 2.305 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)cc1 746038744 RRUJUWQGMWAKQC-UHFFFAOYSA-N 425.533 2.288 10 20 IECD CN(CCC1CC1)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 749530180 CEWIAZLNGJFTCK-WQRHYEAKSA-N 447.582 2.465 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)CC2)cc1F 753885811 MVNHAOVVJSIXKV-UHFFFAOYSA-N 441.467 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCCCN3C3CC3)CC2)cc1 765798588 RKFJMGPNPMIRJI-AXUYNXDZSA-N 426.561 2.033 10 20 IECD CNC(=O)Cn1nc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1C 767971741 SCRWZBHPEHGANJ-AWEZNQCLSA-N 436.463 2.329 10 20 IECD C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770065802 GXBKZBVRVZIDNN-QWHCGFSZSA-N 427.523 2.282 10 20 IECD COc1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 773243907 MLAIPBQVDCIALH-HNNXBMFYSA-N 444.919 2.305 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(Cc3ccccc3)C3CC3)cc2)C1 774383020 AXFCQYUOSBADCK-FQEVSTJZSA-N 434.540 2.196 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn(-c2cccc(Cl)c2)nn1 780404186 CPSZRFQOLOBUIO-UHFFFAOYSA-N 445.932 2.086 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1 785293845 CDAFTTWBIARIBS-BRWVUGGUSA-N 441.528 2.393 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc4c(c3)OCO4)cc2)C1 785370609 RJRJPPYTJIELAS-KRWDZBQOSA-N 447.495 2.437 10 20 IECD CCn1c(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)nc2ccccc21 785473704 NCCXPCFTRMHBLV-UHFFFAOYSA-N 435.528 2.420 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@@H](SC)C3)CC2)cc1 785527034 IVHWEXYMPYIWOB-WIYYLYMNSA-N 448.633 2.114 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1F 785870683 OMJLSUSALHZEAC-IAGOWNOFSA-N 436.572 2.292 10 20 IECD CC(C)CN1C[C@H]2CN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CCN2C1=O 787066217 UDOHAZOWJPTDNH-GHTZIAJQSA-N 429.565 2.372 10 20 IECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 787155845 GRJXJSKRAXQQPI-IAGOWNOFSA-N 443.519 2.423 10 20 IECD COCn1nc(C)c(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 788631421 PUFVUNWAKYBBHG-QGZVFWFLSA-N 442.969 2.406 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@@H]21 788922800 YHCGIIONYKTMGX-RMMBEPAUSA-N 429.536 2.344 10 20 IECD CCOC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789950799 QPLRBCYFZNOGQC-OAHLLOKOSA-N 443.466 2.043 10 20 IECD CCCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H](COC)C(=O)O 797710129 SRUQGXOSVZWCOQ-KHYOSLBOSA-N 425.501 2.461 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)CN3CCCC3=O)cc2Cl)C1 803122251 PEWVUUUEGINVHT-HOTGVXAUSA-N 434.968 2.320 10 20 IECD COc1ccccc1Cn1c(SCC(=O)OCC(=O)C(C)=O)nc2ccccc2c1=O 808492590 YYRHOPRDBUONDN-UHFFFAOYSA-N 440.477 2.247 10 20 IECD CCNC(=O)N1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 836182488 CEJJUJTWBNVFFM-UHFFFAOYSA-N 432.231 2.126 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NCc2ccc(N3CCCC3)cc2)cc1 915082273 XTDODPUMBPFJRU-UHFFFAOYSA-N 444.557 2.182 10 20 IECD Cn1ccnc1[C@](O)(CC(=O)NCc1ccc(N2CCSCC2)cc1)C(F)(F)F 917386618 HOTBJIUXOMUQAH-GOSISDBHSA-N 428.480 2.430 10 20 IECD C[C@H](OC(=O)c1ccn(C)c(=O)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919267367 OXGZESGYUXWSGY-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD C[C@H](NC(=O)c1ccoc1)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919480243 AIASVNARWYKITN-ZDUSSCGKSA-N 446.415 2.355 10 20 IECD CC(C)S(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919878582 RQSAIKOFMGLXFJ-UHFFFAOYSA-N 436.555 2.356 10 20 IECD Cc1c(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nnn1-c1ccccc1 920004616 WJMYIKCUSWUEPT-LJQANCHMSA-N 432.528 2.136 10 20 IECD COc1ccc(/C=C2/SC(=S)N(CCc3cccnc3)C2=O)cc1OCC(N)=O 1115973515 RCOQAUGKTKPUBD-LICLKQGHSA-N 429.523 2.398 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3ncccc3F)C2)C1 1779809128 DYBNBEAYKIEMDG-FQEVSTJZSA-N 435.839 2.043 10 20 IECD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)nc1 1782004814 NEJMYRFLBTUPHB-NRFANRHFSA-N 431.876 2.212 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ncccn2)cc1 1794817761 MYIHHPXKVYZDNN-VTYHHJSWSA-N 445.523 2.401 10 20 IECD O=C(Cn1cc(Cl)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285278 JXHUEDVWWLGZLR-KOTZLPFRSA-N 446.891 2.005 10 20 IECD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)o1 1806256650 YHIMNZPWCRUHPG-UHFFFAOYSA-N 435.571 2.293 10 20 IECD C[C@H](CN)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807017903 MUUZTJYVRRCOLK-DFHBCGBQSA-N 432.908 2.061 10 20 IECD Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807994145 QHVFYCMVLXCDQV-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccncc1F 1808883645 JVCCNRNZISQJPL-VBKZILBWSA-N 437.431 2.055 10 20 IECD O=C(/C=C/c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722149 SOCXFWUEHTUMBJ-FVOPLDGLSA-N 426.454 2.482 10 20 IECD Cc1c[nH]cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818220926 DDWMSGYIUFLOCW-CQSZACIVSA-N 446.558 2.212 10 20 IECD Cc1cc(/C=C/C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)no1 1819937769 YFRPWKGJUUBMIV-PYEVWLCESA-N 441.469 2.185 10 20 IECD CCOCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1826454859 OZLYEOPBOBXVAH-NRFANRHFSA-N 440.544 2.436 10 20 IECD NC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 23045996 HZGLTOWMTQTGCO-UHFFFAOYSA-N 428.400 2.356 10 20 IECD CC(C)=CC(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 25462817 GFZRTRDAGFAMNV-CXUHLZMHSA-N 448.522 2.242 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC([C@]4(C)NC(=O)NC4=O)CC3)ccc21 467502037 JFMTUPQDSQFSIK-QHCPKHFHSA-N 426.517 2.355 10 20 IECD CN1CCCN(S(=O)(=O)c2cccc(NC(=O)N(C)Cc3ccccc3O)c2)CC1 728393871 RXEJKCZNAORJCZ-UHFFFAOYSA-N 432.546 2.382 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](C3OCCO3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 728928146 NBBBSJAVSLPAAS-QGZVFWFLSA-N 447.557 2.009 10 20 IECD CC[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 729229823 ACHCLOCSBZQCCE-OAQYLSRUSA-N 446.573 2.463 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(NC(C)=O)c3)cc2F)CC1 730391926 YOKAIYQMSBEJEZ-UHFFFAOYSA-N 441.507 2.181 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2[nH]cc3c(=O)ncnc2-3)cc1 732114928 PWZKRESQNUMJOM-UHFFFAOYSA-N 432.484 2.379 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)Oc4ccccc43)cc2F)CC1 732478714 YJCPXGRPFMXYPV-QGZVFWFLSA-N 440.519 2.398 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C[C@@H]2CCOC2)CC1 736395253 NDLZPYVNMRHQDR-SFHVURJKSA-N 434.556 2.087 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)NC[C@@H]1CCCCO1 745813986 HPNSLKDMRPFZDI-FQEVSTJZSA-N 440.610 2.161 10 20 IECD Cn1ccc(N2CCC[C@H](NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)C2=O)n1 745882804 JSAWFBZKZGUJGH-ROUUACIJSA-N 427.505 2.012 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1 749027442 LRMRNDKKBGGOEU-UHFFFAOYSA-N 437.544 2.051 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(Cn4ccnn4)CC3)cc2F)C[C@@H](C)O1 753208563 ALWBUDMRJPUFSV-QZTJIDSGSA-N 444.555 2.059 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)CCC(=O)N4C)CC2)cc1 758585975 IDXLWMXGKRBOIM-UHFFFAOYSA-N 437.496 2.110 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](S(C)(=O)=O)C1 763910302 CXOAHQFDNJYNBM-GDBMZVCRSA-N 440.521 2.298 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2cccc(Br)c2O)cc1 765766725 AREWQUWSLNWENB-UHFFFAOYSA-N 427.320 2.176 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cn1 769672726 SKIHZNBHSFAIKD-UHFFFAOYSA-N 430.530 2.201 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776942862 NWPNAKNTCAUOMP-ZYSHUDEJSA-N 443.491 2.377 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 777828578 LNEOOJSIOWPSHA-CYBMUJFWSA-N 432.860 2.361 10 20 IECD Cc1cc(C(=O)COC(=O)[C@]2(C)CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 781287026 BAKWXHWIEMTCHZ-OAQYLSRUSA-N 434.514 2.284 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1 785483349 YHSGFTQVTFPICN-UHFFFAOYSA-N 425.529 2.279 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ccc(C(=O)Nc4nncs4)cn3)cc2)CC1 786070101 BPMBHRNTSGTHNE-UHFFFAOYSA-N 437.529 2.466 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)cc2)CC1 787322086 NANYNCRMAVMIQK-FQEVSTJZSA-N 431.581 2.094 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](c3ccnn3C)C(C)C)CC2)cc1 788539727 VOUVKVVQGZBEDF-GLCJEOIMSA-N 439.560 2.190 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(CCCO)CC(C)(C)C)cc2F)C[C@H](C)O1 789818387 JOZVDSLQIOSJPB-IRXDYDNUSA-N 437.556 2.313 10 20 IECD CN(CC1CC1)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789847773 UVGKTRXPQNCTHE-HXUWFJFHSA-N 430.618 2.046 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 792231688 VIFUYSPMSNUQRO-UHFFFAOYSA-N 432.528 2.444 10 20 IECD CN(CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796117309 WZYPUNVXMCEMIC-UHFFFAOYSA-N 430.480 2.361 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](Oc4ncccc4F)C3)ccc21 803688184 LPOJGUAYSBISNJ-SFHVURJKSA-N 426.492 2.289 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4ccccc4CC3)cc2F)CC1 805008817 SAVZNANTDVEIET-UHFFFAOYSA-N 438.547 2.211 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCN(c2ncccn2)CC1 916266931 OIQLAYDWDJYLAA-UHFFFAOYSA-N 425.581 2.286 10 20 IECD CSC[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 919767387 XIMUULQUECIGSF-SLFFLAALSA-N 445.585 2.046 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(S(=O)(=O)NC2CC2)c1 919970713 APXGTMCAIXQAMR-UHFFFAOYSA-N 447.532 2.158 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1)c1ccc(N2CCOCC2)cc1 920925758 LMEYNYHQZRKSHM-SFHVURJKSA-N 438.528 2.176 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(S(C)(=O)=O)c(F)c3)CC2)cc1 1336289347 HUAIKOUZRHFEIW-UHFFFAOYSA-N 442.534 2.139 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3)C2)C1 1780617439 ZJEFSWIIFCJFAR-BVBLWJPBSA-N 442.443 2.099 10 20 IECD CC(C)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1783120666 FTTXRFTXRVTGDK-HSZRJFAPSA-N 426.517 2.045 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1805454703 OXGHZDPNTYKRJV-HRAATJIYSA-N 433.468 2.225 10 20 IECD CN(C)CCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811802718 ABRNQCVFPFIPMQ-QRWLVFNGSA-N 446.935 2.418 10 20 IECD O=C(C[C@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815602639 JVHYFZYBOUDDTD-ZBFHGGJFSA-N 429.477 2.481 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)c2cn[nH]c2)CC1 1827799068 JGBBMYYNCMPDEC-OAQYLSRUSA-N 448.527 2.436 10 20 IECD CCOC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)NC(=O)N[C@H]1c1ccccc1 109996812 JGXSWSAKSAYGAQ-KRWDZBQOSA-N 426.425 2.434 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)CN1CCOCC1 303886197 YZKFCTYZUVLYAZ-MRXNPFEDSA-N 444.498 2.310 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(CCNC(=O)c3ccccc3F)CC2)cc1 731218033 PFRITXPCPZBIPH-UHFFFAOYSA-N 427.524 2.149 10 20 IECD O=C(CCN(Cc1ccccc1O)C[C@H]1CCCO1)NN1C(=O)NC2(CCCCC2)C1=O 731844911 RCUAXSICTDGORE-GOSISDBHSA-N 444.532 2.049 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H](CC(C)C)N3CCCCC3=O)CC2)cc1 755249384 PGLJRWLPOMRBMU-QFIPXVFZSA-N 430.593 2.361 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](CC(C)C)N3CCCCC3=O)nc12 756573827 JBIOFTIDVPXGBC-INIZCTEOSA-N 432.477 2.082 10 20 IECD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NCCCSc2nccs2)CC1 759601546 NMTGZIOLJHIPRK-INIZCTEOSA-N 425.624 2.354 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](NC(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 760658684 VWBGEMFNIUZEBZ-IIDMSEBBSA-N 433.528 2.185 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2 764210663 LRJWXCBDPQRZPC-UHFFFAOYSA-N 447.557 2.241 10 20 IECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCc2cccc(Br)c2O)C1 764780595 PXPWJLSWTCNTNC-ZDUSSCGKSA-N 433.306 2.332 10 20 IECD CC(C)(C)S(=O)(=O)CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767827880 NEHQNCMKSRNKSR-UHFFFAOYSA-N 443.477 2.157 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 768032428 DJLOAVMZQOKEDZ-UHFFFAOYSA-N 444.532 2.336 10 20 IECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OC)c1 773756654 LVTAOYYYPVFTRZ-KBXCAEBGSA-N 428.485 2.467 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1 774362639 OQNZWOBRCQDTLN-UHFFFAOYSA-N 438.440 2.235 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(=O)(=O)c3cc(C)ccc3C)CC2)c1O 774820706 MVXHQAWWXVHDBX-UHFFFAOYSA-N 435.502 2.432 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 779490075 WWRJCOXSXIOACN-KXFIGUGUSA-N 440.880 2.437 10 20 IECD O=C(NCc1cn2ccsc2n1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 785585549 VKEUOZQAFWYLKV-CYBMUJFWSA-N 449.483 2.399 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(CNC(=O)C(F)(F)F)CC2)cc1 788940685 VFLGILVFBGOKJE-UHFFFAOYSA-N 442.482 2.066 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3nc(C4CCC4)cs3)cc2)C1 789382717 PAXHGOPCOGDUGM-MRXNPFEDSA-N 441.557 2.367 10 20 IECD CCS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793716311 BZDQWBSMHQBINS-CMKODMSKSA-N 446.617 2.185 10 20 IECD CCN1C[C@@H](C)N(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H]1C 803449068 NBMUWZUBVBQDDL-JKSUJKDBSA-N 438.519 2.314 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3ccccn3)cc2F)CC1 805009847 OYTSYDQURSFJJE-JOCHJYFZSA-N 439.535 2.343 10 20 IECD CCC1(CO)CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807769118 SCEWQZAPSTZTKM-MRXNPFEDSA-N 439.503 2.384 10 20 IECD COc1ccc(C[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 808818224 UHIJFLSJUURCBT-LJQANCHMSA-N 439.556 2.485 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1COc2ccc(Cl)cc2C1 916676599 MFBXPPIIXCMHBT-QGZVFWFLSA-N 434.945 2.442 10 20 IECD Cn1ccnc1[C@@](O)(CC(=O)NCc1ccc(N2CCSCC2)cc1)C(F)(F)F 917386619 HOTBJIUXOMUQAH-SFHVURJKSA-N 428.480 2.430 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1OC 917758079 GWKNCSZTQDSVOW-UHFFFAOYSA-N 445.475 2.174 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(C(=O)c2ccccc2)CC1 918220293 WDUKWHUFAMURSK-UHFFFAOYSA-N 440.519 2.454 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc([N+](=O)[O-])n3C)cc2F)C[C@@H](C)O1 919025755 PQERSKBLXPBBGR-OKILXGFUSA-N 448.451 2.159 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)c1 919823808 ABRHXQWVCLCIHE-UHFFFAOYSA-N 432.502 2.190 10 20 IECD COc1ccc(/C=C2\SC(=S)N(CCc3ccccn3)C2=O)cc1OCC(N)=O 1318154903 YNEUCJLVOBAKAX-BOPFTXTBSA-N 429.523 2.398 10 20 IECD CCOc1ccc(-c2nnn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2)cc1 1319427970 WHAPJTINPGLYLF-UHFFFAOYSA-N 440.479 2.031 10 20 IECD CN1CCN(c2ccc(CN[C@@H]3CC(=O)N(CCOc4ccccc4)C3)cc2F)CC1 1339507846 DONQNYUZGJEECL-HXUWFJFHSA-N 426.536 2.347 10 20 IECD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1cc(O)nc(O)c1 1788612235 HKYSDUIXRUYRPP-UHFFFAOYSA-N 438.400 2.186 10 20 IECD CCOc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1799572165 HXIGQKGTXQFYSB-QDMKHBRRSA-N 447.582 2.197 10 20 IECD COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1F 1803208518 UYQRVTOYFQIEEN-MUJYYYPQSA-N 429.448 2.135 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)C(F)F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1812648536 SGEWZIAIPKENFK-JTQLQIEISA-N 433.440 2.113 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ncc[nH]1 1816247742 QZNRDTPKIDVAFU-KRWDZBQOSA-N 446.471 2.232 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(Cl)nc2)[nH]n1)c1cc(O)nc(O)c1 1817842760 NFZYHMWXAOCHDG-ZDUSSCGKSA-N 443.851 2.279 10 20 IECD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1845901895 CUEBSEACAJSLEC-CQSZACIVSA-N 449.573 2.068 10 20 IECD Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 27797043 WPCQVOVJNLWJLJ-INIZCTEOSA-N 437.496 2.247 10 20 IECD CCOCCCN1CC[C@@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)[C@@H](C)C1 516592935 TYPJBUUKDMNHFC-FXAWDEMLSA-N 428.577 2.356 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@H](c2ccccc2)N2CCOCC2)n(C)c2ccccc12 556165662 PBWOZIAZNUZMFQ-HSZRJFAPSA-N 434.540 2.293 10 20 IECD CCCC(=O)N1CSC[C@@H]1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 727367340 LOVSWCPKESWGLL-HXUWFJFHSA-N 434.606 2.025 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(OC(F)(F)F)c2)SC1=S 728083273 HXKCTJGRORNSQV-FLIBITNWSA-N 426.463 2.336 10 20 IECD CCOCCN1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 729995194 RJMCBHZLZMZRIP-QGZVFWFLSA-N 435.524 2.443 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Br)nc3)CC2)cc1 746998897 QETJPQCDYCPFRG-UHFFFAOYSA-N 434.290 2.358 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H]1CC(=O)N(C2CC2)C1 750639786 YHUKNUKPBMOSQI-AWEZNQCLSA-N 426.439 2.105 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](S(=O)(=O)N(C)CCOC)C2)cc1 753400150 ZGWOTXSKIOOSSG-FQEVSTJZSA-N 440.610 2.115 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C)nc3Br)nc12 756425661 JRQZPRXPBQMHRR-UHFFFAOYSA-N 435.234 2.435 10 20 IECD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)cc(Cl)c1O 756739060 QYSRKCKSULTICY-JSGCOSHPSA-N 446.773 2.392 10 20 IECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN(c4ccccn4)C3)CC2)cc(OC)c1OC 759292243 FGDVUVVLVIMRQO-QGZVFWFLSA-N 441.532 2.218 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H](N(C)C)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759967628 RJBAQNAAAKSTBJ-SFHVURJKSA-N 432.590 2.340 10 20 IECD COC(=O)[C@H]1CCN2C(=O)N(C3CCN(c4ccc(OC(F)F)cc4)CC3)C(=O)[C@H]2C1 761158223 JJPAMMUVUDGIJC-SUMWQHHRSA-N 437.443 2.473 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)cc3[N+](=O)[O-])CC2)cc1 766928275 ZAUACHKLSLQPIK-UHFFFAOYSA-N 437.474 2.132 10 20 IECD O=S(=O)(c1ccc(Cl)s1)N1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768445301 RHOREOKORTURJB-OAHLLOKOSA-N 444.962 2.430 10 20 IECD C[C@@H](CCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769518279 VFKVBUNTGKQOTF-KRWDZBQOSA-N 441.553 2.086 10 20 IECD NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769733406 VUDGCDHAKHQXRT-MRXNPFEDSA-N 445.522 2.081 10 20 IECD CC[C@H]1CN([C@H](CC)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 773734525 SCLLJHVXTFTGEJ-JTHBVZDNSA-N 432.609 2.213 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(NCc2cccc(Br)c2O)CC1 775151858 JCPYAKQKNLHPLU-UHFFFAOYSA-N 443.367 2.438 10 20 IECD CCN1C(=O)[C@@H]2CN(Cc3cc(Br)cc(Br)c3O)CCN2C1=O 775736267 QVLWIXPTNQPRNL-LBPRGKRZSA-N 447.127 2.386 10 20 IECD COC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)OC 778501033 FJZUCGYZLQPOLV-OQZOHAQUSA-N 428.557 2.034 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 788823858 QSNTZNWTKUOQEC-UXHICEINSA-N 436.556 2.343 10 20 IECD CCCCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 789799518 IJYNAIOOSVYZOB-UXHICEINSA-N 435.540 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3N(C)CCCC3(C)C)CC2)cc1 791146365 QEPILCHBTULBPO-XPTLAUCJSA-N 428.577 2.137 10 20 IECD Cc1cc(C(=O)CN2C[C@H](C3CC3)O[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791561493 YQSXPENMJJVSHG-IVZQSRNASA-N 431.558 2.424 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)N3CCC[C@@H](C)C3)CC2)cc1 793913182 QHBFFOMRNPUJQE-LJQANCHMSA-N 430.593 2.361 10 20 IECD O=S(=O)(c1cccc(NCc2ccc(N3CCOCC3)c(F)c2)c1)N1CCOCC1 796383138 DQJSBYPGLIPVRH-UHFFFAOYSA-N 435.521 2.295 10 20 IECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1F 796706621 CQOJPLSHEJUKDO-UHFFFAOYSA-N 447.438 2.437 10 20 IECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306726 WXZJCHZFYADTPQ-DENIHFKCSA-N 430.593 2.471 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687081 TWFNYNMCOWLKFY-YLJYHZDGSA-N 428.577 2.229 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315951 WBGDSMSMVWDJLE-HXUWFJFHSA-N 425.529 2.154 10 20 IECD Cc1cc(C(=O)OCCn2cc(C(N)=O)nn2)c(C)n1-c1ccc(Br)cc1 805946036 RIFKDXMDNFLTAX-UHFFFAOYSA-N 432.278 2.404 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806282032 FXFVJBGWVQTSSI-UHFFFAOYSA-N 438.550 2.238 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)cc2F)C[C@@H](C)O1 808918950 KHMPGXSZENSRHV-OKILXGFUSA-N 441.459 2.365 10 20 IECD Cc1cc(N2CCC[C@@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2)n(C)n1 809871080 DFAHWWQYELTHAJ-LJQANCHMSA-N 438.576 2.071 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918122485 LMRXOPQVOPMQNJ-FQEVSTJZSA-N 443.592 2.177 10 20 IECD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442228 BZFXKBYFVNPATD-UHFFFAOYSA-N 440.500 2.329 10 20 IECD C[C@H](OC(=O)c1ccn(C)c(=O)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919267983 OPPPFYSZHYGJRS-ZDUSSCGKSA-N 430.416 2.345 10 20 IECD COCCCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 919793982 BURPWEVRKYBQEC-UHFFFAOYSA-N 445.491 2.333 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cc(OC)ccc3OC)CC2)cc1 920254384 IUYQJTWCUNTBPG-KHPPLWFESA-N 439.512 2.234 10 20 IECD Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C(=O)N3CCC[C@@H](C(N)=O)C3)C(C)C)sc2n1 924232445 FKCVHJURYNNFTI-CZUORRHYSA-N 432.546 2.401 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC(=O)N1Cc1ccc(C)cc1 1323859988 MIZGZQWTXZLAAD-RBUKOAKNSA-N 440.496 2.188 10 20 IECD O=C(/C=C/c1ccsc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804331454 YAHPCFNKRAESGS-NLVNQHKVSA-N 435.596 2.260 10 20 IECD CC(C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992893 DIGIRXDNDWAPRB-MGPUTAFESA-N 428.489 2.023 10 20 IECD Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807993518 JORPNVJQEBQKAZ-FDDCHVKYSA-N 447.495 2.154 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547648 WWSDHTPPYHTEEO-UHFFFAOYSA-N 427.505 2.002 10 20 IECD O=C(c1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426797 HUDWYIWQOUCCNZ-GOSISDBHSA-N 426.473 2.141 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1CCCC1)CCO2 1834653403 YJNMDGPDWOEDFB-OAQYLSRUSA-N 438.908 2.011 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CCc2cnc3ccccc3c2)C1 1841251985 FHPJUMZEAOQXBJ-UHFFFAOYSA-N 432.480 2.491 10 20 IECD O=C(Cc1csc(N2CCCC2=O)n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 302964209 GZKKYLIBIJDJOT-UHFFFAOYSA-N 432.521 2.229 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ccc(F)c(F)c3)CC2)cc1 730123633 UHJCAGSKWJVZNL-UHFFFAOYSA-N 434.487 2.474 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3C)CC2)cc1 734074372 SEGOMHONOKEYKG-UHFFFAOYSA-N 445.541 2.085 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)nc2c1c(=O)n(C)c(=O)n2C 737844548 RGESYWDYJPVFCK-UHFFFAOYSA-N 435.528 2.107 10 20 IECD CC(C)S(=O)(=O)CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742751772 WOFPQMKBVZULAL-KRWDZBQOSA-N 427.567 2.258 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(F)cc1F 743394603 CYNPILHHEPXTMO-UHFFFAOYSA-N 432.427 2.015 10 20 IECD CC(C)(C)NS(=O)(=O)CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743591851 IQJULCWTTCSZCG-AWEZNQCLSA-N 448.536 2.274 10 20 IECD C[C@@H](NC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 743900974 SRYFKXSGLDDGJK-QGZVFWFLSA-N 446.507 2.338 10 20 IECD COC[C@H](NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 745735887 BVRSYEHZUCQIDQ-IBGZPJMESA-N 430.528 2.413 10 20 IECD Cc1ccc(S(=O)(=O)NCCN(C)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 745787921 CDLYGVZTFMYOEN-UHFFFAOYSA-N 430.574 2.497 10 20 IECD CCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 747980050 PQCMDLVZNSPXCT-VQTJNVASSA-N 443.592 2.226 10 20 IECD COc1cc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1 759872010 GDINXXOIWZGNAU-UHFFFAOYSA-N 445.516 2.490 10 20 IECD CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)cc1)C2=O 768561768 FYNNPFWAVPZYRZ-QHCPKHFHSA-N 428.533 2.030 10 20 IECD CC[C@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769863516 KNCKRIPJJNMMCW-AWEZNQCLSA-N 435.458 2.352 10 20 IECD COc1c([N+](=O)[O-])ccc([C@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)c1O 772177116 LMNKTIXUQAZBJH-KRWDZBQOSA-N 426.389 2.317 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1O 775015428 ZBSYMYJACVZVJJ-UHFFFAOYSA-N 435.502 2.500 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)cc1 778252489 LEEZITRZFYOOGY-KHPPLWFESA-N 440.519 2.422 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CCCO)Cc3ccccc3)CC2)cc1 778389815 RCTVBWUVMLOSLI-OUKQBFOZSA-N 437.540 2.311 10 20 IECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccn1 778553542 WWXSHZKAMMYJAW-UHFFFAOYSA-N 426.517 2.332 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)Nc3cccc(C)c3C)CC2)cc1 779218094 AFECRZHQPZSXTR-JOCHJYFZSA-N 440.588 2.365 10 20 IECD Cc1nc(CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)no1 781436095 LHDJXXQNRWENLV-UHFFFAOYSA-N 447.429 2.065 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cn2cc(Cl)ccc2n1)c1ccc(N2CCOCC2)cc1 786502193 JVKGVZNOGQXPRS-OAHLLOKOSA-N 441.919 2.318 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(OCC(F)(F)F)nc3)ccc21 787278025 PKHQPVQUAIBBBY-UHFFFAOYSA-N 436.434 2.338 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)CN3CCOCC3)cc2Cl)C1 787755915 JUWXPJSUYGNMPJ-IRXDYDNUSA-N 436.984 2.029 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1 788032005 VIMDBFZRHBGDQT-UHFFFAOYSA-N 442.535 2.208 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934319 VVGSTWLVWJJBGB-IBGZPJMESA-N 430.549 2.419 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC4(CCOCC4)C3)cc2F)C[C@@H](C)O1 789826236 PHDPPRVIFDRBKS-CALCHBBNSA-N 433.524 2.085 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H](CCCO)c1ccccc1 789841064 QZTJRBKNCYBZFU-NRFANRHFSA-N 443.519 2.033 10 20 IECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1ccccc1 789856142 OWPQKMHCFYMBKO-VXKWHMMOSA-N 438.597 2.418 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1 792225298 QRTMJPPQEGEEEC-CQSZACIVSA-N 435.484 2.345 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1O 792229390 QXGTWEOCGOUBQH-UHFFFAOYSA-N 440.544 2.495 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](Cc3ccccc3)CN(C)C)CC2)cc1 793723846 NTCIYFDOUWPLNI-OAQYLSRUSA-N 438.572 2.023 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccoc3C3(O)CCOCC3)CC2)cc1 798277070 MRPKKSCKEYXYGQ-UHFFFAOYSA-N 443.544 2.228 10 20 IECD CC(C)n1cc2c(n1)[C@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)CCC2 806301643 YTJKURQKXRYUOX-OAQYLSRUSA-N 439.560 2.453 10 20 IECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)CC2 807292881 BCNZAIJKJPGJJB-VQTJNVASSA-N 440.544 2.351 10 20 IECD CCn1cc(CN(C)C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 807768759 BDQYFCVKYJNIRJ-INIZCTEOSA-N 435.475 2.248 10 20 IECD O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NCc1cc(Cl)cc(Cl)c1O 813684632 TUMMRSBZYNUKBN-INIZCTEOSA-N 430.332 2.029 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@H](NC(N)=O)c3ccccc3)CC2)cc1 849192493 TVZTWVSMKSLHCW-QFIPXVFZSA-N 439.560 2.123 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1ccnc(N2CCOCC2)c1 916388976 LXKWJRHXSXHVKT-UHFFFAOYSA-N 427.574 2.471 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(S(C)(=O)=O)ccc3C)CC2)cc1 917759404 QNSORUKJHMCQDC-UHFFFAOYSA-N 438.571 2.308 10 20 IECD COCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 918311395 QPHFQHANVZRQGW-UHFFFAOYSA-N 441.528 2.454 10 20 IECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918633828 PHAGWGOMQNJPRV-TXEJJXNPSA-N 439.509 2.227 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cc(OCC(F)F)ccn3)cc2)C1 1116507416 LIZOXTUOQYJNIC-MRXNPFEDSA-N 447.486 2.427 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 1321366126 GVCXIPDCVNHTON-CJNGLKHVSA-N 448.422 2.020 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2ncon2)CCO3)cc1 1781754498 XGQRKFJUNMHLQS-HSZRJFAPSA-N 435.484 2.234 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C34CCC(CC3)CC4)[C@H]2C1 1791762667 LXFQBOPVTULNJN-UPQNXWCWSA-N 429.517 2.057 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)C3=COCC3)cc2)CCC1 1791999210 LCUGQSDHURMBNF-UHFFFAOYSA-N 431.539 2.285 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CCOCC1 1795898064 QTXXFCSTSAAEEW-YBXVHQAYSA-N 430.501 2.272 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)ccc1O)C1=NN(c2ccccc2)C(=O)C1 1800754759 ZGTMMPKVNQVZOF-ACHSLPGTSA-N 448.479 2.143 10 20 IECD Cc1nscc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991739 SNTBEJAAHUGXEC-KUHUBIRLSA-N 439.497 2.286 10 20 IECD Cc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)s1 1808907694 ZKDKYMHVIAUNLC-KUHUBIRLSA-N 439.497 2.286 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1C[C@H]2CC[C@@H]1O2 1822212475 QFTUFEVMACGXKC-VDERGJSUSA-N 427.461 2.089 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1 1823082032 BXPLEQBWESAYIL-LBPRGKRZSA-N 439.538 2.154 10 20 IECD O=C(c1cc(O)ccc1O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429238 HDOXJPIOLFHXPQ-SFHVURJKSA-N 441.484 2.451 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829165847 GKOZKXSTMTWGNX-QGZVFWFLSA-N 427.505 2.380 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cnccn2)CC1 1832260488 VVRZJIMRPBGJLU-LJQANCHMSA-N 439.516 2.149 10 20 IECD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccc1C=O 1843022538 NUQXDLKFDGDBMY-CYBMUJFWSA-N 431.876 2.443 10 20 IECD O=C(c1cnc2snnc2c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501658 NEEIGFSDBDOZLZ-UHFFFAOYSA-N 445.888 2.282 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)COC1CCCCC1 1847443796 OIDXTBBQONDEIQ-AZGCOUAMSA-N 430.501 2.368 10 20 IECD Cc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cn1 23519179 WQUZOAKXQHUPQU-UHFFFAOYSA-N 427.482 2.485 10 20 IECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1=O 554728463 VXPGAHCENJPTTP-QGZVFWFLSA-N 434.496 2.033 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(SC)nc3)CC2)cc1 727230880 WHMMGXFSKGDFIY-UHFFFAOYSA-N 443.573 2.079 10 20 IECD CCN(CC)S(=O)(=O)N1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728195437 SAMLVWXZUSAFOX-UHFFFAOYSA-N 447.557 2.033 10 20 IECD CC(=O)N1CCCCC[C@H]1C1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 731833808 KFXGSUSBZNZFAH-IBGZPJMESA-N 437.562 2.407 10 20 IECD COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C(=O)N(C)C 734494976 LHWYRYQBJYLQCM-MRXNPFEDSA-N 447.557 2.273 10 20 IECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(c3cccc(OC)c3)C2=O)cc1 739922902 PXEHDEZPRQPWMY-JOCHJYFZSA-N 426.473 2.029 10 20 IECD O=C(CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)NC1CCCCC1 740919377 PSGWZGVEKRTYLM-UHFFFAOYSA-N 425.577 2.339 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2C=CS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742750402 MXTRIWUKCTWDDJ-YJBOKZPZSA-N 437.562 2.383 10 20 IECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Cl 746039807 WSNRFVANSPCZMS-UHFFFAOYSA-N 435.933 2.138 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)NCCNS(=O)(=O)c3cccnc3)c2C)cc1 746276352 WPWRCAKESOECRS-UHFFFAOYSA-N 428.514 2.206 10 20 IECD CC(C)c1nnnn1CC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747027246 RIPOKKGRZIBPJB-ZDUSSCGKSA-N 447.451 2.142 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(C(C)(C)CO)CC2)c([N+](=O)[O-])c1Br 751224783 FLEDKJQRHYAWLC-UHFFFAOYSA-N 433.259 2.167 10 20 IECD COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751229116 UBRLBCOTGKGXAK-UHFFFAOYSA-N 436.505 2.360 10 20 IECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753740111 NKVNNJAKYBXMJN-UHFFFAOYSA-N 439.484 2.234 10 20 IECD COC(=O)c1coc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 754022825 XYFWXRKLCZZMAK-HNNXBMFYSA-N 428.894 2.368 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)ccc3Cl)CC2)cc1F 754027915 JOHVNKLIBDUHKD-UHFFFAOYSA-N 427.885 2.098 10 20 IECD CS(=O)(=O)CC[C@H]1NC(=O)N(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 757916398 SOJVYQGXVHEJAV-QGZVFWFLSA-N 443.485 2.396 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3ccc(S(C)(=O)=O)cc3)CC2)cc1 758216595 MEEBZKAJUMCCPE-SFHVURJKSA-N 436.599 2.374 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3ccc4nc(O)[nH]c4c3)CC2)cc(OC)c1OC 759876628 AUIYZEDMXXFBQX-UHFFFAOYSA-N 441.488 2.055 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCCC[C@@H]3N3CCOCC3)cc2F)CC1 763658714 XMKPCKNYIJFQMT-GGAORHGYSA-N 447.599 2.410 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc21 765902808 DTQPFICHMNCEBM-UHFFFAOYSA-N 432.274 2.319 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(Cl)cn3)CC2)cc1 772854710 WCQCFQQBXLGRFX-UHFFFAOYSA-N 431.924 2.011 10 20 IECD O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775031451 AFONPBUFVHPWCW-FGZHOGPDSA-N 437.540 2.291 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCCCC4)O3)cc2)C1 775758266 BLIZWTLXLRJCSO-AZUAARDMSA-N 430.549 2.263 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 782859810 KFZUACXZIPWBTD-UHFFFAOYSA-N 443.504 2.369 10 20 IECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785527122 ASHLBLWDMDQBDU-DENIHFKCSA-N 430.593 2.409 10 20 IECD O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NCc1ccc(N2CCCC2)cc1 786350704 NEHPKZAVAGEESL-UHFFFAOYSA-N 434.540 2.455 10 20 IECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)nn1 786558570 XCKZISUKLVLOSZ-UHFFFAOYSA-N 428.420 2.346 10 20 IECD C[C@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 787908055 GNYISLNYEQYNJH-SFHVURJKSA-N 448.583 2.031 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1 788978265 WQJMFAMXGSYSNM-GOSISDBHSA-N 445.585 2.436 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@@H](O)Cc4ccccc43)cc2F)C[C@@H](C)O1 789352033 CYTZTDOQKOHBFZ-QKLQHJQFSA-N 427.520 2.479 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCC1(N2CCSCC2)CCCC1 789706947 TWHNLQHZCTZAJG-UHFFFAOYSA-N 428.602 2.157 10 20 IECD CC(C)C[C@H](CCO)CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789828338 XMQYUYNUDIZNPU-LMMKCTJWSA-N 437.556 2.216 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)O1 789948474 BCNUWDYDOOZPRW-RHSMWYFYSA-N 443.466 2.184 10 20 IECD COC(=O)CN(CCN1CCN(C)CC1)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 799035868 ONKMRAUUQCRHTK-UHFFFAOYSA-N 426.561 2.265 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1 804519559 TXWQTWNSAYVRIL-UHFFFAOYSA-N 448.614 2.015 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3nc(C)n(C)c3Br)CC2)cc1F 805032361 YRSUCNSVYCKYMB-UHFFFAOYSA-N 447.330 2.150 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc(OC)c1OC 807652619 XOVALMDJIYTVIM-OKZBNKHCSA-N 445.560 2.446 10 20 IECD CN(Cc1ccccc1S(N)(=O)=O)C(=O)NCc1ccc(N2CCSCC2)cc1 814283888 LHKMOAKBYGCRSU-UHFFFAOYSA-N 434.587 2.229 10 20 IECD COc1cnc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc1 815524942 MYDLGTSESNEBCE-GFCCVEGCSA-N 431.404 2.445 10 20 IECD Cc1cc(CC(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c(C)n1-c1ccc(Cl)cc1 916789480 ZSZPYJMDRNFZEB-UHFFFAOYSA-N 448.932 2.233 10 20 IECD CN(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 917734798 GLMZTVSVCSYPSZ-UHFFFAOYSA-N 431.923 2.214 10 20 IECD C[C@@H]1CN(Cc2csc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)C[C@@H](C)O1 919810438 VEZOETIMSIPTKD-VXGBXAGGSA-N 440.547 2.082 10 20 IECD CN(C)C(=O)COc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969517 OPEXZTCHLZKOBN-UHFFFAOYSA-N 429.492 2.184 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 1325763024 LWXFYQUUGZQKIF-INIZCTEOSA-N 428.420 2.030 10 20 IECD Cc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)c1 1780932137 WCDSYPFIPIJJMA-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1799385390 XXHDTGTZVLJVLN-BJWYYQGGSA-N 433.468 2.449 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1808000162 XMKCGWKUZMFETD-OPAMFIHVSA-N 436.468 2.352 10 20 IECD COC(OC)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811797906 XHMDCUPCYYTGFT-GUYCJALGSA-N 449.891 2.085 10 20 IECD Cc1nn(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1F 1816242915 HXWULUPNSIUAPP-ZDUSSCGKSA-N 443.439 2.017 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817848413 IKTCVWMJAXUILT-BBRMVZONSA-N 439.476 2.288 10 20 IECD COc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427033 MYSFTXWEPQMZCW-SFHVURJKSA-N 440.500 2.444 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC)c(OC)c3)CC2)cc1 38588990 KYSYWEMXKAQGOX-UHFFFAOYSA-N 428.533 2.334 10 20 IECD CN1CCC[C@H](N2CCN(CC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2)C1 261467510 WENGAORBQGILIE-SFHVURJKSA-N 446.551 2.112 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCNS(=O)(=O)c3ccc(C)cc3)CC2)cc1 726612552 CLOWRWAIQOSTIK-UHFFFAOYSA-N 446.573 2.250 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1nccn1CC(F)(F)F 728570414 JXGIAVZDFLFQCT-UHFFFAOYSA-N 443.445 2.169 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCN([C@@H]2CCC[C@H]2O)CC1 728751916 WZACKEYPTYSVPQ-WOJBJXKFSA-N 438.519 2.497 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](CNS(N)(=O)=O)C3)c2C)cc1F 730570280 DRBGBOOCDXRJJR-QGZVFWFLSA-N 436.553 2.229 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCO)CC(F)(F)F)cc2F)C[C@@H](C)O1 731214011 OMTFHPJGFVBUGC-GASCZTMLSA-N 435.462 2.302 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2cc(OC)ccc2O)s1 734065067 UEACKMFBNNGOGR-UHFFFAOYSA-N 427.548 2.492 10 20 IECD COCCOC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 735078071 VZUNHNHHQZWVJE-QZTJIDSGSA-N 437.556 2.183 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nnc(C(F)(F)F)s1 738887839 LVEGDRKFEJWHPJ-UHFFFAOYSA-N 435.453 2.113 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@@H](C(F)(F)F)C3)CC2)cc1 740469926 YOOAFONUFZTQKZ-GOSISDBHSA-N 430.471 2.180 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 742948181 NUIUIEMUCJBJNO-UHFFFAOYSA-N 447.580 2.080 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(OCCN2CCCC2)CC1 745649790 XXAVDMRQQSDFEL-UHFFFAOYSA-N 434.556 2.449 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)N1CCSCC1 745811305 VZVKYKVTLABGCU-UHFFFAOYSA-N 428.624 2.051 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CC(=O)N(CCN4CCOCC4)C3)c2C)c1 749394258 UWSWRKWVMUHRGN-OAQYLSRUSA-N 438.572 2.374 10 20 IECD C[C@H](N1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1)C(F)(F)F 749555578 QGEWFWWFAGHGSF-DOTOQJQBSA-N 441.498 2.166 10 20 IECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NCCCSc3nccs3)ccc2O1 751989745 LBGJQJFOHBBEKP-HNNXBMFYSA-N 428.557 2.470 10 20 IECD COC(=O)[C@H]1COCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 752346970 MKRHLCGYJCDHQQ-PCRWRXJSSA-N 440.568 2.130 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(COC3CCOCC3)cc2)c1 752628222 ZYQPDBZUWXRZJR-UHFFFAOYSA-N 434.514 2.389 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@H]2CCOC2)n1C[C@@H]1CCOC1 752848018 GDXWQGMMDYSCAX-PMACEKPBSA-N 427.549 2.292 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1cccc(C(=O)N2CCSCC2)c1 759598430 WWLQGEKUNDSNQR-FNORWQNLSA-N 442.493 2.482 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 762234057 VTRSEVRCPNUHAX-UHFFFAOYSA-N 435.477 2.169 10 20 IECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762461371 QXFTVJYDPDPLDI-LBPRGKRZSA-N 443.401 2.473 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccnc1OCC(F)F)c1ccc(N2CCOCC2)cc1 765860500 NSLBTQSNLDKGTO-AWEZNQCLSA-N 434.443 2.378 10 20 IECD CCN1CCN(c2cccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)CC1 770749527 UUFZBSOYPLOFRS-UHFFFAOYSA-N 433.556 2.460 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc([S@@](C)=O)c(F)c3)CC2)cc1 774210052 QDCWDEIFGMRNQD-SSEXGKCCSA-N 433.505 2.295 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(=O)(=O)N(C)C4CCCCC4)CC3)cc2)CC1 775656158 BBOFXPDIMXDWEA-UHFFFAOYSA-N 449.665 2.065 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccc(F)cc4C3=O)cc2F)C[C@H](C)O1 776284621 APIBXNGTQNCPIK-KBPBESRZSA-N 443.450 2.491 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](O)[C@@H](O)c3nc4ccccc4[nH]3)cc2F)C[C@@H](C)O1 779607792 UFCABMNDBXRSAX-RZVAPFGTSA-N 442.491 2.026 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 782052850 IOWFXPMVKFZCSH-NRFANRHFSA-N 436.622 2.037 10 20 IECD COCCCN(C(=O)/C=C/c1cnccc1C)c1c(O)nc(=O)n(Cc2ccccc2)c1N 783707742 RCEVLCMRLYPCSL-MDZDMXLPSA-N 449.511 2.366 10 20 IECD CO[C@H]1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2C1 784639177 RWYRVCRBPVZKHJ-IBGZPJMESA-N 427.476 2.031 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1 785439930 XPGQOBRTFONOIO-UHFFFAOYSA-N 441.507 2.321 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1 788328679 JYZLQAOWKGAQFJ-JTQLQIEISA-N 426.878 2.274 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(NC(C)=O)nc3)CC2)cc1 788857650 WTHAZGLXDAFBNL-UHFFFAOYSA-N 440.548 2.060 10 20 IECD COc1cc(Cl)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797596 BGTNSOONBHNILH-UHFFFAOYSA-N 435.883 2.257 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ncsc4C3)cc2F)C[C@@H](C)O1 789823243 ZQJCMQOOGWBJOG-ZIAGYGMSSA-N 432.521 2.097 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc(Cl)cc(C(=O)N(C)C)c2OC)c1O 792983324 SRQNLLGJRGMMMR-UHFFFAOYSA-N 435.864 2.020 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2cccc(S(C)(=O)=O)c2)n1C 800735362 WBMOCUVJQOSPBF-UHFFFAOYSA-N 441.557 2.359 10 20 IECD C[C@H](NC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 804988521 CRGBDQDZVZGNIT-MAUKXSAKSA-N 430.471 2.147 10 20 IECD Cc1cccn2cc(CCNC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)nc12 806538176 XXDOSYLTTAHJPZ-UHFFFAOYSA-N 437.569 2.171 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1 808104439 KTACXIOURYMSFB-UHFFFAOYSA-N 443.522 2.167 10 20 IECD Cc1nc2ccc(NC(=O)C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2n1 810396645 LYIUFZROHFMYKM-MRXNPFEDSA-N 442.907 2.116 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)c1 813614795 RCMCELQZEBTDIF-GDBMZVCRSA-N 436.490 2.366 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)cc2)C1 917832132 KLRMJOVGDUQMNC-GOSISDBHSA-N 448.483 2.412 10 20 IECD COc1cc(OC)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC 917833035 KUFKMIFWMMPTAD-INIZCTEOSA-N 427.501 2.344 10 20 IECD COCCOC(=O)C1=C(C)N(CC2CC2)C(=O)N[C@H]1c1ccc(N2CCOCC2)cc1 918074278 ZDAWSNUSELQBIX-NRFANRHFSA-N 429.517 2.463 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc([N+](=O)[O-])n3C)cc2F)C[C@H](C)O1 919025754 PQERSKBLXPBBGR-KBPBESRZSA-N 448.451 2.159 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccn(-c4ccc(F)cc4)n3)nc12 919106116 WIJGVCNJWUIEBO-UHFFFAOYSA-N 425.376 2.293 10 20 IECD C[C@H](NC(=O)NCc1ccc(NS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 920872939 YVQYPKBRTFRWFR-INIZCTEOSA-N 432.546 2.455 10 20 IECD C[C@@H](NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 920881988 UGDCCFKYSUIMGZ-CRICUBBOSA-N 448.523 2.094 10 20 IECD Cc1ccnc(O)c1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1321447800 HBAJRWLROFKUES-GJZGRUSLSA-N 431.464 2.322 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@H]3c3cccn3C)cc2F)C[C@@H](C)O1 1321602063 HRBGTYFYEMTBTI-IXFSTUDKSA-N 444.551 2.468 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2 1782003132 CSXLDZSZEGBSSO-INIZCTEOSA-N 440.777 2.095 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2nccn2C)cc1 1794873955 MMXOZFISKMOEGJ-VTYHHJSWSA-N 447.539 2.345 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cscn1)C1=NN(c2ccccc2)C(=O)C1 1796241964 FJTMXDQHWOOAAO-GBEXYDAJSA-N 437.525 2.117 10 20 IECD C=C(Oc1ccccc1O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601229 HNLINIUIVQQLMH-MUJYYYPQSA-N 425.441 2.043 10 20 IECD O=C(CSC1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334842 XZAUZKCKNBUIBD-BTTYYORXSA-N 441.644 2.161 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3snnc3C3CC3)CC2)C1 1810551193 DSHRLMTXCGOZSU-UHFFFAOYSA-N 443.529 2.380 10 20 IECD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1(O)CCC1 1814423243 ZLVUFFYUDSSSAM-DOMZBBRYSA-N 429.477 2.073 10 20 IECD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825335632 YTJZERVKBSGHNM-LPHOPBHVSA-N 441.532 2.259 10 20 IECD C[C@@H](CN)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826801729 FGSUJWNFRQFPGK-UCSQHBGMSA-N 431.533 2.031 10 20 IECD O=C(C1CC(O)C1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832874526 BKCVVIWKQTXYCG-KUTQSGRNSA-N 444.528 2.207 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3n[nH]cc3c2)C1 1843255358 NRILJIZRPKHAKT-UHFFFAOYSA-N 442.479 2.173 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccncc2Cl)C1 1844442255 OCIUXEIBAYZESB-HWKANZROSA-N 429.860 2.382 10 20 IECD O=C(c1ccc2occc2c1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054801 ZZJLKUGNZXJDLC-UHFFFAOYSA-N 429.523 2.110 10 20 IECD C=C1c2ccccc2C(=O)N1CC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 21583736 KMESLDXPMZGMDW-UHFFFAOYSA-N 435.480 2.014 10 20 IECD NC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 23045999 JZRMLYFEXIJBBG-UHFFFAOYSA-N 428.400 2.356 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 437010736 RTONMRCSPBIERE-UHFFFAOYSA-N 443.447 2.475 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1ccccc1N(C)S(C)(=O)=O 466441807 NZUZREYBDQNKIN-UHFFFAOYSA-N 433.511 2.039 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2csc(Br)c2)SC1=S 727176341 KAFODYRCLOURBG-XBXARRHUSA-N 427.392 2.261 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(OCCN(C)C)CC3)cc2F)CC1 734276391 ZMCAXIISMVIWKM-UHFFFAOYSA-N 435.588 2.220 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3nc4c(s3)COCC4)cc2F)C[C@H](C)O1 735584178 FJWYIQKARWLQTP-STQMWFEESA-N 448.520 2.223 10 20 IECD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 736196299 QTRMPOQEULRNPA-UHFFFAOYSA-N 449.548 2.215 10 20 IECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 737283734 FTRWJRXRUMPKBS-UHFFFAOYSA-N 427.457 2.043 10 20 IECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800489 SMQJUUHVQSCIOD-IYNKWVJVSA-N 445.466 2.180 10 20 IECD Cc1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(O)n1 744535760 JIFSTXTVLWGUPI-GASCZTMLSA-N 431.464 2.322 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2cc(S(=O)(=O)N(C)C)ccc21 749926906 QGRBXWCKDJRRLI-UHFFFAOYSA-N 430.574 2.024 10 20 IECD O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227912 NIRKOSQCYXJUGF-UHFFFAOYSA-N 427.429 2.313 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN(C)C[C@@H](O)CN3CCOCC3)c2C)cc1 751486130 UHWBZHXSDVKIFZ-OAQYLSRUSA-N 429.561 2.300 10 20 IECD Cc1cc(S(N)(=O)=O)cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 751980630 NRXAYOZMKLCDJH-UHFFFAOYSA-N 431.558 2.090 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4c(ncn4-c4ccccc4)C3)CC2)cc1 754243502 VHOOIVXAAPLORE-QHCPKHFHSA-N 447.583 2.422 10 20 IECD CCn1c(/C=C\c2cn(CC(=O)O)nn2)nc2cc(S(=O)(=O)C(F)(F)F)ccc21 759074436 DJOKQKDUGQEVGM-UTCJRWHESA-N 429.380 2.196 10 20 IECD CN(C)c1ccc(N(Cc2ccc[nH]2)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 760190497 UMLVJSNJBLWXIJ-UHFFFAOYSA-N 425.514 2.112 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](N2CCCC2=O)C1 761115540 SZFFNAKRGMXKNL-RDJZCZTQSA-N 431.492 2.486 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 761983017 PSJRVTFBJOPQLV-CQSZACIVSA-N 443.978 2.078 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@](=O)C1 762550574 ZGQFUUVYLGUYFK-QDXKXIGTSA-N 428.557 2.095 10 20 IECD O=C(COC(=O)c1cc2n(n1)CCCO2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 763349349 YLOSETRLNRWBFF-UHFFFAOYSA-N 431.404 2.237 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765904395 SWSAIRSKMCCSIJ-UHFFFAOYSA-N 445.277 2.083 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3COc4cc(OC)ccc4C3)CC2)cc1 768055781 UJESSRHKLVKEQI-IBGZPJMESA-N 440.544 2.129 10 20 IECD CCCC[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768523130 XUCREGHDABGUHV-RKVPGOIHSA-N 434.512 2.166 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2nccnc2c1 769024876 UFJLUNUKPFEIPQ-UHFFFAOYSA-N 444.539 2.417 10 20 IECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@H](C)CN1C 770165824 STEQFDKUGGEWTN-ZIAGYGMSSA-N 448.501 2.266 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(-c5nc[nH]n5)c4)n3)CC2)cc1 771057586 PZEFYVUUAOVBMI-UHFFFAOYSA-N 445.483 2.422 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSC4(CCOCC4)C3)CC2)cc1 771581412 XRYSVZULBPRVQH-VOTSOKGWSA-N 445.585 2.025 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 771790660 FLDCSTBCHYMNGS-UHFFFAOYSA-N 432.546 2.012 10 20 IECD C[C@H](NC(=O)CSCCOc1ccc(S(N)(=O)=O)cc1)c1ccc(N(C)C)cc1 775405214 RVKNPIVSWXFLEI-HNNXBMFYSA-N 437.587 2.389 10 20 IECD CC[C@H](NCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1)c1ccccc1O 775526361 RBYRKRGSKSXPPT-SFHVURJKSA-N 442.559 2.238 10 20 IECD C[C@@H](NC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 777469815 NTBXSUJTCNQGSE-GDBMZVCRSA-N 428.455 2.294 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3COc4ccccc4C3)CC2)cc1 778220775 CLFPATFAOUBFBT-OEIFXAAASA-N 435.524 2.268 10 20 IECD COCCN(C(=O)CN(C)c1ccc(OCc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1 781964432 UWBQEIWPQFKXII-NRFANRHFSA-N 446.569 2.364 10 20 IECD CCc1csc(-n2cc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)cn2)n1 786262447 MCKZGAISIMXVMK-UHFFFAOYSA-N 438.557 2.490 10 20 IECD O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)NCc1ccc(N2CCCC2)cc1 787852703 SFGFKECYNMEZGC-UHFFFAOYSA-N 449.599 2.232 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 788281088 RFFBUCZMBJIFFU-GOSISDBHSA-N 428.533 2.195 10 20 IECD CC(C)C[C@H](CCO)CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828343 XMQYUYNUDIZNPU-SCTDSRPQSA-N 437.556 2.216 10 20 IECD C[C@@H]1C[C@@]2(CCO1)CN(C(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)C[C@@H](C)O2 789862547 VSBQUXDNAVVHSM-PNCHPQGNSA-N 447.601 2.041 10 20 IECD CO[C@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 790911351 GXIDJCXHAOANGU-FQEVSTJZSA-N 443.475 2.387 10 20 IECD CCCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H](COC)C(=O)O 797710130 SRUQGXOSVZWCOQ-YZVOILCLSA-N 425.501 2.461 10 20 IECD CCN(C[C@H]1CCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448397 QJFHDBIAXRFQIO-GOSISDBHSA-N 425.476 2.401 10 20 IECD Cn1cc(N2CCC[C@H](NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)C2)cn1 806843709 AHYAYHJQSBHWRG-SFHVURJKSA-N 437.500 2.033 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CN(Cc2ccccc2)CCO1 807469290 GNGQSDJXHDJQDY-AUSIDOKSSA-N 438.572 2.117 10 20 IECD COC(C)(C)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807605206 QFQZNGOFRDJSPE-GOSISDBHSA-N 430.593 2.155 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1 807919842 MOGRDUYXMCJQGL-JOCHJYFZSA-N 439.556 2.404 10 20 IECD Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)cc1 808546304 HTXAFKPOBARCBJ-HSZRJFAPSA-N 448.567 2.469 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Oc4ncccc4C)CC3)CC2)cc1 809994085 YFHQTFVTEOONJQ-QFIPXVFZSA-N 440.588 2.425 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cn(Cc2ccccc2)nn1 815623709 FJACBKONFOOTIW-UHFFFAOYSA-N 430.262 2.049 10 20 IECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCc2cc(OC(F)(F)F)ccc21 915158255 HNVPTHDJWJHYAH-UHFFFAOYSA-N 427.404 2.362 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(F)c3F)cc2)C1 917929226 AMNHAKRNECYWPT-CYBMUJFWSA-N 427.448 2.284 10 20 IECD CCOC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918285076 WNRXPMXEZJHFGZ-UHFFFAOYSA-N 444.463 2.486 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1C[C@H](C)O[C@H](C)C1 921203348 FZLPKWXWGLQKIL-TWWGPRNNSA-N 430.593 2.138 10 20 IECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)Nc2c(Cl)ccc3nonc23)C1=O 1342953240 VMQRZIMRPHSIQE-IBGZPJMESA-N 429.820 2.291 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccncc1F 1787756355 YCFUVDJZZYVJTI-MIUNTBIASA-N 449.866 2.192 10 20 IECD O=C(NC1(c2ccc(NC(=O)[C@@H]3C=CCN3)cc2)CCC1)C1=NN(c2ccccc2)C(=O)C1 1788535704 CCTCAXUJSMOTJW-FQEVSTJZSA-N 443.507 2.441 10 20 IECD Cc1ccc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1 1791920829 RNXPFYCZLUDZRB-SNRMKQJTSA-N 425.485 2.017 10 20 IECD N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccccn1 1800715496 QLZVMQKYMWMTPS-KYZVSKTDSA-N 430.892 2.098 10 20 IECD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)cn1 1808142220 CHDRZQSQRQYOFB-UHFFFAOYSA-N 446.598 2.095 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)nn1C 1817846331 SCUAFKHZSATSLP-MRXNPFEDSA-N 439.476 2.132 10 20 IECD CC(C)n1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 1827858982 QWVTYJZFNSVGMA-QGZVFWFLSA-N 442.520 2.212 10 20 IECD CN(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nc1 1842278499 NGLLOSFIFBTJIQ-UHFFFAOYSA-N 430.892 2.343 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CN2CCOC2=O)C3)cc1 1845397938 HXTYGXQLRFGRCK-UHFFFAOYSA-N 436.512 2.363 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN(c3ncccn3)CC2)c([N+](=O)[O-])c1Br 14206784 MIYQOQBFBMMAHR-UHFFFAOYSA-N 439.226 2.391 10 20 IECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)ccc1OCCCC(=O)O 726156474 VREGVBKIHQHRNK-UHFFFAOYSA-N 442.515 2.411 10 20 IECD CN(C)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 728140416 YJGMAKCBCKVGLP-UHFFFAOYSA-N 442.535 2.146 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CC(c2cc(F)ccc2F)=NO1 732657545 YAYVYTGXSARDDE-FQEVSTJZSA-N 449.479 2.009 10 20 IECD CCCCn1c(=O)nc(O)c2c1nc(CN(C)Cc1ccc(N3CCOCC3)cc1)n2C 741734282 BTHZGEIPXRMWAP-UHFFFAOYSA-N 440.548 2.104 10 20 IECD COc1ccc(N(CC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)C(C)C)cc1F 744394055 YGKVLXRYKDNQNM-MSOLQXFVSA-N 442.553 2.244 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 749639423 KMGJXKNAQXBZCL-UHFFFAOYSA-N 436.509 2.298 10 20 IECD O=C(COc1ccc(N2CCCC2)cc1)N1CCN(S(=O)(=O)c2ccccc2)CC1 749791467 NXJQVGXGRSKMAX-UHFFFAOYSA-N 429.542 2.199 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 750549707 CHZSKAKZMGIFOQ-XHSDSOJGSA-N 432.496 2.136 10 20 IECD CCN1CCN(C(=O)Cc2ccc(NC(=O)NCc3cc(OC)ccc3O)cc2)CC1 751009770 GHQHBDOAEJNHDZ-UHFFFAOYSA-N 426.517 2.429 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 751227683 JNUOZPPVDDQKNT-UHFFFAOYSA-N 439.484 2.363 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](Cn4ccnn4)C3)cc2F)C[C@@H](C)O1 752064667 KKDZHJFFUIOOBS-NSHGMRRFSA-N 444.555 2.059 10 20 IECD COc1cc(N2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)CC2)cc(OC)c1OC 759222303 KEVMBYLIWHSANR-UHFFFAOYSA-N 445.428 2.312 10 20 IECD Cc1cc(F)ccc1-n1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 767298220 KYSCYQXLHUQQBK-KRWDZBQOSA-N 436.491 2.347 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)cc2F)C[C@@H](C)O1 770513459 ZBVVXIOLYYSBBR-QWQRMKEZSA-N 429.558 2.019 10 20 IECD CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 775433467 DLFHGUBMYSKPJL-HXUWFJFHSA-N 429.565 2.413 10 20 IECD CN1CCN(c2ccc(CN3CCN([C@H]4CCN(c5ccccc5)C4=O)CC3)cc2)CC1 775695600 OIQLCGDUGKHYMN-VWLOTQADSA-N 433.600 2.362 10 20 IECD CC(=O)N[C@@H](CC(C)C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783258205 LEJBFDIKCLWKJH-IBGZPJMESA-N 436.464 2.495 10 20 IECD Cc1nc(Cn2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn2)no1 783854265 YCIBIBYTXSELBK-CYBMUJFWSA-N 433.419 2.018 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1 784553555 GVBGJQLSJLWCKT-UHFFFAOYSA-N 439.512 2.227 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N2CCOCC2)o1 785644348 CGZOLZPHWXGTKX-FXAWDEMLSA-N 428.533 2.021 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCC1(c2ccccc2)CC1 785868850 UKEXCBQPNWBISX-UHFFFAOYSA-N 425.504 2.251 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1Cl 786119736 FTBCXVYMQIMVPU-UHFFFAOYSA-N 437.949 2.496 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccsc1 787655798 RKXDCJNCLAHZFI-RBUKOAKNSA-N 431.558 2.380 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 788932883 QUNIXGVUOXKSRF-QGZVFWFLSA-N 427.936 2.347 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1 788966515 VMWUATHRCIPYHA-CNNODRBYSA-N 430.593 2.249 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCN(C4CC4)CC3)cc2F)C[C@@H](C)O1 789818696 KCCGYPKMSUFUJS-IAGOWNOFSA-N 446.567 2.046 10 20 IECD CC(C)(C)OCc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)no1 789855093 JGAKDXDSIROEIF-UHFFFAOYSA-N 446.573 2.476 10 20 IECD COc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)c(O)c1 794383932 UDOVNMWOQSBIKC-KRWDZBQOSA-N 427.457 2.485 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1 799180676 FSPPBRMAFIJNLC-MNVSYLFESA-N 433.464 2.219 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](Cn1cccn1)c1ccccc1)c1ccc(N2CCOCC2)cc1 803296331 AZLNYMSJWPQOCM-AUSIDOKSSA-N 447.539 2.455 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@H](OC(F)F)C1 803448235 LSTWYOLDGMDNBM-HNNXBMFYSA-N 433.402 2.213 10 20 IECD CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809659527 QGRSPTYGTTZFGP-WMQCIHAUSA-N 431.577 2.438 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1=CCN(C(=O)OC(C)(C)C)CC1 809774397 RYWPUOMLMAMCBA-UHFFFAOYSA-N 430.549 2.394 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc1 843443724 MTUGTFBFMTUDCY-UHFFFAOYSA-N 446.498 2.032 10 20 IECD Cc1cc(C(=O)O[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)c(C)n1-c1ccccn1 914903957 WIPJIYOYZNZDRL-SFHVURJKSA-N 434.500 2.173 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 918439469 LHUFLIJOWORJFU-UHFFFAOYSA-N 443.475 2.137 10 20 IECD Cn1nc(O)c2c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc(C3CC3)nc21 918633804 PBOCMIHXFKEDTD-UHFFFAOYSA-N 425.464 2.457 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(-c4ccncc4)c3C)CC2)cc1 1320329388 HMSUGBVIBISXBO-UHFFFAOYSA-N 435.484 2.090 10 20 IECD CN1CCN(c2ccc(CNc3cccc(C(=O)N4CCC[C@@H]4CO)n3)cc2F)CC1 1320662539 SHBPDZWMQCYFIR-GOSISDBHSA-N 427.524 2.182 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccoc1Cl)C2)c1cc(O)nc(O)c1 1777850781 IIRKXFITUIWMGU-JLTOFOAXSA-N 435.864 2.181 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccn1 1794491431 CPNLLGFDLFRYSH-BZBLDOMBSA-N 437.496 2.483 10 20 IECD CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600819 GEAIKSDFGLJDGX-MUJYYYPQSA-N 433.505 2.257 10 20 IECD CC(C)C1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)CCC1 1802082514 PUQYXWRGUNVNRK-YRNKJSLSSA-N 444.528 2.233 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cc(C2CC2)on1 1802786822 YLELYKHETXWURM-YCRPNKLZSA-N 449.467 2.387 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@H]1C[C@H]1F 1807848736 ORXUOJBLVQGREL-LHUGJAOOSA-N 441.459 2.276 10 20 IECD CCOC(=O)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821687087 JFSSZUHEMOAWAA-RISCZKNCSA-N 447.448 2.083 10 20 IECD COc1ccc(N2CCC(NC(=O)C3=NN(c4ccc(F)cc4)[C@H](C(N)=O)C3)CC2)cc1 110475049 GQGZWANHMDIBGH-NRFANRHFSA-N 439.491 2.040 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCc3nnc4n3CCCCC4)cc2F)CC1 303294259 LOIPKHIIRTWIRI-UHFFFAOYSA-N 443.571 2.327 10 20 IECD Cc1c(CNC(=O)C(=O)NC[C@@H](c2cccs2)N2CCOCC2)n(C)c2ccccc12 572020635 XIRLMXMWEMLUOW-FQEVSTJZSA-N 440.569 2.354 10 20 IECD COCCN(Cc1cccnc1)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 727941155 NMTGMUFOQRRKQF-UHFFFAOYSA-N 427.549 2.070 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(CC(C)(C)O)CC1 728054613 UDTCEIDPNUEMCD-INIZCTEOSA-N 435.524 2.178 10 20 IECD CCOC(=O)[C@]1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCc2ccccc21 735873346 JMTYZHPSUWTQMW-VWLOTQADSA-N 437.540 2.338 10 20 IECD COCCOc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738903506 BIRSFQHTCPSTEB-UHFFFAOYSA-N 433.530 2.268 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1[N+](=O)[O-] 740610300 WSOFSDPWNLXVPL-UHFFFAOYSA-N 434.474 2.106 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c[nH]1 742277832 FZPDSANAAHHQGM-STQMWFEESA-N 425.482 2.033 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cccn(Cc4ccccc4)c3=O)CC2)cc1 742916484 JHQDGNKJWDWXSC-UHFFFAOYSA-N 446.551 2.457 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)C1CCN(S(=O)(=O)c2cccnc2)CC1 743719847 WYGIPSAGZSZKML-UHFFFAOYSA-N 429.542 2.383 10 20 IECD COc1ccccc1-c1noc([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 743798376 HYRPHKQIVJOWGV-NSHDSACASA-N 432.458 2.313 10 20 IECD COc1ccc(N2CCN(c3nnc([C@@H]4CCOC4)n3C[C@@H]3CCOC3)CC2)cc1F 752835640 DCATXVCRXUWFQN-DLBZAZTESA-N 431.512 2.293 10 20 IECD Cn1ccc(/C=C2/SC(=S)N(c3ccc(S(=O)(=O)N4CCOCC4)cc3)C2=O)c1 763284806 XLRCBCYHOZVAFT-SFQUDFHCSA-N 449.579 2.452 10 20 IECD COc1ccc(C(=O)NCC(=O)NCc2cccc(Br)c2O)cc1[N+](=O)[O-] 765727369 MXFYADJJTMLFFH-UHFFFAOYSA-N 438.234 2.118 10 20 IECD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCO1 770266405 REKKUNUEVWAFNP-OLZOCXBDSA-N 435.458 2.399 10 20 IECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 783303012 CWVIXEWAZPTQPR-UHFFFAOYSA-N 448.426 2.235 10 20 IECD Cc1ccncc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 785884295 LYUBYSGKJGMVQB-UHFFFAOYSA-N 427.482 2.485 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(CCN(C)C)cc3)CC2)cc1 786116681 MBTJSUUWARMHSA-UHFFFAOYSA-N 439.604 2.421 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccnc(OC2CCCC2)c1 787257600 KUAJSARNJIMSQB-UHFFFAOYSA-N 438.528 2.172 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@H]3c3ncon3)CC2)cc1 787262336 QECZFRZUDBSLPA-CFGKVWFZSA-N 439.516 2.427 10 20 IECD CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789839812 AMPGLBWWNAQBJT-DYESRHJHSA-N 449.567 2.361 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@]4(CCO[C@@H]4C)C3)CC2)cc1 790643031 LKDFNDFRMDRBGZ-DCLXLUIPSA-N 446.592 2.185 10 20 IECD CC(C)CC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793717227 DQTWDUZGBMBZMV-FPOVZHCZSA-N 428.577 2.432 10 20 IECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3C(=O)c3cccs3)CC2)cc1 794753799 HRPQYUSSTQJDMG-SFHVURJKSA-N 426.542 2.367 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1 799253810 WWJDBFXEBWXCRN-VLIAUNLRSA-N 441.484 2.135 10 20 IECD CCOc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1OC 803306682 VYOHSHHJZBPKPK-QGZVFWFLSA-N 441.528 2.424 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@@H]3C[C@@H](O)c3cccs3)ccc21 803688882 DQRFVOWHMIPKKL-AZUAARDMSA-N 443.569 2.098 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3c(F)cncc3F)CC2)cc1 804824296 LNLTWNHLPFKRKM-MVGZEHJDSA-N 430.455 2.451 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(Cc3ccccn3)C3CC3)cc2F)CC1 805006861 INSINDDOURHGGK-UHFFFAOYSA-N 439.535 2.170 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](CCOC)c3ccco3)cc2F)CC1 805007412 LDRUIOYUJCWUQD-LJQANCHMSA-N 446.523 2.071 10 20 IECD COC(=O)C[C@@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 805816813 OMHMUNCVRWDHLH-GOSISDBHSA-N 428.485 2.312 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@](O)(C(F)(F)F)CC3)cc2)C1 806494200 MVYXHQNCYMLRIN-UZLBHIALSA-N 442.482 2.377 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCc1cccc(Br)c1O 807057847 JLZQOMVKUXVGIA-UHFFFAOYSA-N 435.200 2.470 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385279 HFIVHJSBSFWZFA-UHFFFAOYSA-N 436.262 2.377 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 808538119 ZYUQPKODQWXXQF-UHFFFAOYSA-N 444.557 2.281 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cc(CN4CCCC4)on3)CC2)cc1 812453546 MGDXNMNQGFVQFL-UHFFFAOYSA-N 427.549 2.221 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](CO)(c4ccccc4)C3)cc2)C1 813044276 WCTGIVDDLKKDFU-CPJSRVTESA-N 436.556 2.234 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)[C@H]4CC=CC[C@H]4C3=O)cc2F)C[C@@H](C)O1 815062958 RYIUYTCCSCQUBW-AHCXZYCDSA-N 429.492 2.007 10 20 IECD CCOC(=O)c1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1 816100938 ZMNWAAIXQBOVGH-UHFFFAOYSA-N 429.473 2.247 10 20 IECD Cc1cc(NC(=O)NCc2ccc(N3CCSCC3)cc2)n([C@H]2CCS(=O)(=O)C2)n1 916672174 BSRYNCICGDMDKO-SFHVURJKSA-N 449.602 2.426 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)c4cc(C)oc4C)CC3)CC2)cc1 917070421 ADOPLRVMJFAQTO-UHFFFAOYSA-N 440.544 2.012 10 20 IECD COC(=O)c1ccc2c(O)nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)nc2c1 917261412 VTZHYPPRKXCCTQ-UHFFFAOYSA-N 436.468 2.022 10 20 IECD CCCc1cc(=O)n2nc(NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)sc2n1 917391283 PUZWWMYXCCZVIE-HNNXBMFYSA-N 426.546 2.417 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3Cn3cncn3)CC2)cc1 918462073 QGLUMGRGANIPIJ-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C[C@@H](OC(=O)c1ccn(C)c(=O)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919267982 OPPPFYSZHYGJRS-CYBMUJFWSA-N 430.416 2.345 10 20 IECD CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920195346 QCWDHMMTDKTEGS-UHFFFAOYSA-N 444.919 2.133 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 920260256 WHPYSVYFSWIOLD-UHFFFAOYSA-N 429.539 2.474 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-n4cncn4)cc3)CC2)cc1 1116501150 WPJZADKDVWAZTJ-ZHACJKMWSA-N 432.484 2.119 10 20 IECD O=C(C[C@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004001 RGHBCJSIQHGDHC-VFNWGFHPSA-N 438.908 2.154 10 20 IECD CCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1782004321 BJPJVIMVKLCLDN-QFIPXVFZSA-N 445.903 2.466 10 20 IECD O=C(c1cncc(F)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004344 BSTNJGJTIYEIAD-HXUWFJFHSA-N 435.839 2.043 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cncc(F)c1 1786147384 ULFAHVNXGPEQED-GYOIFBIXSA-N 449.866 2.192 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnnc(Cl)c1 1794505755 IDUHFMOQWGLWHP-BPQKRJORSA-N 444.875 2.212 10 20 IECD CCOCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708832 QLHLOARWGQYENQ-JTQLQIEISA-N 425.894 2.470 10 20 IECD CCO/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1826473539 LJXLLPXPGYAUPG-NPABGRFFSA-N 445.497 2.436 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2c[nH]c3cnccc23)C1 1844142669 HJHSFKJYOIFFNL-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CC[C@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)OC(C)(C)C 1845234378 HHMDOMZOYNYYJD-OAHLLOKOSA-N 448.520 2.003 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 9656369 LTAGMZNQUAWQNR-UHFFFAOYSA-N 426.908 2.489 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H]3C[C@]3(C)NC(=O)NC3=O)ccc21 561238755 WNYPBKFTCAWMNB-SBUREZEXSA-N 426.517 2.497 10 20 IECD COc1ccc(N2CCC(NC(=O)NCC3(NS(C)(=O)=O)CCCCC3)CC2)cc1 726703502 FUDNWJHAYJSCGJ-UHFFFAOYSA-N 438.594 2.215 10 20 IECD CN(C)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 730077685 DYRRZLAMOFTVMT-MRXNPFEDSA-N 448.501 2.267 10 20 IECD CN(C)CCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 730679523 FBEWNZIYRVGZMN-UHFFFAOYSA-N 440.544 2.109 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(F)c1 737110767 KJNRRSRQXFZSND-INIZCTEOSA-N 430.432 2.464 10 20 IECD CNC(=O)c1ccc(CN(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742948534 XBSRQKFUCRPEBN-UHFFFAOYSA-N 439.560 2.018 10 20 IECD O=C(C1CCN(c2ccc3nnnn3n2)CC1)N(Cc1ccco1)Cc1ccccc1O 743431618 XLMMDOBXMWIREY-UHFFFAOYSA-N 433.472 2.263 10 20 IECD O=C(Nc1cnn(Cc2ccccn2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 746363315 RXUAVGSYKBWTQC-FQEVSTJZSA-N 435.484 2.178 10 20 IECD CN1CCCc2cc(CNC(=O)c3cccc(CN4CCS(=O)(=O)CC4)c3)ccc21 751386915 LAZIZNRIYIRLQZ-UHFFFAOYSA-N 427.570 2.229 10 20 IECD COC(=O)C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 752865522 LRLIKQORSZWDLP-MRXNPFEDSA-N 445.438 2.016 10 20 IECD CN(C[C@H]1CCC[C@H]1O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755060241 XJCNDQAEWUGTCA-WIYYLYMNSA-N 442.539 2.245 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O 755255833 NYGOGTKBNUWYSX-UHFFFAOYSA-N 425.445 2.338 10 20 IECD O=C(Nc1ccn(Cc2ccccn2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 759022298 KTYMQLLACJESKQ-LJQANCHMSA-N 435.484 2.178 10 20 IECD C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NCCc1ccc(O)c(O)c1 762273851 DMHJREMYZXZPCJ-LLVKDONJSA-N 432.420 2.142 10 20 IECD NS(=O)(=O)c1cccc2c(C(=O)NCc3cccc(Br)c3O)nccc12 765729548 OKIOFJNZIKQDNK-UHFFFAOYSA-N 436.287 2.280 10 20 IECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3cc(OC)c(C)cc3O)CC2)c1 768443060 YFFARLBTMMQHSF-UHFFFAOYSA-N 436.530 2.233 10 20 IECD CCC[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 768521911 LQTCLNUWZULCMJ-DFFLPILJSA-N 434.512 2.166 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 769660524 NQPOORFBAAXRLR-CYBMUJFWSA-N 441.456 2.417 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 772485412 CFXQBWXTIFFTBK-IBGZPJMESA-N 449.511 2.299 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1 774866640 XICUUQZNEFIINH-QHCPKHFHSA-N 438.572 2.166 10 20 IECD O=C(NCCc1ccccc1F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 775197697 SUHJGCBAJUTVED-UHFFFAOYSA-N 438.547 2.333 10 20 IECD C[C@@H](NCC(=O)N(CCC(N)=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 775254033 GAQWTUHIWKAUCX-QGZVFWFLSA-N 428.508 2.222 10 20 IECD CCOC(=O)c1c(NC(=O)CN[C@H](C)c2cc(OC)ccc2O)sc(C(N)=O)c1C 775371388 WYWUOEOQNRJCSY-LLVKDONJSA-N 435.502 2.336 10 20 IECD COC(=O)COc1ccc(CN(C)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 776121459 FKGPOZCNWVWOCZ-UHFFFAOYSA-N 427.501 2.417 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)cc1 778919640 HPULNCMYBAGLFO-UHFFFAOYSA-N 432.498 2.018 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C 785297747 RZHCPHJANZUOTB-ZDUSSCGKSA-N 449.529 2.244 10 20 IECD O=C(NCCc1ccc(F)c(F)c1F)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813307 SQVDLGIRSRATAH-UHFFFAOYSA-N 439.409 2.055 10 20 IECD CC(C)(C)CN(CCO)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951640 XYZOXILTWJVYTI-UHFFFAOYSA-N 445.482 2.025 10 20 IECD CN(Cc1ccc(Cl)cc1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793735032 WUNANPUJTMPVLC-GOSISDBHSA-N 442.947 2.317 10 20 IECD O=C(COC(=O)c1cnn2c1OCCC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 795732791 HFFWMNKCHXVDCE-UHFFFAOYSA-N 431.404 2.237 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3S[C@@H](C)C(N)=O)cc2)CC1 800952771 JEJHSQHRPQWSEU-INIZCTEOSA-N 440.569 2.251 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)n(C2CCOCC2)n1 807385516 LYXPYCJGJVQIBI-UHFFFAOYSA-N 437.294 2.266 10 20 IECD CN(CCCn1ccnc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771009 QUCGOQPBECMVMH-MRXNPFEDSA-N 435.475 2.118 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O 808568113 DYNCJLBGSYJZQC-IBGZPJMESA-N 444.482 2.301 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4cccc([N+](=O)[O-])c4)CC3)CC2)cc1 915680371 GGFSAGDGDRCXLZ-UHFFFAOYSA-N 439.516 2.074 10 20 IECD CS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918032476 AWEDUJQOCSPSDY-INIZCTEOSA-N 430.530 2.114 10 20 IECD CN1CCN(c2ccc(CNCCNS(=O)(=O)c3ccc(Cl)s3)cc2F)CC1 1116487424 BXJIGXXJQSOOLD-UHFFFAOYSA-N 447.001 2.361 10 20 IECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603433 LCDLGYKFRHWEKI-FZKCQIBNSA-N 448.520 2.048 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc21 1802534169 BBGNQJQIQFMMEU-DFGXFYAUSA-N 443.594 2.215 10 20 IECD Cc1c(F)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334523 MLVBYFOSPYSJRV-BTTYYORXSA-N 435.546 2.246 10 20 IECD Cc1nscc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722336 XXHPTDQPFDDGNU-SNVBAGLBSA-N 431.499 2.254 10 20 IECD O=C1CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)c(O)c(Cl)c3)n[nH]2)N1 1821293463 LWWSHJXJWHIJHW-GXTWGEPZSA-N 447.879 2.059 10 20 IECD O=C(c1nnsc1C1CC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039059 OPAKNCDYKTZQNG-FNORWQNLSA-N 442.497 2.063 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C(=O)c4ccco4)CC3)cc2F)CC1 303328762 TTYOSIXKEZCUOA-UHFFFAOYSA-N 443.523 2.228 10 20 IECD COc1cccc([C@H](C)N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 728980789 GIRKSPGIPCTVGS-HNNXBMFYSA-N 433.530 2.291 10 20 IECD CCc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(CC)CC)cc2)cc1S(N)(=O)=O 737116965 FKDSLVGOXOHWPJ-UHFFFAOYSA-N 446.573 2.340 10 20 IECD COCCCOc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 742050105 CBGWWSRZZMSZJV-UHFFFAOYSA-N 432.542 2.267 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCCN(C(=O)c2ccncc2)C1 742079776 MRAAUEVVMCJGCA-QFIPXVFZSA-N 436.556 2.459 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)c[nH]1 743046574 YSLSLSMDJCBXCL-UHFFFAOYSA-N 441.512 2.129 10 20 IECD CCNC(=O)COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958414 VQDRLFZLMBIMHM-UHFFFAOYSA-N 425.485 2.041 10 20 IECD CCN1CCO[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1 748462897 ZLXHTNFCTUAENC-OAQYLSRUSA-N 428.485 2.327 10 20 IECD CN(C)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 751892160 DXXLIGDRWFUQNR-UHFFFAOYSA-N 433.455 2.341 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)C1 751936082 HBQQRZXIKMGJRE-HNNXBMFYSA-N 431.514 2.275 10 20 IECD COc1ccc(N(C)CC(=O)N(CC(C)C)c2c(O)nc(=O)n(CC(C)C)c2N)cc1F 757852427 NHNDPZKUJJQNES-UHFFFAOYSA-N 449.527 2.460 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c2ccccc12 759034055 IFDDFUWTYNOUFF-UHFFFAOYSA-N 438.436 2.361 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc(N4CCOCC4)cc3)nc12 775254366 HNFLFOXOIICPTE-OAHLLOKOSA-N 425.489 2.299 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)NCCCSc3nccs3)ccc21 778644593 DVIBIHRJDVEJKC-UHFFFAOYSA-N 448.570 2.306 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C\c2cnccc2C)c(O)nc1=O 783705996 FTGONNFNNASNPP-HJWRWDBZSA-N 435.484 2.128 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H]1C 789950288 NSBIMUGPUQYXQN-ILXRZTDVSA-N 443.466 2.183 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](C)CN1CCCC1 790184779 ASXMZFWUVSPUQE-AWEZNQCLSA-N 426.355 2.351 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(Br)n1)c1ccc(N2CCOCC2)cc1 792971893 PZDFENDAJXGQON-CYBMUJFWSA-N 433.306 2.497 10 20 IECD COc1ccc(F)c2[nH]c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc12 793127763 XGJZNWDTNAXTOF-UHFFFAOYSA-N 431.489 2.480 10 20 IECD Cc1cccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 793727899 WDVQYYVIZKDCBK-FGZHOGPDSA-N 448.567 2.329 10 20 IECD Cc1cccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 793733277 LYHNCKVVBCTPBF-UGKGYDQZSA-N 449.555 2.072 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc(Cn4cccn4)c3)CC2)cc1 793816296 ZOZQQJQYOSKZQC-UHFFFAOYSA-N 447.539 2.295 10 20 IECD COc1ccc(CNC(=O)[C@@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)c(O)c1 794369494 GMJXAWLOFLMLII-QGZVFWFLSA-N 433.486 2.477 10 20 IECD CCc1nn(C)c(OC)c1CNC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 805024623 SRJZISOLDABOBD-UHFFFAOYSA-N 427.549 2.160 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1 807771569 VXYGRNLRNKEYHI-GJYPPUQNSA-N 437.487 2.447 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3([S@@](C)=O)CC3)cc2Cl)C1 807955257 RBJBRKTUUITVNT-GMYLUUGSSA-N 425.982 2.220 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 808586929 XDOMULJCGIDCKP-IBGZPJMESA-N 428.920 2.286 10 20 IECD COC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 808787781 AAWKKGZAPQMHTK-OAQYLSRUSA-N 447.482 2.264 10 20 IECD NC(=O)c1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 913332542 ZCWMFFXWFQMYEU-UHFFFAOYSA-N 428.400 2.356 10 20 IECD CCCS(=O)(=O)NC1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916624723 NPAWBISHTRTTID-UHFFFAOYSA-N 440.635 2.243 10 20 IECD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1ccc(N3CCSCC3)cc1)C2=O 917386320 UHIVAISBJANPIK-KSFYIVLOSA-N 430.574 2.357 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(OC)c1OC 917833846 UFAFZFYRQLCSOE-INIZCTEOSA-N 427.501 2.344 10 20 IECD CN(C)C(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918118079 UWWJIHMANHAHTF-FQEVSTJZSA-N 437.544 2.090 10 20 IECD O=C(Nc1cccc(Cn2cncn2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918296363 JMDQHVUVWPDUBC-FQEVSTJZSA-N 435.484 2.178 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 920921133 XYVWPNSQTQPNOL-AWEZNQCLSA-N 438.575 2.053 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cnn(CC(=O)NC4CCCC4)c3)CC2)cc1 1319625392 JAUASLGMMMLLPF-UHFFFAOYSA-N 425.533 2.303 10 20 IECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCN(C)CC2)c(F)c1 1327145461 IPANKAIKZPSEDA-SFHVURJKSA-N 434.581 2.424 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3cccnc3)cc2)C1 1338887569 MPCJYFRTDTXQQK-JTHBVZDNSA-N 435.572 2.454 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2cc(C)cc(F)c2)nn1 1344084454 ZVHIWIWVDPGGJQ-INIZCTEOSA-N 428.420 2.030 10 20 IECD COC[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781119745 YJDIRORCBYNMOB-KPFBPEDLSA-N 440.924 2.161 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1Br)c1cc(O)nc(O)c1 1798869705 PAFRNNGWSXSTIZ-CLLJXQQHSA-N 447.289 2.216 10 20 IECD CNc1nsnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800713622 WPDOTHXUTPLEOA-JGPRNRPPSA-N 437.909 2.210 10 20 IECD Cc1nscc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991742 SNTBEJAAHUGXEC-LIRRHRJNSA-N 439.497 2.286 10 20 IECD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccccn1 1813504590 PNVZXNIDYTZGSX-GIMINZRKSA-N 447.495 2.406 10 20 IECD Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1813508284 DTCUDJBGPSGWCJ-AOMKIAJQSA-N 436.468 2.352 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1CCCS1 1813614612 UMERJCBQRMUJQV-URLQWDBASA-N 428.514 2.103 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1[C@H]2C=CS[C@H]21 1821706269 BMWKHFBGZOEFTA-CWMCZYRISA-N 427.486 2.397 10 20 IECD Cc1[nH]nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1F 1825607240 DBHJZWFZRHAIDG-OAHLLOKOSA-N 431.468 2.211 10 20 IECD O=C(c1cn[nH]c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876890 QIIQQWGHHAWDHJ-FZMUQLTDSA-N 440.500 2.473 10 20 IECD O=C(CCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)Nc1ccccc1 1841326550 WGZZMSGYARRJSZ-UHFFFAOYSA-N 438.484 2.119 10 20 IECD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)nc2ccc(Cl)cn12 1845698355 KBPCDMVBGBTLCA-UHFFFAOYSA-N 441.875 2.233 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H]3C[C@@]3(C)NC(=O)NC3=O)ccc21 561238757 WNYPBKFTCAWMNB-UZUQRXQVSA-N 426.517 2.497 10 20 IECD CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 726039542 UKWWDWSXESEJDS-RTBURBONSA-N 445.560 2.172 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](C)N3C(=O)NC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 726502531 BCXSASBJKAZGCD-BZUAXINKSA-N 446.523 2.309 10 20 IECD CN1CCN([C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2)CC1 729523962 ZYVJTADIPVFRKN-XMMPIXPASA-N 440.563 2.392 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(CC(=O)Nc3cc(C)on3)CC2)cc1F 731363251 CINIETOZDHIMHV-UHFFFAOYSA-N 446.527 2.434 10 20 IECD COc1ccc(N2CCN(Cn3nc(CCC(N)=O)n(CC(C)C)c3=S)CC2)cc1 732417652 NZDYQWNLBPXKAY-UHFFFAOYSA-N 432.594 2.276 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1C 737208209 FFUCLEJPFAHOLS-UHFFFAOYSA-N 432.546 2.386 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)S(C)(=O)=O)NC(=O)OC(C)(C)C)cc1 742755916 ZJIBONVFHIJADE-MRXNPFEDSA-N 427.567 2.258 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(C[C@H]4CCCO4)c3)CC2)cc1 743363555 UBMMNHNHSXAXPF-OAQYLSRUSA-N 428.537 2.014 10 20 IECD COc1cccc(CNC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1O 745412547 YNIKBNWPHUCJLR-UHFFFAOYSA-N 433.530 2.362 10 20 IECD CN(C)c1ccc(CN(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)C2CC2)cc1 747570990 MKTYGSDWDSWDIO-UHFFFAOYSA-N 426.521 2.004 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)Nc2c(C3=S=CC=C3)nc3ccccn23)cc1 751247436 QZVWTHKKBLXDCT-UHFFFAOYSA-N 442.522 2.394 10 20 IECD CN(c1ccccc1NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(C)(=O)=O 758261623 LGHXZRGJQRXBPU-UHFFFAOYSA-N 436.509 2.380 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 759377445 AUHXQOTXWWZYNE-UHFFFAOYSA-N 431.558 2.321 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCC4)CC2)cc(OC)c1OC 759414242 VTTWAIJBPIATPY-UHFFFAOYSA-N 439.512 2.488 10 20 IECD C[C@@H]1OCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@@H]1C 770022147 AHAWOKTXBQYKJT-OLZOCXBDSA-N 435.458 2.351 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OC)c3F)cc2F)CC1 770740291 VACAVRCFFSMYAH-UHFFFAOYSA-N 432.471 2.370 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCN(CC(F)(F)F)C1=O 772996695 GWUBGMFFLKERDU-HNNXBMFYSA-N 432.418 2.015 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1C(=O)OC 773859537 VVBVHNMGTMUSPK-CYBMUJFWSA-N 427.457 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3ccc(Cl)cc3)CC2)cc1 778230482 BNICXKMLSAWURM-XPTLAUCJSA-N 443.931 2.403 10 20 IECD CCN1CCN(S(=O)(=O)c2cccc(NC(=O)/C=C/c3ccc(O)c(O)c3)c2)CC1 779475781 RIFPONPUQQPMCC-VQHVLOKHSA-N 431.514 2.076 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 779589465 HDFRTBUDSMMXQL-IZTUGPKFSA-N 428.510 2.495 10 20 IECD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@H]1CC[C@H](O)CC1 784744293 PJENSFSPZFVMRJ-KOMQPUFPSA-N 449.485 2.477 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1 785648338 OXNQDELYWBGOMF-NRFANRHFSA-N 442.560 2.240 10 20 IECD C[C@H](OC(=O)c1ccc2nnnn2c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 786049436 CIZCICPAYFKEQH-LBPRGKRZSA-N 441.403 2.084 10 20 IECD O=C(NCc1ccc(Cn2cccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788460459 FFRASMVIZXNUIM-JOCHJYFZSA-N 448.523 2.461 10 20 IECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C12CCCC2 789842136 AADJKXNUUPIDJI-SFTDATJTSA-N 447.551 2.257 10 20 IECD C[C@H](OC(=O)[C@H]1CCCN(C(N)=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792270556 AXPCVBMUTUQPQD-KBPBESRZSA-N 449.463 2.123 10 20 IECD O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NCc1ccc(N2CCCC2)cc1 799363371 ANLUIQKAYDQBPM-UHFFFAOYSA-N 438.500 2.343 10 20 IECD CN1CCC(N2CC[C@H](NC(=O)C(=O)N(Cc3ccccc3O)C3CCCCC3)C2)CC1 806209709 GRNRCUFICYLCCS-FQEVSTJZSA-N 442.604 2.338 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N(Cc1ccc(-n2cncn2)cc1)C1CC1 807290585 ZCTVHPMTLLDNHC-UHFFFAOYSA-N 442.523 2.451 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385329 ININSWLCSXXWOJ-UHFFFAOYSA-N 425.210 2.335 10 20 IECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc21 807386800 JXEGZFBOZIARTP-UHFFFAOYSA-N 432.274 2.319 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ncc(-c2ccccc2)cn1 807755096 BYDIJPGMSVBIHT-UHFFFAOYSA-N 445.523 2.255 10 20 IECD C[C@H](c1ccccn1)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808854222 TTXMYIVRDMFFOY-LJQANCHMSA-N 435.572 2.449 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)c1 920348544 AMYCWLYWBNJVNA-LLVKDONJSA-N 449.312 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c(C)nn(C(F)F)c3C)CC2)cc1 920916159 YXIJBLUKVWXYNG-UHFFFAOYSA-N 436.459 2.338 10 20 IECD O=C(Cc1ccccc1F)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 921198690 CFDFRWBPNAZVBW-UHFFFAOYSA-N 440.519 2.259 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(CCCC[C@H]4C)C3=O)CC2)cc1 1253854348 XKNWEXMTQJYUTR-HXOBKFHXSA-N 428.533 2.235 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CC1)C2)c1cc(O)c(O)c(Cl)c1 1781123142 XYKZMMPBDLJFPP-DNVCBOLYSA-N 426.872 2.381 10 20 IECD O=C(CCCn1cccc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007749 NZSOUZSALMQFHB-QFIPXVFZSA-N 447.919 2.477 10 20 IECD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1793859404 VUGKIFQWGRNKOA-QDMKHBRRSA-N 448.520 2.048 10 20 IECD CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)cc1C 1796934432 CLRKFBHKUNFAEL-GGPHIMKMSA-N 448.527 2.256 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2cccnc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993869 PAQVNWHYTOTOMO-AVMAXUKXSA-N 445.479 2.316 10 20 IECD Cn1nncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1825359640 CUWCBYXWFZZDHR-INIZCTEOSA-N 447.923 2.427 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3c2CCC3)CC1 1830902684 WVNVQHMWCZEANP-SFHVURJKSA-N 439.516 2.183 10 20 IECD O=C(CN1CCCCC1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 12787931 WQCZFCWTVWTQEB-GZTJUZNOSA-N 433.555 2.219 10 20 IECD CC(C)CN1C(=O)/C(=C\Nc2ccnn2Cc2ccc(N(C)C)cc2)C(=O)NC1=S 29009097 IXJHAXGEQUMYDQ-BOPFTXTBSA-N 426.546 2.193 10 20 IECD CCCN(CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cc1ccccc1O 110081873 FOBJJPDQJVBOBQ-UHFFFAOYSA-N 447.557 2.264 10 20 IECD COC(=O)c1cc(NC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)cc([N+](=O)[O-])c1 609838872 TUGVXQHUTKAEPR-UHFFFAOYSA-N 429.410 2.338 10 20 IECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ncccc2c1 726975525 DSWNYZSGJCFCMJ-UHFFFAOYSA-N 445.566 2.257 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCS(=O)(=O)CC4)C3=O)c2C)c1 729153999 YGTWGUOIBIWEJC-UHFFFAOYSA-N 443.525 2.084 10 20 IECD CC(C)[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 734270672 WKMSZXBVKFWZBL-QGZVFWFLSA-N 428.455 2.208 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(C(=O)N(C)OC)cc3)CC2)cc1 736979720 JZJXGHVSGKQADE-UHFFFAOYSA-N 441.532 2.272 10 20 IECD COCCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 743859677 ZJYVYCIHLVRRHL-QWFCFKBJSA-N 437.556 2.040 10 20 IECD C[C@@H](CNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCN(C)CC1 745862069 GDVMTTVKUMXLPJ-ZWKOTPCHSA-N 439.551 2.440 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](CN4CCCC4)C3)CC2)cc1 746413456 INCUFYDUVBPTHB-OAQYLSRUSA-N 429.609 2.335 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1CCS(=O)(=O)CC1 746589445 REFVESVTOJIFMK-SDNWHVSQSA-N 444.625 2.423 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2C)cc1OC 747697090 ZTASVADQIWTKBY-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CCOC(Cn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1)OCC 748551119 MKROXRDJRIUBHO-IYBDPMFKSA-N 449.527 2.360 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCc3ncnc(O)c3C2)c([N+](=O)[O-])c1Br 750565209 CGTKGGBHEYYZAT-UHFFFAOYSA-N 426.183 2.332 10 20 IECD C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 755249425 QEOAVFOGLRWTOW-INIZCTEOSA-N 433.578 2.172 10 20 IECD O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(O)c(-c3nc(Cn4cccn4)no3)c2)c1 758289014 GHOAQSUWQGNOOU-UHFFFAOYSA-N 442.413 2.396 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOc3ncccc3Cl)cc2)C1 760833231 KZJJLMACSVNGHH-MRXNPFEDSA-N 431.924 2.315 10 20 IECD Cn1cc([C@@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 766765211 RGODURKRHFMWBB-NQIIRXRSSA-N 431.512 2.194 10 20 IECD COCCn1nc(C)c(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1C 772529098 YTCUEGCQRRKJDU-UHFFFAOYSA-N 430.553 2.099 10 20 IECD CC(C)=CCC[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772899543 IMFALEVCDNZDAR-QHCPKHFHSA-N 446.523 2.335 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(CC(F)(F)F)c3)CC2)cc1 778284749 BTDJUILLTOABQV-VOTSOKGWSA-N 437.422 2.298 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc1 785527337 KACXBRXYJAURJN-HSALFYBXSA-N 430.593 2.264 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C[C@@H](C)O4)cc2)CC1 786121318 YUYWKOSPWPVEDF-MRXNPFEDSA-N 429.542 2.157 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)nn(CC(C)C)c3C)cc2)CC1 786121962 LAFDEIFLHIRVDR-UHFFFAOYSA-N 447.605 2.303 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1 789819916 OTYCPMDSVWHXLK-GQIGUUNPSA-N 435.540 2.377 10 20 IECD CO[C@@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 789865276 ZMZBUKQSOVDZJD-AWEZNQCLSA-N 434.587 2.336 10 20 IECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCc2cc(Cl)cc(Br)c21 801712031 TXFAJVNVJRZGED-UHFFFAOYSA-N 442.722 2.489 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H]1COC2(CCCCCC2)O1)c1ccc(N2CCOCC2)cc1 803312106 VIJLCEFXHFBIGS-RXVVDRJESA-N 445.560 2.283 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H](C)CS(C)(=O)=O 803677607 RVEFTHBESBSUIM-KRWDZBQOSA-N 437.606 2.353 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(Cc4ccc(Cl)nc4)CC3)ccc21 803688785 BDOMHCUIIJWZSD-UHFFFAOYSA-N 441.963 2.078 10 20 IECD C[S@@](=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 805865785 KQNLEJMVGVZIOG-PLTNMMHCSA-N 442.585 2.266 10 20 IECD CN(C)CCN(C)CCCN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808781446 GPJLKIHPKYDXIN-UHFFFAOYSA-N 436.556 2.216 10 20 IECD CC(C)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808852097 NKAMFCJDLORXCK-QFIPXVFZSA-N 444.645 2.435 10 20 IECD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 815715636 OJSBCMJSOCIDOE-JCGIZDLHSA-N 433.455 2.324 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(F)c(NC(N)=O)c3)CC2)cc1 817212986 OZYJREOEQMRASX-HJWRWDBZSA-N 441.463 2.168 10 20 IECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)cc2)[nH]1 915198749 NQTNMXXICXJQSP-UHFFFAOYSA-N 434.496 2.411 10 20 IECD CS(=O)(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 919943673 ZGOBUHDBGPKXTM-UHFFFAOYSA-N 444.575 2.261 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)C4CCCCC4)CC3)CC2)cc1 921191907 XVJUMLFMFWGWRM-UHFFFAOYSA-N 428.577 2.068 10 20 IECD Cc1nc(F)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007553 TXUVDBXLYWCDNW-NRFANRHFSA-N 449.866 2.351 10 20 IECD CC(C)O[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798541911 DOPMIRQDZLATID-DKKFBQAASA-N 426.517 2.231 10 20 IECD CCCC(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718493 ZXHBJWUWSHGLDF-REBRKWNGSA-N 437.924 2.308 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994270 FITHCQIQRQTKCJ-JLTOFOAXSA-N 437.431 2.055 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H]2CCN(C(=O)C(O)O)[C@@H]2c2cccnc2)cc1 1811262494 PSUPKLPTUGLEHY-IFMALSPDSA-N 448.523 2.119 10 20 IECD CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1827441618 VFAJNNFCFBODSK-GQOHGMTASA-N 438.600 2.128 10 20 IECD CCc1[nH]c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1C(=O)OC 32877520 KXPOMFSVIHQLMO-UHFFFAOYSA-N 443.500 2.186 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCc3nc(-c4ncccn4)no3)cc2F)CC1 303271311 GAKVFLDXGBCBCP-UHFFFAOYSA-N 439.495 2.057 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(CN4CCOCC4)c3)cc2)C1 727768286 ZEMLIPNUENMXOT-JOCHJYFZSA-N 436.556 2.151 10 20 IECD O=C(CCNC(=O)c1n[nH]c2ccccc12)NCc1ccc(N2CCC(O)CC2)c(F)c1 728068496 PFJHQFFETGIZMO-UHFFFAOYSA-N 439.491 2.099 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C)c1ccc(N2CCOCC2)cc1 729788307 UEUCBYQUEDCWRF-MRXNPFEDSA-N 436.512 2.248 10 20 IECD COC(=O)[C@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 736311468 KIRGIVAVSAOEPM-QFIPXVFZSA-N 429.492 2.125 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 743868699 BZPNPGWFNHOXRF-KRWDZBQOSA-N 444.557 2.080 10 20 IECD CCN1CCCC[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 745084059 FPMGLYDXUBRVQK-CBGDNZLLSA-N 435.540 2.473 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc4c(c3)CCCN4C)CC2)C1 746985363 NDYGSHUSBQHHBV-WOJBJXKFSA-N 441.620 2.401 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C(=O)c2cc[nH]c2)cc1 748703898 BKEIDXWNAFGSSO-UHFFFAOYSA-N 437.521 2.411 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc2c(=O)n3ccccc3nc2n1C 749632534 MRGLLUIHINSMCD-UHFFFAOYSA-N 447.495 2.068 10 20 IECD CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NCCc2ccc(O)c(O)c2)c1 750794596 IULNZQJZODZHSL-UHFFFAOYSA-N 447.557 2.311 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)nc3)CC2)cc1F 753838441 DCIDKCWGDQALFP-UHFFFAOYSA-N 429.496 2.098 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br 754787008 WTXPJFZRYOKXIM-JTQLQIEISA-N 431.243 2.185 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C3=Cc4cc(OC)ccc4OC3)CC2)cc1 756465767 LAIPCRIJJCDGSS-UHFFFAOYSA-N 438.480 2.372 10 20 IECD C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 756812793 ODJOPAGDMQFAER-CVEARBPZSA-N 439.578 2.087 10 20 IECD COC(=O)c1c(F)cccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 757914270 XRKIYNIIPJHSCU-UHFFFAOYSA-N 426.441 2.271 10 20 IECD Cc1cc(C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c(C)n1-c1ccc(F)cc1 763687620 DWTMXXUOPVVFGY-UHFFFAOYSA-N 431.493 2.103 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)s1 766200625 MXCDVZQIFGNBJR-UHFFFAOYSA-N 433.349 2.373 10 20 IECD C[C@@H](c1nccs1)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 767015201 PKXIWEGLVPFMHJ-KRWDZBQOSA-N 447.580 2.114 10 20 IECD NC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(-c4ccccc4)ccc3O)CC2)o1 768873973 UXFCOPJNXCMLJN-UHFFFAOYSA-N 441.509 2.258 10 20 IECD CCN1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 769786763 HATVVGKSPNULKY-UHFFFAOYSA-N 448.501 2.269 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)CC2)cc1 772457489 WTOLDEPMGSVPJK-IBGZPJMESA-N 443.592 2.050 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1 774273306 BWNBDULJOQJOFQ-NRFANRHFSA-N 431.558 2.451 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)c1 775579385 SFSSCEWRDAOWBA-UHFFFAOYSA-N 447.557 2.211 10 20 IECD CCOCCCN1CC[C@H](NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)[C@@H](C)C1 775926784 AGRUFHMIXPOFJX-REWPJTCUSA-N 432.609 2.070 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2c(=O)n(C)c(S)nc2c1 777828981 RQXNVETUKXCAGA-UHFFFAOYSA-N 447.900 2.397 10 20 IECD CCc1oc(C(=O)OC)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 778558696 ZQXIOXYXYVYDRD-UHFFFAOYSA-N 436.895 2.454 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(Br)c(OC)cc2OC)c1 778610055 XKHWMXJZSGFHPM-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCC[C@]1(C)C(=O)NCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782661099 HVRUSVBMIAQRDP-SAHWJRBASA-N 434.556 2.046 10 20 IECD COc1cc(NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc(OC)c1 785433295 MDPRSXIWXKYBHU-UHFFFAOYSA-N 440.544 2.489 10 20 IECD COc1ccc(OC)c([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 785499537 MUDWWMIDTKXUHQ-MRXNPFEDSA-N 427.501 2.034 10 20 IECD CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 788564918 YVQVEHXWTGXECL-RBUKOAKNSA-N 447.580 2.388 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc([N+](=O)[O-])c1C 790366841 JJRSECDFCGJZBJ-UHFFFAOYSA-N 433.486 2.077 10 20 IECD Cc1ccccc1C1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793735848 ZCKRXDLTEZHZKY-FQEVSTJZSA-N 448.567 2.161 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c1 800839219 ADDVJDCJKPVJLC-UHFFFAOYSA-N 442.515 2.010 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 806457237 HBOUULIUBDWXSC-ZBFHGGJFSA-N 433.446 2.489 10 20 IECD COC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806841922 BGYSSRYIQKWZCW-UHFFFAOYSA-N 435.477 2.074 10 20 IECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807291777 NHTDLRDOFKULKD-QUCCMNQESA-N 426.561 2.222 10 20 IECD C[C@H](NC(=O)C(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674125 GLEBHAVJGWOVSE-ZDUSSCGKSA-N 428.480 2.206 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN(C(=O)N(C)C)CC1 915217360 ZEJZFRNTWBSWBE-HNNXBMFYSA-N 434.496 2.088 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 918307084 MIJAEIJBUFUFID-UHFFFAOYSA-N 433.512 2.396 10 20 IECD CCOc1ccc(N2CCN(CC(=O)NCCOc3ccc4c(c3)OCO4)CC2)cc1 1323175672 CKZCNQISFUKYOK-UHFFFAOYSA-N 427.501 2.131 10 20 IECD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1C 1782005377 BUCYSSKBARMONQ-OAQYLSRUSA-N 433.892 2.155 10 20 IECD CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccccc1 1786358830 CWXGHLKFPZZUDN-RNQOJCNYSA-N 439.512 2.280 10 20 IECD O=C(CCN1CCOC1=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789137401 VLRVUSUYSXNKKB-UHFFFAOYSA-N 440.456 2.083 10 20 IECD O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806515401 MURRVCGKQUJNMD-MBSDFSHPSA-N 432.480 2.450 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)c3ccccc3O)C2)CC1 1807868604 PQNHIARUNZXCLS-UHFFFAOYSA-N 447.582 2.097 10 20 IECD O=C(c1ccc2c(c1)OCO2)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551144 CMXREKKODFFXBL-UHFFFAOYSA-N 439.468 2.380 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2)C1 1843275403 VIAUUHIWORSQAN-UHFFFAOYSA-N 442.479 2.124 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(O)c1 1844879410 FAZIYYIHPRAXTL-UHFFFAOYSA-N 448.479 2.011 10 20 IECD C[C@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847735424 RGZCGYLCZIYYOY-BPUTZDHNSA-N 449.623 2.229 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4scnc4c3)CC2)cc1 726296337 YEZWAUVGBHQBAF-UHFFFAOYSA-N 439.541 2.182 10 20 IECD CCOC(=O)c1c(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)n[nH]c1C 727359773 XXDSINNSEDBHPL-UHFFFAOYSA-N 432.506 2.006 10 20 IECD C[C@@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NC(=O)C1CCCCC1 727371304 IBKILBGNEWZCOH-KRWDZBQOSA-N 435.590 2.013 10 20 IECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 737132094 VIPAODMEJQRYTM-UHFFFAOYSA-N 438.528 2.133 10 20 IECD CN(c1ccc(CNC(=O)N2CCN(S(=O)(=O)N(C)C)CC2)cc1)C1CCCCC1 742758636 GAKMJEXWULYZHJ-UHFFFAOYSA-N 437.610 2.089 10 20 IECD COCCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(OC)c(OC)c1 746478319 TUQODTPEKYNBLA-UHFFFAOYSA-N 433.417 2.432 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(C(=O)OC(C)(C)C)CC3)CC2)cc1 754030983 PXKJDXLYWRZXNP-NRFANRHFSA-N 433.593 2.232 10 20 IECD Cc1nn(C)c(C)c1OCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 758995786 VVFLFLKBIKIFDH-UHFFFAOYSA-N 447.447 2.373 10 20 IECD C[C@H]1COCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762704191 LZCFSEWWZBDPDF-SJCJKPOMSA-N 435.458 2.256 10 20 IECD CCCN(CC)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 764212608 PUDDDXMFUWRUGB-GZTJUZNOSA-N 435.571 2.465 10 20 IECD O=S(=O)(NC1=NCCCCC1)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765026660 DDFYIIQTCXRPBF-UHFFFAOYSA-N 449.514 2.274 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765924988 BUMMQDHTAFMFKP-UHFFFAOYSA-N 441.303 2.122 10 20 IECD CN(C)c1nc2cc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc2o1 766164403 NECUEMJYOJAPJU-UHFFFAOYSA-N 443.529 2.450 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1C 766364313 FDCWGLMLKRWIAC-UHFFFAOYSA-N 444.557 2.099 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 768009381 BNAQBTGFXILBFR-QGZVFWFLSA-N 443.475 2.379 10 20 IECD COc1ccc(N2CCN(CCNc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)cc1 769859085 MNATWPJXDLZABI-UHFFFAOYSA-N 440.547 2.303 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCn4cc(Cl)cn4)n3)CC2)cc1 771080428 BNDNRIXDKXLYQF-UHFFFAOYSA-N 430.896 2.062 10 20 IECD CC1(C)CN(CC(F)(F)F)CCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775564422 YXEYLABRGBWPEY-UHFFFAOYSA-N 446.489 2.237 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](C)O[C@H](C(F)(F)F)C3)CC2)cc1 778294226 KGSQFMAWZOWDPE-KJTGTQQJSA-N 441.450 2.078 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)C[C@H](C)O1 785296604 OGACQYBMMGYERP-PMPSAXMXSA-N 427.501 2.397 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(F)c(S(C)(=O)=O)c1 786526066 JMFBOYDAAFHFRV-UHFFFAOYSA-N 429.853 2.404 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CCC2(CC1)OCCO2 787431771 MTSNWNPVWADGGS-UHFFFAOYSA-N 441.322 2.305 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCc4ccccc43)cc2)C1 788484793 OWYPDEMOGPPNEC-SFTDATJTSA-N 448.567 2.241 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)CC2)cc1 790921927 NPCXLQBOJKOFBQ-MRXNPFEDSA-N 441.532 2.046 10 20 IECD CC[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734337 SCTQNNQCEHRVLY-TZIWHRDSSA-N 437.544 2.009 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)Cc3ccc(O)cc3)cc2F)CC1 793822312 BPZUSMJXTBUFRB-KRWDZBQOSA-N 442.535 2.037 10 20 IECD CN(CCOc1ccc(S(=O)(=O)N(C)C)cc1)Cc1ccc(N2CCOCC2)cc1 797707464 HVMUMFNSLAUWAT-UHFFFAOYSA-N 433.574 2.284 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 799260420 VMJBEHFMNVTOKQ-KKSFZXQISA-N 438.528 2.486 10 20 IECD CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] 801159815 WCQFRCPEIIWOQZ-UHFFFAOYSA-N 447.513 2.137 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O 801545877 SIVBGBGWBWCKAR-UHFFFAOYSA-N 449.573 2.413 10 20 IECD COCCN(Cc1cccs1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803300024 OXFYLSPABBYBTE-KRWDZBQOSA-N 431.558 2.437 10 20 IECD COc1ccc(COCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 803301358 ZQBZXDUUVYYHDG-SFHVURJKSA-N 441.528 2.042 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCCCn3cc(Br)cn3)ccc21 803685387 FPUGBFFNPSZTQX-UHFFFAOYSA-N 448.365 2.241 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)cc1F 804852013 WVCAMDRGQIOINH-UHFFFAOYSA-N 442.451 2.389 10 20 IECD CCOC(=O)C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)=O 805540357 PBUVXCYXUOQMKD-OAHLLOKOSA-N 441.483 2.322 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1F 807385930 VHRMBBAFUOOXRH-VWLOTQADSA-N 429.267 2.286 10 20 IECD CO[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1(C)C 807769691 UXZXLRYRAJTWQC-KBRIMQKVSA-N 425.476 2.303 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1 916502203 FOEYIAJRHLOMQA-IBGZPJMESA-N 430.936 2.476 10 20 IECD O=C(CN1CCN(c2ccccc2F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 916977217 NFCANXKRSXNYQK-UHFFFAOYSA-N 430.499 2.240 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)S(=O)(=O)c3ccccc3)cc2F)C[C@@H](C)O1 917714711 NYQCFCZRHLZBGT-IAGOWNOFSA-N 449.548 2.376 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1Cl 918311464 RMLJSATWAHLOMF-UHFFFAOYSA-N 444.919 2.133 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(O)cc3O)cc2F)C[C@@H](C)O1 918875844 WYPLUNDISIJEHH-OKILXGFUSA-N 432.448 2.324 10 20 IECD O=C(Cc1ccsc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782000938 GJFOMZNLMRPSFN-HXUWFJFHSA-N 436.917 2.499 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1ccc(C2(NC(=O)Cn3cncn3)CCC2)cc1 1792301090 DIXREVUZORBPPT-YCRREMRBSA-N 449.467 2.242 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc(C(F)(F)F)c1 1796599475 NPCCBWOLCHHYHR-BTTYYORXSA-N 436.390 2.472 10 20 IECD COc1cc(OC)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796601422 GUCLPYIRDBRFEY-MUJYYYPQSA-N 427.457 2.076 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3ccnc23)[nH]n1)c1cc(O)nc(O)c1 1817846259 OAZPKJMBONQVOI-MRXNPFEDSA-N 447.455 2.483 10 20 IECD Cc1nc(N)sc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426024 GVDCNHCIOUSMKG-HNNXBMFYSA-N 445.545 2.387 10 20 IECD O=C1C[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1831417901 HRLBHLNHSMOREE-WBVHZDCISA-N 449.935 2.121 10 20 IECD Cc1c[nH]cc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031557 OQEHKLJNQGXZKP-UHFFFAOYSA-N 428.489 2.055 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3c(C)c4ccccc4n3C)CC2)cs1 472234998 ZMRKLKVTGPTGFA-UHFFFAOYSA-N 447.586 2.468 10 20 IECD Cc1cccc(C(=O)N2CCC(O)CC2)c1NS(=O)(=O)c1cccc2nsnc12 514512599 NWBHWUGJXLPOJX-UHFFFAOYSA-N 432.527 2.397 10 20 IECD NS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1F 726567050 CRHGQQJOFOJWGA-UHFFFAOYSA-N 443.447 2.473 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)NC(=O)C3CCCCC3)CC2)cc1 727375723 LRNIAPNRZWLMSD-LJQANCHMSA-N 430.593 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cccc(NC(C)=O)c3)CC2)cc1 729877260 RWSKBYYGHAWXDZ-SSEXGKCCSA-N 429.542 2.251 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](N3CCCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730808683 OSPUDSRLRLZJQS-FQEVSTJZSA-N 444.601 2.484 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc4c(=O)n5c(nc4c3)CCC5)c2)CC1 739767912 HZESEEPXRPWQSN-UHFFFAOYSA-N 431.496 2.297 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)Cc3ccc(OC)nc3)CC2)cc1 749167529 SKUWUWNFVRDLRH-UHFFFAOYSA-N 427.549 2.453 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@H]3OCCc4ccccc43)CC2)cc1 754026611 XCKPDAKFYAIHAQ-RCZVLFRGSA-N 425.573 2.424 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c(C)n1-c1ccccc1 754934901 ZXINTYXFNFZARR-UHFFFAOYSA-N 429.484 2.367 10 20 IECD C[C@H](NCCS(=O)(=O)N1CCOCC1)c1cc(Br)cc(Cl)c1O 756689997 WUGWXVSAAJAPAH-JTQLQIEISA-N 427.748 2.121 10 20 IECD C[C@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccc(Br)cc1O 756738652 KHZJUXIAORRJEC-LBPRGKRZSA-N 443.367 2.392 10 20 IECD COc1ccccc1C(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 760536506 FKOMTIFQNKBPPU-UHFFFAOYSA-N 449.486 2.450 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1N(C)C 760539307 BNIOJBFVHGSOLI-GOSISDBHSA-N 430.574 2.241 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761463853 YMLQPXKWGVIGNF-BBRMVZONSA-N 446.525 2.473 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 766200869 OYUIHZVXKUWRRN-UHFFFAOYSA-N 427.320 2.312 10 20 IECD Cc1cc(S(=O)(=O)NCCNC(=O)NCc2ccc(N(C)C)c(F)c2)c(C)s1 772604020 QYPQQUZNTVYCAD-UHFFFAOYSA-N 428.555 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(C)(C)N3CCCCC3)CC2)cc1 778220579 YQSCLLUHPZMZBK-VAWYXSNFSA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)cc1 778394762 BTNMJCMUTWTXTC-DGVDTQEHSA-N 434.540 2.203 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](C4CCOCC4)C3)CC2)cc1 778396262 XQYZTZRXJNZGST-YJJPMGAVSA-N 427.545 2.175 10 20 IECD C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCS(=O)(=O)CC1 779014883 YLJQQROJKOTFOY-QGZVFWFLSA-N 447.580 2.245 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCC[C@H]1CO 781930706 SBXQAILGTHJTSQ-DEOSSOPVSA-N 438.572 2.479 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(OC)cc3OC)CC2)cc1 786665869 KWGLGJOMWPYYII-UHFFFAOYSA-N 427.501 2.114 10 20 IECD C[C@@H]1CCCCN1C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321089 SKRUPCWVPWTJDB-IFMALSPDSA-N 442.604 2.252 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3nnn(CC4CCCC4)c3C)CC2)cc1 788741890 IPXVNZKIIUCSFY-UHFFFAOYSA-N 426.565 2.337 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccccc1F 789798272 DLSKUZGFNGITIF-HNNXBMFYSA-N 433.455 2.001 10 20 IECD C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812573 MMRVSEBMEVQYGY-DZGCQCFKSA-N 431.430 2.468 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 789833544 GRERWXAGVCSVFK-GOSISDBHSA-N 447.551 2.401 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](C(F)(F)F)O1 789864812 RXZKVEDWEIWHNX-XJKSGUPXSA-N 431.480 2.034 10 20 IECD COCc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 795847888 GDIOAPSFDOFANV-UHFFFAOYSA-N 438.521 2.420 10 20 IECD COCCOc1cncc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 800939772 UAEFMVCEGCMADD-UHFFFAOYSA-N 431.489 2.095 10 20 IECD COC(=O)c1c(F)cc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1F 802554359 AHNCZDJDQPKDPJ-UHFFFAOYSA-N 447.438 2.484 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2cccc(F)c2)C1)c1ccc(N2CCOCC2)cc1 803308824 KTENLMYTSWJMCI-VGSWGCGISA-N 441.503 2.440 10 20 IECD C[C@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 917709712 WIBPLBZOYGAWIO-MRXNPFEDSA-N 427.476 2.483 10 20 IECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 917918058 KCQWTBODSCRTDI-UHFFFAOYSA-N 428.457 2.297 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C[C@H]4CCCO4)CC3)cc2F)C[C@@H](C)O1 918221132 OBCRKRRCJRRGRW-QWFCFKBJSA-N 434.556 2.446 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 918304439 QVQJRFUVNYXLSR-UHFFFAOYSA-N 438.528 2.212 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(-n2cccn2)cc1 918437955 CSDHKAXVUUVQPI-UHFFFAOYSA-N 437.475 2.227 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc(CN4CCC[C@@H]4C(N)=O)c3)CC2)cc1 920928348 OZTSFDMOCVRANE-JOCHJYFZSA-N 437.544 2.499 10 20 IECD Cc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1785962894 AZXSGMOUDAIREF-AXHNFQJDSA-N 445.903 2.362 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)C)[C@H]3C2)cc1 1786479345 AGJMVNQCJKEBRQ-PMVMPFDFSA-N 438.572 2.249 10 20 IECD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c(C)n1C 1799768988 IQTAHFIIQYZGMA-CCWDJLKJSA-N 447.919 2.224 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)[C@@H]3CC=CCC3)C2)CC1 1805406034 KTGGTUZDEOVSLV-MRXNPFEDSA-N 435.615 2.434 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cnc[nH]3)C2)CC1 1808269405 JTWJBJKQDWRQFZ-UHFFFAOYSA-N 434.500 2.047 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)c2ccco2)CC1 1823772088 WMOSJPSSJVQMND-OXQOHEQNSA-N 429.473 2.053 10 20 IECD Cn1nncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1825359641 CUWCBYXWFZZDHR-MRXNPFEDSA-N 447.923 2.427 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1)CCO2 1838852007 MBIYMTUVXZSFAV-QFIPXVFZSA-N 446.887 2.135 10 20 IECD O=C(c1ccc(Cl)nc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440692 AQBSXNDZCKLAGO-UHFFFAOYSA-N 437.887 2.345 10 20 IECD COc1ccc(CCNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 15571695 ZVXFQYQUFGRXKH-UHFFFAOYSA-N 427.545 2.331 10 20 IECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1 727242891 PQGGTUVUJHAZJH-UHFFFAOYSA-N 434.543 2.202 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 729784697 OHKCALNPCVWETC-UHFFFAOYSA-N 439.512 2.478 10 20 IECD Cc1nc2n(n1)C[C@H](N[C@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 732918424 MEPGWOVIBOATGI-CZUORRHYSA-N 429.480 2.294 10 20 IECD O=C(CCN1CCN(c2ccccn2)CC1)NCc1ccc(N2CCSCC2)cc1 741145733 ICFKTJHNSWYXPU-UHFFFAOYSA-N 425.602 2.463 10 20 IECD CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 741181654 AOWIQARFCGEAQN-PMACEKPBSA-N 443.592 2.082 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c[nH]1 742277828 FZPDSANAAHHQGM-CHWSQXEVSA-N 425.482 2.033 10 20 IECD O=C(NCCNS(=O)(=O)c1cccnc1)N(Cc1ccco1)Cc1ccccc1O 746326919 UZYSUMACWCYEMH-UHFFFAOYSA-N 430.486 2.071 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCOc3ccc(C(N)=O)cc3)cc2F)CC1 748709808 SCHFYDREEZILFP-UHFFFAOYSA-N 428.508 2.152 10 20 IECD COCCOCC(=O)NC1CCC(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 748723348 BQEKWEXKUWYCFA-KMFTYDHNSA-N 447.576 2.038 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 749641545 IGPDUIHTKUXUCB-UHFFFAOYSA-N 449.515 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C(=O)N(C)C)c(C)c3)CC2)cc1F 754213982 JOQFKCPCYKVZEP-UHFFFAOYSA-N 442.491 2.132 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3coc(S(=O)(=O)N(C)C)c3)cc2F)C[C@@H](C)O1 755579915 VPTGKLRVSQPDLZ-ZIAGYGMSSA-N 439.509 2.213 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCc2n[nH]cc2C1 756940554 NTKKVRIRYNVYQF-KRWDZBQOSA-N 435.507 2.087 10 20 IECD COc1cc(N2CCN(C(=O)NC3CCN(CC(F)F)CC3)CC2)cc(OC)c1OC 759253628 IGBSMDNGPFALOY-UHFFFAOYSA-N 442.507 2.274 10 20 IECD CC(C)(C)OC(=O)c1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 777875444 OLJYVFZQMNULLP-SDNWHVSQSA-N 442.584 2.392 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 778234145 MLLJPCWRUXGTFP-QIAVYIFCSA-N 442.604 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3CCN(C(C)(C)C)CC3)CC2)cc1 778245350 FUDUPCFMULGUHG-MDZDMXLPSA-N 428.577 2.279 10 20 IECD Cc1nc(Cn2nnc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2C)no1 782677085 QMGMAEYFCJOXFU-CHWSQXEVSA-N 443.483 2.009 10 20 IECD C[C@@H]1CCC[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793725705 RLTYBPIQFOQWJJ-WSTZPKSXSA-N 428.577 2.337 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)c(O)c1 797390724 OPDKMMILZYBMNP-UHFFFAOYSA-N 443.525 2.153 10 20 IECD CC(C)NS(=O)(=O)NCCNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799985608 ZFBVUHOHQJEYJY-OAHLLOKOSA-N 446.017 2.208 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)cc1F 803662336 BATUSRYCLFUCMG-UHFFFAOYSA-N 444.482 2.022 10 20 IECD Cc1nc2n(n1)C[C@@H](NC(=O)C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CC2 804361965 NKSMBWLMQQGJFA-YOEHRIQHSA-N 444.967 2.224 10 20 IECD CCOc1cccc(Cc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)n1 809464510 GQRNQQUJYGQQQI-UHFFFAOYSA-N 437.500 2.354 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(C4CCC4)C[C@@H](C)C3)CC2)cc1 813609203 BWEPAOJJANKNQK-HXUWFJFHSA-N 429.609 2.333 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)CC34CCC(CC3)CC4)cc2)CC1 814383280 SNQXRCUORPURKA-UHFFFAOYSA-N 426.604 2.311 10 20 IECD O=C(NCCNS(=O)(=O)Cc1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 916517278 OGXIHOOXHUTSRY-HXUWFJFHSA-N 447.557 2.202 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H](C)c3ccc(S(C)(=O)=O)cc3)nc12 917096279 TYJVNDMFUCURDX-CYBMUJFWSA-N 432.502 2.208 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 918306239 XIVMXRCTEUULJP-CALCHBBNSA-N 425.533 2.358 10 20 IECD O=C(NCCN1CCN(Cc2ccccc2)CC1)NCc1ccc(N2CCOCC2)cc1 919790135 LTNRTMNYZUEHDX-UHFFFAOYSA-N 437.588 2.140 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCCCC1 1795710430 HQCPLGJWIYHYGM-ASYHBGTLSA-N 443.544 2.331 10 20 IECD CC[S@@](=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798291101 MOILBMGQMSBEGK-KTJAZULCSA-N 428.938 2.162 10 20 IECD Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)n1 1805509820 OUKXNPSTRPVPKO-HRAATJIYSA-N 433.468 2.225 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cnc3ccoc3c2)C1 1843289886 ZQFFNBLWANDTCT-HWKANZROSA-N 435.436 2.475 10 20 IECD CC[C@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847055766 MXHBFVFQSRHPGV-INIZCTEOSA-N 431.583 2.244 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(N3CC=C(c4c[nH]c5ncccc45)CC3)nc2)CC1 643846864 CDWRHDJAYIEKPC-UHFFFAOYSA-N 438.557 2.188 10 20 IECD COc1ccc(N2CCC(NC(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1 726562369 LHGKLDFLLRYLMG-UHFFFAOYSA-N 435.521 2.288 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccccc3NS(C)(=O)=O)cc2F)CC1 730236178 WHSRPHMUIKKWNO-UHFFFAOYSA-N 434.537 2.269 10 20 IECD COC1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 730829464 IPHPDBPUHDGVPX-UHFFFAOYSA-N 436.572 2.475 10 20 IECD O=C(OCCCN1C(=O)CNC1=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 733385100 BIGDXJMCNQDZML-UHFFFAOYSA-N 426.812 2.214 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(C)c1C 735267813 HOBODHVZACCTNP-UHFFFAOYSA-N 428.488 2.183 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)c(F)c3)cc2)C1 742279916 LBZSZVFDANYVNQ-CYBMUJFWSA-N 427.448 2.284 10 20 IECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(NC(C)=O)c1OC 742577893 SRRRFXHIWSCCCT-UHFFFAOYSA-N 447.513 2.149 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1N1CCNC1=O 743315370 UBCRDGVUSYWTPM-UHFFFAOYSA-N 442.491 2.255 10 20 IECD C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 746048834 JJPYAJRAAMVOMG-PXNSSMCTSA-N 444.601 2.489 10 20 IECD NC(=O)CC[C@@H](C(=O)NCc1ccc(N2CCCCC2)cc1)N1C(=O)c2ccccc2C1=O 746172745 OMMOFPIAZAPLSK-NRFANRHFSA-N 448.523 2.223 10 20 IECD COc1ccc(C(=O)NCc2ccccc2O)cc1S(=O)(=O)NCc1ccccn1 748345631 GBBGMJONVVLOOT-UHFFFAOYSA-N 427.482 2.204 10 20 IECD COC(=O)CC1(CS(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 751373096 RMYAKHCXFYMWQA-MRXNPFEDSA-N 430.954 2.273 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NCc1ncccc1F 752152016 RZXXXAIPIYPKTH-UHFFFAOYSA-N 439.470 2.476 10 20 IECD CC(=O)N1CC[C@@H](CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 755148859 ZUWLXNGWBFAUJV-AWEZNQCLSA-N 435.436 2.311 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)co1 755936605 LVMFKERLZGWQHI-CYBMUJFWSA-N 429.445 2.188 10 20 IECD CCCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 756084998 TUQAOFLXMKWHLC-HNNXBMFYSA-N 429.546 2.052 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(=O)n(-c2ccccc2F)n1 766205014 OHJWFMMMBBGCSD-UHFFFAOYSA-N 438.459 2.253 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1 769655377 BKWWNAKGLMSCDC-UHFFFAOYSA-N 443.979 2.279 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Nc1ccc(C2CC2)cc1 772227524 GKNJGJUCYAOJRS-UHFFFAOYSA-N 427.526 2.054 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2F)C[C@@H](C)O1 774499567 ZVGBIQRWNKYGJK-HZPDHXFCSA-N 448.583 2.481 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H](C)C(=O)NC(C)(C)C)cc2F)C[C@@H](C)O1 776849697 LVJOVSJCCKZIPP-BBWFWOEESA-N 436.572 2.291 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3COC4(CCOCC4)O3)cc2F)C[C@@H](C)O1 776897169 SSUNPCWXJXFPAZ-NUJGCVRESA-N 437.512 2.161 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3ccc(Cl)cc3)CC2)cc1 778230476 BNICXKMLSAWURM-RQWLHQTBSA-N 443.931 2.403 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)C(=O)Nc3ccccc3)CC2)cc1 778273830 ZCNOCEXBJOLXIR-SQVRQVGWSA-N 436.512 2.043 10 20 IECD CC(C)(O)CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 779199711 IAWSXYJEEBUOGU-UHFFFAOYSA-N 449.485 2.477 10 20 IECD CC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 785506789 VPAXXCRZIWHBFN-HNNXBMFYSA-N 434.968 2.320 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1coc(-c2cccs2)n1 785686069 FDDCIEYLDSNQGR-UHFFFAOYSA-N 444.488 2.311 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 787706969 PQNGIVUHKRGWEM-WOJBJXKFSA-N 430.593 2.218 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 797611288 OADYGJGVEOYCMU-HNNXBMFYSA-N 428.489 2.121 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)c2cccc(O)c2O)C(F)(F)F)CC1 801556797 DVICXOOSIQKYGR-CQSZACIVSA-N 433.427 2.311 10 20 IECD O=C(N[C@H]1CCCN(c2cccnc2)C1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 808198979 TYEJUHCPWCQUEK-FQEVSTJZSA-N 448.479 2.221 10 20 IECD Cc1cc(-c2nnc(N3CCCN(S(C)(=O)=O)CC3)n2C)c(C)n1-c1ccccc1 809807930 VJPUKERTTGAICA-UHFFFAOYSA-N 428.562 2.361 10 20 IECD NC(=O)c1cccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 913332395 SFYOIWLCOQEKBC-UHFFFAOYSA-N 428.400 2.356 10 20 IECD Cc1cccc(NC(=O)CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 917028891 XVHYORIVYLUGRQ-UHFFFAOYSA-N 442.535 2.466 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CCCS(=O)(=O)N3CCCC3)cc2F)C[C@@H](C)O1 917710419 VANYKWYDFSTEED-IAGOWNOFSA-N 441.569 2.261 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3C(=O)c3ccco3)cc2)C1 918659674 REVLMFJDEUSKBV-UYAOXDASSA-N 438.528 2.292 10 20 IECD CCN(CC)C(=O)CN1CCCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 920920510 HSUZMYUUJNZDIH-HXUWFJFHSA-N 445.608 2.170 10 20 IECD CN1CCN(c2ncccc2CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 921199362 INYPGDVUZLNQNE-UHFFFAOYSA-N 440.617 2.386 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)o1 1790244978 IZTJJBZUCDTEFX-JDFRZJQESA-N 449.891 2.263 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)Cn2cccn2)C3)cc1 1799620720 TYCNGODSUAVVAE-RUMRUAAYSA-N 447.539 2.194 10 20 IECD Cc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)s1 1799768145 LZPPLSWIEOIUHU-DRXBFXEBSA-N 437.905 2.033 10 20 IECD CC[C@H](C)CC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1803368049 HVYUFLANAHHTQR-YYFZDKIDSA-N 448.614 2.384 10 20 IECD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336420 XBUPLSREQFZAGB-DYSFYUKASA-N 435.615 2.311 10 20 IECD Cc1ncsc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991038 MXDQBOLSGVIPSX-KBXCAEBGSA-N 439.497 2.286 10 20 IECD Cc1occc1C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1808317531 MDSBETQNYOPIRP-UHFFFAOYSA-N 435.571 2.293 10 20 IECD CCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812613689 GVBSHKVZVCDFJO-QAPCUYQASA-N 448.614 2.384 10 20 IECD COc1ccccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727502 ZDNOUCVTHWWJQR-LBPRGKRZSA-N 440.481 2.498 10 20 IECD CCN(CC)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847144 MFNOPHFRHQEHEV-WMLDXEAASA-N 444.536 2.500 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc2ccccn12 1818612514 WHVJMKXIKKOAAZ-OAHLLOKOSA-N 447.455 2.483 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCOC1)CC2)c1cc(O)c(O)c(Cl)c1 1823713703 QGUOFJHWXHOXRU-KOLCDFICSA-N 437.905 2.470 10 20 IECD Cc1nnc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)s1 1827150486 XTTNYVUUWQKPJW-MRXNPFEDSA-N 445.545 2.129 10 20 IECD O=C([C@@H]1Cc2ccccc2CN1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501259 SRFOVOHDNGTKKE-SFHVURJKSA-N 441.915 2.283 10 20 IECD O=C(CS[C@@H]1CCCCO1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038977 WIMSNAICRYVXOT-ZLQZBKBYSA-N 448.541 2.280 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CSc1ccncc1 1848134654 QTUMFZPJNGCLLY-BPTRJATKSA-N 441.509 2.206 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2Br)cc1 326701038 VVWITNFEVKJNNN-UHFFFAOYSA-N 449.304 2.320 10 20 IECD CCCN(CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)Cc1ccccc1O 727831201 NMCIVXTVVYFVNE-UHFFFAOYSA-N 449.548 2.276 10 20 IECD CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NCc3ccc(N(C)C)cc3)c2)CC1 728393831 QYMOADGPKUFALB-UHFFFAOYSA-N 445.589 2.401 10 20 IECD CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 737118092 ZPSMSBMJHWEOSM-UHFFFAOYSA-N 425.533 2.240 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)OC)c2)cc1OC 743254130 KRDLXQRMQXVARH-UHFFFAOYSA-N 434.517 2.106 10 20 IECD O=C(NCCCSc1nccs1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 759591018 ORDFWUZWELJHDT-UHFFFAOYSA-N 440.616 2.483 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(CN4C(=O)CCCC4=O)cc3)ccc21 761052734 HESXNMBWWWZEBP-UHFFFAOYSA-N 448.523 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3C[C@@H](O)c3ccccc3)CC2)cc1 763431869 XENKSLXVQLJTMB-LADGPHEKSA-N 439.556 2.168 10 20 IECD CS(=O)(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 764733159 AZZFACJEGLWHBN-WMLDXEAASA-N 431.505 2.475 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(N2CCCNC2=O)c1 765927333 QGTQGMJDWGOBSQ-UHFFFAOYSA-N 447.289 2.329 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cc(OC)c(C)cc3O)CC2)c1 768441289 GAMBSYFTVZSCCK-UHFFFAOYSA-N 440.543 2.064 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 769666120 GMGYJOHEXBFRME-UHFFFAOYSA-N 433.895 2.041 10 20 IECD C[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1C(=O)NC2(CCCC2)C1=O 771055741 DDZPGBPYYVZSIB-YOEHRIQHSA-N 448.951 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@@H](CS(C)(=O)=O)c3ccccc3)CC2)cc1F 774274336 DXYZZCJVQURBRP-IBGZPJMESA-N 435.521 2.452 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@H]1CC1(Cl)Cl 775163988 ORKHUHQJIWOWQI-QGZVFWFLSA-N 439.387 2.145 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775260001 MIWCJVHHTGEGKS-JPYJTQIMSA-N 437.540 2.300 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3COC4(CCCCC4)O3)CC2)cc1 775734675 VWURLLUBGSMIGN-OAQYLSRUSA-N 432.565 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCCNc3ccccn3)CC2)cc1 778265268 VTOASHROUPMDDA-QXMHVHEDSA-N 437.544 2.304 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1 779486238 SUHXSEHDDJCOMX-NHCUHLMSSA-N 441.553 2.216 10 20 IECD C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)Nc1ncccn1 785408007 OGEXPJOECCFMQF-LLVKDONJSA-N 448.482 2.229 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@@H]4C3)CC2)cc1 785610497 XSFATDZVXSETOZ-NJDAHSKKSA-N 442.604 2.409 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ccc(O)cc4C3)cc2F)C[C@H](C)O1 789811785 IBLOOAKBNVPGJM-HOTGVXAUSA-N 441.503 2.346 10 20 IECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789828786 YOFKAWNNQINOLE-GGUMNFRJSA-N 449.567 2.455 10 20 IECD Cc1cccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 793733274 LYHNCKVVBCTPBF-SIKLNZKXSA-N 449.555 2.072 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1OC 793914088 MNIUJQVBUCZQPC-UHFFFAOYSA-N 441.528 2.070 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[nH]1 796351579 QSAFWCCHVFNXJD-ZIAGYGMSSA-N 447.463 2.027 10 20 IECD Cc1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nc2ccccc12 803305435 MLJOIGSSHRIRST-INIZCTEOSA-N 433.512 2.268 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCC1CCSCC1 803664115 FCGSCJKZXCTTFR-UHFFFAOYSA-N 430.618 2.094 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 804968918 JTJZANAWHHBHDW-GOSISDBHSA-N 433.528 2.142 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 807103949 YKFWJRTUTGEWOC-WMZOPIPTSA-N 432.565 2.439 10 20 IECD CCN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 808294757 HXMSTQFHVQPUIZ-UHFFFAOYSA-N 445.585 2.466 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N3CCN(C(C)=O)CC3)c2C)cc1 857435125 XHFUSXUMTFYNGO-KRWDZBQOSA-N 427.501 2.339 10 20 IECD Cc1cnoc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121897 DJCGVSOAOQIJQE-IIBYNOLFSA-N 449.891 2.489 10 20 IECD Cc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1782004749 LYLYKXISVKVEFJ-OAQYLSRUSA-N 431.876 2.212 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1C[C@@]1(F)Cl 1796935110 WPELSKYJBYISPQ-MCHXMWHTSA-N 432.883 2.342 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc2n(n1)CCC2 1800718188 NNNHNHLEDOLTMK-YOWGUQMCSA-N 430.892 2.460 10 20 IECD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1F 1804334565 RAEMRRDVQUMWBB-BTTYYORXSA-N 435.546 2.246 10 20 IECD CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804335693 DLYGEEYDVFEDBP-MUJYYYPQSA-N 447.582 2.197 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1 1814186510 RBCDMHBDJDKJDK-LPHOPBHVSA-N 444.582 2.058 10 20 IECD Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1821726309 HUDJQPRQHGBNDM-LBPRGKRZSA-N 427.486 2.136 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)C(F)F)CC2)CC1 1837681568 OIFMGFXITHZCCE-DUXPYHPUSA-N 440.443 2.080 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c(C)n1C 1843442346 CGJSGQDKVYADSF-UHFFFAOYSA-N 433.512 2.252 10 20 IECD Cn1ncc2c(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)cccc21 1843800361 SNEGLEHMWLGZBX-VQHVLOKHSA-N 448.479 2.221 10 20 IECD O=C(c1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054400 KXWNQEDAEGRCDL-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1847074486 DFEXJABGWZUULU-HNNXBMFYSA-N 448.520 2.003 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 729526854 ILDKVASQIKMPKA-OAHLLOKOSA-N 434.500 2.204 10 20 IECD COCCNS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CCCC3)cc2)c1 735511160 UXCZJBSREPGTBU-UHFFFAOYSA-N 446.573 2.211 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 742799120 GNGCJDOFBLIOII-GFCCVEGCSA-N 429.445 2.188 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)CC2)cc1F 746339230 LHEMHANAOXCNRA-HNNXBMFYSA-N 432.418 2.219 10 20 IECD CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 748344163 XLYFROMGUYZROM-OAHLLOKOSA-N 425.551 2.312 10 20 IECD CC(C)COC(=O)N1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 749177650 CKVDYJGBDXPMKX-LJQANCHMSA-N 445.564 2.008 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1ccccc1F 753110393 XIGGXTUNXDOWPK-FQEVSTJZSA-N 430.455 2.184 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4ccncc34)cc2)C1 756159382 OCJPKHZOHMGGCO-SFHVURJKSA-N 431.496 2.191 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)CC4(CCCCC4)CC3=O)CC2)cc1 758220718 RSHQAPBQAUHZGA-HXUWFJFHSA-N 429.561 2.278 10 20 IECD NC(=O)c1ccc(-c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)cn1 762063192 YVSDCUYNEFBYNQ-UHFFFAOYSA-N 443.466 2.465 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)nc1Cl 764527740 SHRAIPIHRBEZIJ-UHFFFAOYSA-N 432.936 2.401 10 20 IECD C[C@@H]1OCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@@H]1C 765690195 ODLHIMYLJJVBQK-SJORKVTESA-N 428.512 2.261 10 20 IECD Cc1cc(Cl)ncc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 766366803 ORIHWQNERKJICC-OAHLLOKOSA-N 429.908 2.000 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)cc1 785427633 FHFCFZNIOMHYBN-UHFFFAOYSA-N 430.499 2.428 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 787636621 VMKSFWUSSQZQTC-MRXNPFEDSA-N 447.486 2.150 10 20 IECD C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1)c1ccc(N(C)C)cc1 788027142 STPQTWDLOUVEIC-SFHVURJKSA-N 441.551 2.007 10 20 IECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccnn1C 788112912 YARORSIOONLULY-QUCCMNQESA-N 426.565 2.361 10 20 IECD CCN(CC)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 793792503 HDDZFBWCHAVWKL-HNNXBMFYSA-N 444.498 2.005 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 793915601 ZNILHEVHDPSMNY-OTWHNJEPSA-N 430.593 2.263 10 20 IECD C[C@H]1CCN(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 795250053 XTQKTAMBEAUUPZ-YJBOKZPZSA-N 426.583 2.495 10 20 IECD CN1CCN(c2ccc(CNCCNS(=O)(=O)c3ccc(Cl)cc3F)cc2)CC1 799345100 RBSPXVAPGXGEGR-UHFFFAOYSA-N 440.972 2.299 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1)c1ccc(N2CCOCC2)cc1 803303173 ISJBHAZIFCFVPC-QKNQBKEWSA-N 442.604 2.470 10 20 IECD C[C@@H](NC(=O)C(=O)NCCc1nc2c(s1)CCCC2)c1ccc(N2CCOCC2)cc1 803304721 CWDYYWBLUSRXCS-MRXNPFEDSA-N 442.585 2.395 10 20 IECD COc1ccc(C)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803661553 GBQYZNRTJFUNTI-UHFFFAOYSA-N 442.535 2.169 10 20 IECD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)nc1 803664972 UYKRPCFAIPUVLB-QGZVFWFLSA-N 441.507 2.089 10 20 IECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687143 VRPUIZUXTPQIGS-SFHVURJKSA-N 435.572 2.422 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3C[C@H](N4CCOCC4)C[C@H]3C)cc2F)C[C@@H](C)O1 804969375 PSZNHRMGTHBNTP-SOAMZJECSA-N 434.556 2.444 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCc4ccccc43)cc2F)CC1 805008612 OMPDCXNASMGDHC-FQEVSTJZSA-N 438.547 2.430 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCC(CCCO)CC1 807768220 FUALVKCSUQMHRE-QGZVFWFLSA-N 439.503 2.384 10 20 IECD CCCN(CC(C)(C)O)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771567 VWPYAOFTPAVJOU-OAHLLOKOSA-N 427.492 2.383 10 20 IECD Cn1cc(-c2nc3ccccn3c2NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 813478634 JEFKOZUVTWJUDT-UHFFFAOYSA-N 426.458 2.064 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1ccc(N2CCOCC2)nc1 916234359 BMNQDDAMSQEUOZ-UHFFFAOYSA-N 427.574 2.471 10 20 IECD CC(C)C(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 917055689 UHJAAPVBQNCTRJ-HDICACEKSA-N 448.583 2.292 10 20 IECD CCN1C(=O)c2ccc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)cc2S1(=O)=O 917824836 ZEWPAAJGRBJYQF-UHFFFAOYSA-N 443.525 2.212 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc2c(cc1F)NC(=O)CC2 917864502 SDAGIUOIIKPANV-UHFFFAOYSA-N 433.505 2.368 10 20 IECD Cc1c(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cccc1-n1cnnn1 918294224 NJSBELIYSHBAJH-UHFFFAOYSA-N 432.440 2.437 10 20 IECD Cc1cc(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1cccc(Cl)c1 919979688 FWJCUNQTVLYVAO-MRXNPFEDSA-N 437.949 2.171 10 20 IECD C[C@@H](NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920882284 YQNAMVMUUQZVGC-MRXNPFEDSA-N 429.542 2.455 10 20 IECD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)cc1 1780770519 SBXWTQHLDOAUMB-VWLOTQADSA-N 446.507 2.231 10 20 IECD CC[C@H](C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806081355 CHWJZGVBINYBJN-PHYPQJFDSA-N 446.544 2.455 10 20 IECD C[C@@](O)(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1827424461 XVTLNSPXBZWOAU-AUUYWEPGSA-N 445.438 2.039 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCOC2)CC1 1832383849 MGAVUUSUDUDBCU-GGUXULKNSA-N 444.528 2.473 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@](C)(C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 725798757 ARJCDZLQLCDUNG-XVTZWQNCSA-N 442.535 2.046 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](CNC(=O)C(C)C)C2)c1 726182938 OZRBYZPUZZJMNH-IBGZPJMESA-N 431.577 2.411 10 20 IECD COc1ccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cc1O 726626999 NQAMDEDLDZQAPA-SXGWCWSVSA-N 436.536 2.450 10 20 IECD Cn1c(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nnc1-c1ccccc1 728165251 FZTMMQFLSDCQKP-LJQANCHMSA-N 432.528 2.043 10 20 IECD CCN(CC)c1ccc(CNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1F 731345782 IUONGHWYBXWNGW-UHFFFAOYSA-N 432.521 2.369 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)cc(OC)cc3C)CC2)cc1 732923279 SFLPTAJDOHLIPN-UHFFFAOYSA-N 433.574 2.421 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CC(=O)N(C3CC3)C2)NC(=O)OC(C)(C)C)cc1 742755025 UNNHCAGOSTUMHL-QFBILLFUSA-N 430.549 2.446 10 20 IECD Cn1cc(-c2csc(NS(=O)(=O)c3cc(S(C)(=O)=O)ccc3Cl)n2)cn1 743047532 ZDNRVVLGCRFFPU-UHFFFAOYSA-N 432.936 2.401 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 747402355 AVSJBWWVIZKRQC-AUSIDOKSSA-N 426.561 2.109 10 20 IECD CN(C)CCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 748959918 NLMFCFCMQCBUQJ-HXUWFJFHSA-N 445.608 2.031 10 20 IECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NCc2cccc(OC)c2O)c1 751309284 KEEYDPXJBCEJNE-CMDGGOBGSA-N 437.470 2.083 10 20 IECD COc1cccc(CNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)c1O 751309578 OMIHNXWDDBXUTE-UHFFFAOYSA-N 432.495 2.169 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)Nc3ccccc3Cl)CC2)cc1 754008972 JICILECCNAICPL-LJQANCHMSA-N 446.979 2.402 10 20 IECD COC(=O)[C@H](c1ccccc1)N(C)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754068187 RZSIIGZJESWWEW-GMAHTHKFSA-N 427.545 2.024 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3cccc(NC(C)=O)c3)CC2)cc1 754123739 MWXCESJRQILMKS-JPYJTQIMSA-N 426.561 2.487 10 20 IECD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 758560455 LJHMMKUJUKVRSA-CQSZACIVSA-N 448.497 2.456 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CC(=O)N(c4ccccc4)C3)CC2)cc(OC)c1OC 759220209 FUICXLUQCLMYLM-KRWDZBQOSA-N 439.512 2.414 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(-c4ncccc4F)n3)cc2)C1 760077721 CFWJBDMCOLQTRV-INIZCTEOSA-N 437.479 2.430 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1 760091699 BAZWTPJJVMQWHI-FQEVSTJZSA-N 439.512 2.288 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)nc12 762899232 QQYPASGHPAQIIP-UHFFFAOYSA-N 425.357 2.358 10 20 IECD C[C@H](NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 764363783 QLLSEKFCPGVOIC-SXWKCWPCSA-N 429.609 2.252 10 20 IECD CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 765255067 OUSPXALQGBOXOK-LPHOPBHVSA-N 430.574 2.147 10 20 IECD CCOc1cc(NC2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)ncn1 767301797 CVGASKCQPNINDV-UHFFFAOYSA-N 440.548 2.498 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)CC2)cc1 774754448 JOBLBCDCCDBZAC-CNNODRBYSA-N 430.593 2.264 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)cc1OC 774828334 XEXMZJFOPBLUNK-UHFFFAOYSA-N 431.445 2.284 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 779489533 RTBLXCMNIWAKPU-VQTJNVASSA-N 445.516 2.107 10 20 IECD CS(=O)(=O)c1cc(Br)cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1F 783322072 OYJPNYOKJYBURQ-UHFFFAOYSA-N 447.234 2.443 10 20 IECD CC(C)C[C@H]1C(=O)NCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783744688 ZEQDIEQCSFJZGI-HNNXBMFYSA-N 437.543 2.241 10 20 IECD Cc1cc(N2CCC(NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)CC2)n[nH]1 784130937 PMLBXWKMJKFTBD-UHFFFAOYSA-N 426.565 2.395 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1 787734242 APOWUEJEWCILOJ-MRXNPFEDSA-N 432.571 2.221 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2 788309723 GPRSKXUGADVMLP-FQEVSTJZSA-N 437.496 2.232 10 20 IECD COc1cccc(F)c1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799057 HTMOGICHHHOCHQ-AWEZNQCLSA-N 433.455 2.304 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](n4ccnc4)C3)cc2F)C[C@@H](C)O1 789827335 SAPOPRPWHTXJEF-LMMKCTJWSA-N 443.523 2.116 10 20 IECD C[C@@H]1CN(C(=O)C(C)(C)C)C[C@@H](C)N1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795123164 PVJMDGBKXVVXAF-QZTJIDSGSA-N 448.583 2.246 10 20 IECD Cc1cc([N+](=O)[O-])cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1F 803462222 NMCKGPVSIAGJBW-UHFFFAOYSA-N 449.410 2.491 10 20 IECD Cc1cc(C(=O)NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c(C)o1 803663675 WRVISVYBDICWRF-UHFFFAOYSA-N 444.507 2.139 10 20 IECD COC1CCN(C(C)(C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 805156144 JIGUKMSESKTQCS-UHFFFAOYSA-N 432.609 2.495 10 20 IECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 806830272 BKQPYKMBNIEHGK-UHFFFAOYSA-N 425.533 2.288 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccnc1OCC(F)F 807387005 UVTWEZQMYNGVNY-UHFFFAOYSA-N 430.205 2.449 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 915778298 ILAAMBIVALLKPC-UHFFFAOYSA-N 442.541 2.082 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1ncccc1C(=O)N(C)C 917416181 NIHVPFXMELXNDP-UHFFFAOYSA-N 432.527 2.371 10 20 IECD Cn1nc(O)c2c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc(C3CC3)nc21 918670836 AQTOZRJLHBTEEN-INIZCTEOSA-N 448.527 2.183 10 20 IECD CCc1nnsc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918903369 OCMZZJZZOOQMKB-STQMWFEESA-N 436.509 2.326 10 20 IECD CC(C)=CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802080168 CZVQQXZHUSZBIQ-HHVYCJAJSA-N 430.501 2.153 10 20 IECD O=C(CCCCn1cccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804335998 PGXAYEZRXNQSAJ-BJWYYQGGSA-N 448.614 2.157 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807996136 YRDWHYNNETZAGU-PTSWNOGYSA-N 428.489 2.021 10 20 IECD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1(O)CCC1 1814423244 ZLVUFFYUDSSSAM-IUODEOHRSA-N 429.477 2.073 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccco1 1816342336 UKFOXRLRNOMGNQ-GFCCVEGCSA-N 433.515 2.169 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1cc(O)nc(O)c1 1817845043 VVBVXNRQUQKLQW-OAHLLOKOSA-N 448.443 2.107 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc3nonc3c2)C1 1843676498 YHGKNTHVENTFIW-UHFFFAOYSA-N 428.832 2.418 10 20 IECD Cc1c(CNC(=O)N2CCN(S(=O)(=O)N3CCCCCC3)CC2)n(C)c2ccccc12 472227204 YRBSPWVRZRQRON-UHFFFAOYSA-N 447.605 2.435 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCNC(=O)CC3CCCCC3)cc2)C1 726103849 VNPWSNKRQHGSTM-HXUWFJFHSA-N 443.592 2.274 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc(Cl)c3c(c2)OCCCO3)SC1=S 727177500 LANJMZINVLYDNH-UKTHLTGXSA-N 448.975 2.252 10 20 IECD Oc1cc2c(cc1CNC[C@H](O)COc1ccc(I)cc1)OCO2 727471337 YEXWPTGHEPUZFP-ZDUSSCGKSA-N 443.237 2.255 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3nc(-c4ccccc4)oc3=O)cc2F)CC1 730235392 VLFFJJLCWJDYQY-UHFFFAOYSA-N 439.491 2.101 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)c2ccc3c(c2)S(=O)(=O)N=C2N=CNN23)cc1 731540703 LQEHILWTFRDZGT-UHFFFAOYSA-N 440.529 2.216 10 20 IECD CCOC(=O)c1c(NC(=O)COC(=O)c2cc(O)cs2)sc(C(=O)NC)c1C 731911266 IHKYDXVURUENGI-UHFFFAOYSA-N 426.472 2.155 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)Nc3cnn(CC(=O)N4CCOCC4)c3)c2C)cc1 741702645 JALYYXDCERFLSQ-UHFFFAOYSA-N 437.500 2.410 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1 743288131 UFHDORDKNMSWDQ-UHFFFAOYSA-N 425.533 2.341 10 20 IECD COc1cccc(CNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)c1O 745673673 FZQUXSVVBTZCDC-UHFFFAOYSA-N 442.516 2.061 10 20 IECD CC(=O)NC[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751062872 GGCSILJMEWUFOS-AWEZNQCLSA-N 437.543 2.243 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 751227693 JVJQCXQYJRQUFH-UHFFFAOYSA-N 436.505 2.360 10 20 IECD C[C@@H]1CN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C[C@H]1C 752301251 PSHJYMVMAYZWQC-ODSUSYTRSA-N 447.582 2.321 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccc3nnnn3c2)NC(=O)OC(C)(C)C)cc1 758254180 UBGIHPZBQWZDJM-KRWDZBQOSA-N 425.493 2.186 10 20 IECD Cc1ccnc(-n2nccc2NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 760214227 ZDEHDXLFZFRDLE-KRWDZBQOSA-N 434.500 2.228 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)COCC(=O)N[C@H](C)c2cc(OC)ccc2O)c1 761967055 FKJUQWMUKWKVTB-ZIAGYGMSSA-N 432.473 2.186 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCC[C@@H]1N1CCOCC1 763662214 YBNCIKJBTNMIFQ-UNMCSNQZSA-N 434.556 2.229 10 20 IECD C[C@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763897402 ZEKFSIFLXAFIMV-GJZGRUSLSA-N 440.521 2.156 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccn(Cc4ccccn4)n3)CC2)cc1 778256585 NMZUPPPECRCXKK-MDZDMXLPSA-N 446.511 2.179 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3CCN(C(=O)OCC(C)C)CC3)cc2)CC1 786256623 HJAXBDLXSVGPFA-UHFFFAOYSA-N 444.576 2.476 10 20 IECD CCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789953632 FRTSBWUXMWLVTO-QGZVFWFLSA-N 443.466 2.186 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@H](N2CCCC2=O)C1 791081864 MUHHMSZUNBUNDJ-AWEZNQCLSA-N 435.527 2.091 10 20 IECD Cc1cc(C(=O)N[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c(C)n1-c1ccccn1 792582692 QGHXRYDQKLFHPZ-QFIPXVFZSA-N 449.559 2.440 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCc2ccccn2)Cc2cccnc2)c1 797782340 WEXDKWOMCLHYKK-UHFFFAOYSA-N 426.498 2.439 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(CS(N)(=O)=O)c1 798248480 CEGXXYUFUXETMG-UHFFFAOYSA-N 447.557 2.477 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3c[nH]c4cccc(F)c34)cc2)CC1 799768459 JZVWOSGZQBPKRD-UHFFFAOYSA-N 437.518 2.020 10 20 IECD CC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCOCC1 803447865 AAJIVZWEEONCOJ-UHFFFAOYSA-N 425.476 2.306 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCc4ccccc43)cc2F)CC1 805008613 OMPDCXNASMGDHC-HXUWFJFHSA-N 438.547 2.430 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCC2(CCOCC2)C1 807771531 VNEPELWSJNOKAH-INIZCTEOSA-N 437.487 2.402 10 20 IECD COc1cc(N2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)c([N+](=O)[O-])cc1OC 811805114 HANYXGWAMHHOCH-UHFFFAOYSA-N 441.428 2.405 10 20 IECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 816482316 BEUDVFUCPLFQEY-UHFFFAOYSA-N 440.884 2.273 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@@H](NC(N)=O)c3ccccc3)CC2)cc1 849192492 TVZTWVSMKSLHCW-JOCHJYFZSA-N 439.560 2.123 10 20 IECD Cc1cc(CC(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 914493335 QEWJUYCOOYHRAU-UHFFFAOYSA-N 438.981 2.241 10 20 IECD CCOC(=O)[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917043419 YEIFXEKKRNKKJH-FIKGOQFSSA-N 435.540 2.473 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCN(C(=O)c4ccsc4)CC3)CC2)cc1 917409049 CNVFIGOWBFGQQH-UHFFFAOYSA-N 442.585 2.253 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)OC)cc2)cc1C 917758448 YXZRXVIXFFOIRC-UHFFFAOYSA-N 442.515 2.109 10 20 IECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1Cl 917918569 QDFSYVJJGARRTI-UHFFFAOYSA-N 428.869 2.492 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(CCc4ccccc4)CC3)cc2)C1 918117729 IBFNSDJOUGUEQZ-QHCPKHFHSA-N 449.599 2.458 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 918632666 ARBFRWWWECGTJS-SOLBZPMBSA-N 441.569 2.117 10 20 IECD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920964477 IJDFOSSAZQCYER-GETUCHRZSA-N 426.428 2.208 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1ccccc1O)CCO2 1782004791 NBQHLOOQPUYHQJ-NRFANRHFSA-N 432.860 2.214 10 20 IECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)C1(O)CCC1 1792557186 NUOFWBKODPDSRW-HSWVFLFASA-N 430.501 2.006 10 20 IECD Cc1noc(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805530803 BELBYJUBTZZFND-MGPUTAFESA-N 437.456 2.126 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997873 GCXYMVHNOJNQGC-CJBQKRJLSA-N 434.855 2.132 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812481266 ORXUOJBLVQGREL-UVVPWPQKSA-N 441.459 2.276 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1842024968 PEJKFZTZBCGXSV-JXMROGBWSA-N 437.496 2.356 10 20 IECD CCOC(=O)[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 15350502 VGPYEAHBZFCFSB-QGZVFWFLSA-N 447.557 2.199 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)CC2)cc1 111165740 VNVUFUABCWZTJJ-UHFFFAOYSA-N 433.486 2.406 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cnc4c(c3)c(C)nn4C)cc2F)CC1 303315053 PZORHTYMCDBPKU-UHFFFAOYSA-N 446.552 2.036 10 20 IECD CCCn1c(N)c(N(CCOC)C(=O)/C=C\c2cnc(C(C)(C)C)s2)c(O)nc1=O 744353613 YLQSNYXCDOXKGH-FPLPWBNLSA-N 435.550 2.388 10 20 IECD COC(=O)[C@@H](O)C1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 747417587 UQSUCJJFQAEORC-YJBOKZPZSA-N 441.475 2.212 10 20 IECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)oc1C 751127771 VAAPPJPTWAMWCH-UHFFFAOYSA-N 446.470 2.275 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cnc4ccsc4c3)cc2)CC1 752245735 AQZGUWWUYHXSPC-UHFFFAOYSA-N 437.568 2.010 10 20 IECD COC(=O)c1nscc1S(=O)(=O)Nc1nc(-c2ccc(CNC(C)=O)o2)cs1 755737308 QFMAFGMODVYYST-UHFFFAOYSA-N 442.500 2.083 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cc1 768036222 IPFBOABNIPKMLB-UHFFFAOYSA-N 434.500 2.012 10 20 IECD COc1ccc(N2CCCN(C(=O)c3nccc4c(S(N)(=O)=O)cccc34)CC2)cc1 768477239 HKUAPFKPWDXUHD-UHFFFAOYSA-N 440.525 2.243 10 20 IECD COc1ccc(CCN2C[C@@H](C(=O)NCc3cccc(OC)c3O)CC2=O)cc1OC 769503971 RGWWMHBHYPJHKD-KRWDZBQOSA-N 428.485 2.125 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1F 775055888 GDIGUDJXIHGCMH-UHFFFAOYSA-N 435.477 2.115 10 20 IECD COc1cc(OC)cc(-n2nnnc2CN(C)Cc2ccc(N3CCN(C)CC3)cc2)c1 775736642 VYAYABVZTVJHFE-UHFFFAOYSA-N 437.548 2.063 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)N3CCC[C@H](C(=O)O)C3)c2C)cc1 777367281 FNXANPNPCSVHTG-KRWDZBQOSA-N 427.501 2.498 10 20 IECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 783187091 XTDGPWIODFJWBY-UHFFFAOYSA-N 444.456 2.361 10 20 IECD Nc1ccc(N(C(=O)C(=O)Nc2ccn(CCN3CCOCC3)n2)C2CCCCC2)cc1 784058053 KCMNASHMVKPQKQ-UHFFFAOYSA-N 440.548 2.102 10 20 IECD COc1ccc(OC)c(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 786650434 TZJGHGJFALSCNY-UHFFFAOYSA-N 429.542 2.190 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@H]12 788922798 YHCGIIONYKTMGX-LRNAHUNVSA-N 429.536 2.344 10 20 IECD CCN(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822459 AVOAKIIPVZGRLG-IAGOWNOFSA-N 428.508 2.499 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cccc2c1CCO2 796972086 MYTGJINPVPHGIW-UHFFFAOYSA-N 434.540 2.408 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2I)c(O)c1 797390852 VSZSWGRCASCZTF-UHFFFAOYSA-N 426.210 2.260 10 20 IECD O=C(NCCS(=O)(=O)CCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 799887379 VWMFPNQEWMUAKH-UHFFFAOYSA-N 449.548 2.119 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H](CN2CCOCC2)C1 802005671 RSLPJERNUAPEGK-LJQANCHMSA-N 434.556 2.041 10 20 IECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803687080 TWFNYNMCOWLKFY-XLIONFOSSA-N 428.577 2.229 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688142 VXHFDMWAWWCMCE-APWZRJJASA-N 444.576 2.447 10 20 IECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807291775 NHTDLRDOFKULKD-ICSRJNTNSA-N 426.561 2.222 10 20 IECD CC(C)OCc1cc(NS(=O)(=O)c2ccccc2S(=O)(=O)N(C)C)ccc1O 811703813 HBHXSQFINWLTPF-UHFFFAOYSA-N 428.532 2.368 10 20 IECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 915194934 LFOWRTVMGHXTKS-QGZVFWFLSA-N 448.317 2.360 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 917930946 ZZVIVMWFUQILTO-GOSISDBHSA-N 445.541 2.044 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc2c1O[C@@H](C)C2 918340541 RQWAMPSYGJAKTG-HNNXBMFYSA-N 430.526 2.183 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CN3CCCCCC3=O)cc2F)C[C@@H](C)O1 918813916 DHXWTTHHNLASFF-CALCHBBNSA-N 449.523 2.001 10 20 IECD Cc1cc(C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c(C)n1-c1cccc(Cl)c1 919984850 RWAKBGNQVSPOSI-UHFFFAOYSA-N 428.920 2.311 10 20 IECD C[C@H](NC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1Cl 920637366 GIZHCOUQTLXGJI-NSHDSACASA-N 426.878 2.451 10 20 IECD C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 920868009 ZXEWPMXHBXXUMX-OALUTQOASA-N 440.544 2.140 10 20 IECD C[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1801507635 GLYGPOBKFPZUSW-BZBAAFQNSA-N 444.528 2.233 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807993519 JORPNVJQEBQKAZ-JPYJTQIMSA-N 447.495 2.154 10 20 IECD COC(OC)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811797904 XHMDCUPCYYTGFT-DYVFJYSZSA-N 449.891 2.085 10 20 IECD CC(C)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n[nH]1 1816727281 LFLMHYBCMFRBAR-LLVKDONJSA-N 442.501 2.335 10 20 IECD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428236 SMLUGGWPRHHIRE-MRXNPFEDSA-N 443.460 2.276 10 20 IECD CC(C)CC(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834415581 ZZSBGOMMZRPVIG-GQCTYLIASA-N 445.560 2.434 10 20 IECD COC(=O)c1ccc(OC[C@@H](O)CN2CCCN(c3ccc(OC)cc3)CC2)c(OC)c1 108106061 GQLXXUICLSTEAU-FQEVSTJZSA-N 444.528 2.442 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC3(N4CCCC4)CCOCC3)cc2F)CC1 730126333 OAUXYGVMHUHUGE-UHFFFAOYSA-N 447.599 2.412 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3cnc4c(C)cccc4c3=O)cc2F)CC1 730192861 NTXNDQNASXEVMV-UHFFFAOYSA-N 437.519 2.302 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(=O)(=O)CCOC)cc1 733662213 UFLLLRPLRNGAAM-UHFFFAOYSA-N 447.557 2.160 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1 742928375 PILNNFFKBFACNV-UHFFFAOYSA-N 425.533 2.341 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1N1CCOC1=O 743955876 MGNNLKMLFPZDCE-UHFFFAOYSA-N 439.468 2.491 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2cccc(OC)c2O)s1 745407733 PZEYGAYQCCRMNA-UHFFFAOYSA-N 427.548 2.492 10 20 IECD CNS(=O)(=O)C[C@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 749850131 JRBJJFLKSFPZLM-GOSISDBHSA-N 447.557 2.062 10 20 IECD O=S(=O)(c1ccc2nc(O)nc(O)c2c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 751120325 GKJJESNHPDRBIY-AWEZNQCLSA-N 431.470 2.117 10 20 IECD CCOC(=O)NCCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 751897730 KLFIJTSOQHSUBY-UHFFFAOYSA-N 438.436 2.470 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 755294238 BVKHBIVXPHLMQX-DOTOQJQBSA-N 433.553 2.101 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cccnc3-n3cncn3)CC2)cc(OC)c1OC 759962514 LYZLWNNBUBQNOC-UHFFFAOYSA-N 439.476 2.042 10 20 IECD CNS(=O)(=O)c1ccc(CNC(=O)NCc2cccc(Br)c2O)s1 765449418 XGELBSDPAHNDDX-UHFFFAOYSA-N 434.337 2.124 10 20 IECD Cc1ccc(S(N)(=O)=O)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 767321036 MPZHUPDXUCNJRR-UHFFFAOYSA-N 428.558 2.427 10 20 IECD COc1ccc(-c2noc(CN3CCN(Cc4cc5c(cc4O)OC[C@@H]5O)CC3)n2)cc1 768441877 PTUDYLNQUWCXKI-FQEVSTJZSA-N 438.484 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(C)CCO[C@H]3C3CC3)CC2)cc1 768656385 QZHFKWZCZRDNSG-AUDJJSHHSA-N 427.545 2.221 10 20 IECD O=C(CNS(=O)(=O)c1cccs1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915148 JXQRWRVGRRMTBN-OAHLLOKOSA-N 443.978 2.166 10 20 IECD COc1ccc(O)c(CNC(=O)c2ccnc(C(=O)NCc3cc(OC)ccc3O)c2)c1 769530630 ISZGJOWCFHFJFL-UHFFFAOYSA-N 437.452 2.370 10 20 IECD Cc1ccc(C(=O)Nc2ccc(CC(=O)N3CCN(c4ncccn4)CC3)cc2)c(O)c1O 770469815 UPZLUGKOGGUJET-UHFFFAOYSA-N 447.495 2.340 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 772996196 CETHYTINJQKBRN-RDTXWAMCSA-N 433.578 2.371 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1)c1ccc(N(C)C)cc1 773847911 UQCAWQLLCBKZMY-CQSZACIVSA-N 448.520 2.248 10 20 IECD CN(C)CCc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 782904789 IGYPVBOIXQLWNS-UHFFFAOYSA-N 430.574 2.347 10 20 IECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 784643577 LVPDIRJSYSDVQZ-UHFFFAOYSA-N 426.429 2.063 10 20 IECD COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NCc1ccccc1O 784698908 PAAXMQHTXJAMIC-UHFFFAOYSA-N 425.210 2.335 10 20 IECD C[C@@H]1CN(Cc2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 785428855 TZLNIMZTSRFPKT-RTBURBONSA-N 438.572 2.294 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)cccc3[N+](=O)[O-])cc2)CC1 786121191 DETRHQIHKFELPJ-UHFFFAOYSA-N 432.502 2.050 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCN(c2ccccc2F)C1 788321382 VOXKDVLXFJMDJW-IBGZPJMESA-N 440.519 2.064 10 20 IECD COc1cc(Cl)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1C(=O)O 790386438 YFSDONMCQVPQKZ-UHFFFAOYSA-N 434.879 2.219 10 20 IECD O=C(CN1CCC(Oc2ccc(F)nc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 792387856 HSEVWFVBAPIVDX-UHFFFAOYSA-N 446.498 2.356 10 20 IECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCOCC2)cc1 793744820 WNTHLFORXDLKDU-JOCHJYFZSA-N 442.535 2.006 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)c1cc(C)n(-c2ccccc2C)c1C 798311222 JXPNDSHEXRIFFH-SFHVURJKSA-N 431.558 2.168 10 20 IECD O=C(NCC1(OCCO)CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 800704415 DPRQMNAREDNJPN-UHFFFAOYSA-N 443.491 2.114 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3[nH]cnc3C(=O)c3ccccc3)cc2)C1 806538940 ANPGFDNQAZYCTF-GOSISDBHSA-N 431.496 2.272 10 20 IECD CN(C)S(=O)(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 806543948 ODHBFHDVYAFPTA-UHFFFAOYSA-N 436.509 2.234 10 20 IECD CON(CC1CCOCC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770089 YANRGMGNBIEKAO-MRXNPFEDSA-N 441.475 2.190 10 20 IECD C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)S1(=O)=O 813085430 FZYQMANYBLBVNS-KFWWJZLASA-N 431.505 2.474 10 20 IECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCC(F)(F)F 918213886 LLBSJLKRYKYCEN-UHFFFAOYSA-N 442.360 2.020 10 20 IECD Cc1ncoc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121299 NMVUKOOOTZFBKJ-IIBYNOLFSA-N 449.891 2.489 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccno1)C2)c1cc(O)c(O)c(Cl)c1 1781121477 YAFGJQFFDFMLPM-OXQOHEQNSA-N 435.864 2.181 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)CC3(O)CCC3)CCC2)cc1 1792315767 AODIQFUQERYRFN-UHFFFAOYSA-N 447.582 2.286 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1S 1792582986 VYOHWNYRAIOPLI-RRJKNOHSSA-N 441.509 2.452 10 20 IECD CC(C)n1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1818293402 XMGZRFLOGDGNHQ-AWEZNQCLSA-N 440.464 2.008 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ncccc1F 1819973966 QBQPFUIIAXWLIM-AWEZNQCLSA-N 426.408 2.370 10 20 IECD Cc1cnn([C@H](C)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1822744557 PIYSZRDTLDOTMP-CJNGLKHVSA-N 439.476 2.288 10 20 IECD O=C1C[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1830740039 GKPSFERPYHFRRQ-WBVHZDCISA-N 449.935 2.121 10 20 IECD COc1cc(Cl)ccc1CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250816 QYWMLCXMTXKIPS-UHFFFAOYSA-N 431.876 2.215 10 20 IECD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1844322637 DJLRHADBTYMRBQ-MDWZMJQESA-N 433.555 2.055 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)N[C@H](C)c3ccc4c(c3)OCO4)nnc2n1 68735416 AYZNLYAKLSCXMD-LLVKDONJSA-N 444.521 2.081 10 20 IECD COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1-n1nnnc1C 726722628 HZNFMVNCOSVPKT-UHFFFAOYSA-N 449.515 2.175 10 20 IECD CNC(=O)C1(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCC1 730047069 YIZUGIOVMKFZNU-ZDUSSCGKSA-N 434.448 2.249 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4cc(F)ccc4F)=NO3)cc2)C1 732637423 VEYGLGRFNPOURP-BTYIYWSLSA-N 442.466 2.476 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(CN4C(=O)CCC4=O)cc3)c2)CC1 739767887 HQIPGBVDEQFKNW-UHFFFAOYSA-N 434.496 2.290 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4ccn(C)c4c3)CC2)cc1 743899898 ZBQWDOFRPLBJML-UHFFFAOYSA-N 435.528 2.064 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCC[C@@H](CCO)C1 745735927 CMHZKRLTVUBLIV-SFHVURJKSA-N 442.539 2.246 10 20 IECD C[C@@H]1CN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C[C@H]1C 752301249 PSHJYMVMAYZWQC-JAEYLYOOSA-N 447.582 2.321 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(CCNC(C)=O)s3)CC2)cc1F 754044441 AEEACMORSHPSMO-UHFFFAOYSA-N 441.550 2.085 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(OC)c(OC)cc3C)CC2)cc1F 754213380 RQTZACIIYQKDBU-UHFFFAOYSA-N 431.464 2.447 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 756483777 QEQSRZJWFXNWQY-MAUKXSAKSA-N 448.541 2.487 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)N[C@@](C)(C4CCCCC4)C3=O)CC2)cc1 758198265 NFRDZWFGFUYPLB-RDPSFJRHSA-N 444.576 2.069 10 20 IECD CC1(C)NC(=O)N(CCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1=O 768916454 QXBNQMHCPAVZFR-INIZCTEOSA-N 436.940 2.237 10 20 IECD CC(=O)N1CCc2c(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cccc21 769261188 NWSBTKYJYCFBQH-UHFFFAOYSA-N 436.512 2.029 10 20 IECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 769398146 YQFQUQMNZOFKMO-UHFFFAOYSA-N 439.509 2.262 10 20 IECD C/C=C/C[C@@H](CO)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 771621299 PSGLCWRGWQOLIT-HSWBROFVSA-N 435.458 2.158 10 20 IECD COc1ccccc1CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 775050856 FUHWQYBGINWZJP-CALCHBBNSA-N 443.519 2.423 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnc(OC(C)C)c3)cc2F)CC1 778607119 QTPAYNSKKJLSIO-UHFFFAOYSA-N 443.523 2.405 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 779478105 FMGMIZIQCIITMJ-IQBZNYMQSA-N 426.469 2.101 10 20 IECD O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)OCC(=O)c1ccc(O)c(O)c1 783559844 GTTYJYSVHOACKC-CQSZACIVSA-N 432.816 2.382 10 20 IECD CN(C)C(=O)Cn1nc2n(c1=O)CCN(Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)C2 786578101 HJAZROZUZPPEAI-UHFFFAOYSA-N 443.592 2.449 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 787988569 BYWGMFYIUWAYIW-UHFFFAOYSA-N 441.528 2.122 10 20 IECD O=[N+]([O-])c1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1N1CCCCC1 789558284 VMONXTNLMKFJLI-UHFFFAOYSA-N 436.578 2.280 10 20 IECD COCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C)o1 789842490 DFRVGTGZACKCFG-LJQANCHMSA-N 447.507 2.198 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 792233190 PYTINHYAADKLKP-UHFFFAOYSA-N 442.523 2.446 10 20 IECD COc1ccc(OCCCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 793860550 BBBBVYTZNCGSHC-UHFFFAOYSA-N 441.528 2.374 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c(O)c1 797389162 SIJVDWPJHSZEJA-UHFFFAOYSA-N 436.468 2.041 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCCC34CCOCC4)CC2)cc1 800607804 ZIKHIMMOVDDHMA-HEDKFQSOSA-N 427.545 2.366 10 20 IECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)CC2 803300749 KLOKOFJERHNAEH-FXAWDEMLSA-N 439.560 2.152 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@@]2(CCOC2)O1 803677155 HDURNLIRJBWYBT-MHECFPHRSA-N 429.561 2.478 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 805202374 OOSRDDILJGNBSV-SFHVURJKSA-N 428.920 2.252 10 20 IECD CC(C)C[C@H](CO)N(C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769510 GPGPBMGLKJYRCD-NVXWUHKLSA-N 427.492 2.238 10 20 IECD CNC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 807951819 AZZKYXJCHBPCQZ-QRQCRPRQSA-N 434.968 2.177 10 20 IECD O=C(CCn1cc([N+](=O)[O-])cn1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 919846322 MAWILLRLLHVQDC-UHFFFAOYSA-N 427.383 2.353 10 20 IECD CNS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ccc(OC)cc2O)c1 1321550219 JDVXOVBNUHKRHD-UHFFFAOYSA-N 429.292 2.001 10 20 IECD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1)c1cccs1 1777850949 MLFVEMFPCLSYJY-WTBBCNCBSA-N 445.541 2.486 10 20 IECD CCC1(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)CCC1 1778328822 IYOBDACCTQVQTM-DEOSSOPVSA-N 438.528 2.190 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccsc1)CCO2 1785508779 LXTHAOZNMOZURI-XAFBZQIESA-N 430.482 2.022 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H](O)CN2)cc1 1799921763 WNYVAIRZIKHARX-UVVBHOOISA-N 436.556 2.069 10 20 IECD Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1805241912 QHZIBHGMJDMGBE-KBXCAEBGSA-N 439.497 2.286 10 20 IECD Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)nc1 1816722224 FKHZAVBUXJMKKA-GFCCVEGCSA-N 425.470 2.192 10 20 IECD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cs1 1816722711 VFFSGDFANQZZTJ-SNVBAGLBSA-N 431.499 2.254 10 20 IECD C[C@@](O)(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(F)(F)F 1824832010 JTICGBWUJQISCY-IFXJQAMLSA-N 445.438 2.039 10 20 IECD CNCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877448 LUXLYWLNIMACKV-LHUXKHBRSA-N 445.560 2.436 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(C3CC3)on2)=NN1c1ccccc1 1847388912 ZNZRUIKXACVMBF-OALUTQOASA-N 433.468 2.160 10 20 IECD COCCn1c(SCC(=O)NCc2ccc(N(C)C)cc2)nnc1-c1ccncc1 18270423 SPUNXOIKLXIKFI-UHFFFAOYSA-N 426.546 2.461 10 20 IECD CCS(=O)(=O)c1ccc(CNC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)cc1 553883732 VTRSIAWBZNJBRG-UHFFFAOYSA-N 432.523 2.115 10 20 IECD CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 730121193 JTRIAGBJBDXGRU-MSOLQXFVSA-N 445.564 2.197 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C[C@H](NC(N)=O)c3ccccc3)cc2F)CC1 730235634 JMEZVWZVBWYJLF-FQEVSTJZSA-N 427.524 2.384 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cc3cccc(NS(C)(=O)=O)c3)cc2F)CC1 730236009 SOGOKSCJAJIVQJ-UHFFFAOYSA-N 448.564 2.198 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)cc1 732202505 TXJJWQYSNPVIBZ-LJQANCHMSA-N 432.542 2.093 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)nc12 733519908 FBTTVBSWFPUHGS-AWEZNQCLSA-N 434.449 2.054 10 20 IECD COc1cc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1O 734216998 QQAVCNLSPNIGJU-GOSISDBHSA-N 426.517 2.144 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)cc1 737079551 PWPXECOPLUIAHC-UHFFFAOYSA-N 444.557 2.182 10 20 IECD O=C(COCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCc1cccnc1 742804789 BMPIFIOIWKBRAB-QGZVFWFLSA-N 448.470 2.101 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCCN1C(=O)COc2ccccc21 743640331 JYUFVXGFGZVGNN-UHFFFAOYSA-N 438.528 2.480 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(OC)c(-n3cnnn3)c2)cc1 743890546 MLUVEHWPPLMVSP-UHFFFAOYSA-N 437.504 2.114 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H](c1cccc(F)c1)N1CCOCC1 745423917 LKPVXQWNLZGYPP-QHCPKHFHSA-N 443.519 2.467 10 20 IECD CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 746036849 BAQTXEBDRNPRKI-UHFFFAOYSA-N 437.544 2.382 10 20 IECD CN(C)c1ccnc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 749737066 PEHGPAKEYWTFMM-UHFFFAOYSA-N 435.507 2.333 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@@H]4CCOC4)CC3)cc2)C1 753121456 NOOWLFMDHTVEAP-UXHICEINSA-N 444.576 2.115 10 20 IECD COc1ccc(N2CCN(Cn3nc(C4CC4)n(CCC(N)=O)c3=S)CC2)cc1F 754011654 HTSHZAVHBBVKOZ-UHFFFAOYSA-N 434.541 2.094 10 20 IECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 756890652 ZYWBQQHNOPUXAJ-MRSFGVLCSA-N 442.560 2.228 10 20 IECD COc1cc2ncn(CCCC(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c(=O)c2cc1OC 763279274 KFYJJLBETNQBNZ-AWEZNQCLSA-N 441.484 2.353 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)cc1 766046764 CNBJSLDCXSQXGW-UHFFFAOYSA-N 426.516 2.426 10 20 IECD O=C1NCCc2ccc(S(=O)(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)cc21 768011794 GCJQQJOULDWWLF-UHFFFAOYSA-N 440.569 2.305 10 20 IECD CCCc1ccc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768442975 UULASFMZTNDJJJ-NRFANRHFSA-N 432.542 2.277 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 769641005 CLJPGCAFVIXVNW-UHFFFAOYSA-N 441.456 2.417 10 20 IECD OCCN(CCN1CCOCC1)Cc1cc(Br)cc(Br)c1O 775658372 NRHDZSNUMSJQTB-UHFFFAOYSA-N 438.160 2.044 10 20 IECD Cc1cc(C(=O)COC(=O)Cn2ncn(C)c2=O)c(C)n1-c1ccc(Br)cc1 781264197 RZMJGBMYUMIXID-UHFFFAOYSA-N 447.289 2.178 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 787703294 AQAGEVBXIUPLOT-SVFBPWRDSA-N 431.577 2.384 10 20 IECD O=C(NC[C@H](CO)Cc1cccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788181651 WOSJRENEHXFDJX-OAHLLOKOSA-N 447.538 2.231 10 20 IECD COCCN(Cc1cccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800196 NHQNNOQNURECOI-UHFFFAOYSA-N 435.521 2.015 10 20 IECD CCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccn1 793725746 RWKQJCLCDVXLEH-GHTZIAJQSA-N 437.544 2.057 10 20 IECD Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 800597825 URLHGSOYXFHGQY-UHFFFAOYSA-N 430.436 2.476 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H]1Oc1ccccc1 803687338 CAOAEJYNLXTWKK-MDNUFGMLSA-N 437.540 2.426 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@H]3c3nc(C)no3)CC2)cc1 804857689 HXGMRTRUHJQRTQ-PISNEZEASA-N 439.516 2.345 10 20 IECD COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc(OC)c1OCC(N)=O 914439714 OIMXGOYVRJHVMZ-UHFFFAOYSA-N 427.501 2.439 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(NC(C)=O)ccc3OC)CC2)cc1 918461472 DQSQPDNCVPXAKZ-UHFFFAOYSA-N 440.500 2.340 10 20 IECD CCCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194795 HINFYTZCCPYRMG-UHFFFAOYSA-N 425.485 2.345 10 20 IECD CN1CCN(c2ccccc2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 1318781948 MYQOEXYSMCYLJR-FQEVSTJZSA-N 435.572 2.070 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C(=O)OCC(C)C)CC1 1320436018 FHJHKAZKBXBQIF-KRWDZBQOSA-N 436.505 2.193 10 20 IECD CCOC(=O)C[C@H]1CCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1320785783 BQCFBKUFEJEORB-HXUWFJFHSA-N 432.565 2.335 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1=CCCS1 1803634921 USZGTNDBTIXQOQ-KUHUBIRLSA-N 426.498 2.228 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993347 IGBJNZBFHSDRBS-JTSKRJEESA-N 440.500 2.024 10 20 IECD CC(C)n1nccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547228 SZQHYBYYCNGEIN-UHFFFAOYSA-N 427.505 2.429 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(F)nc1 1810692072 BOAXKRLMPROLMU-XOBRGWDASA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnnc(Cl)c2)[nH]n1)c1cc(O)nc(O)c1 1817843951 JYWOXCSHAHSVMI-CYBMUJFWSA-N 443.851 2.279 10 20 IECD O=C1CSC(=S)N1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1 1823082031 BXPLEQBWESAYIL-GFCCVEGCSA-N 439.538 2.154 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987034 BJYKTVYEQCVTPA-DNVCBOLYSA-N 430.549 2.114 10 20 IECD CC(C)=CCCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987364 LWYJMZXOHSQRKR-UHFFFAOYSA-N 430.549 2.424 10 20 IECD Cc1cc(C)c(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c(C)c1 1846793219 DERRIDKCQNGIBM-UHFFFAOYSA-N 431.583 2.289 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1F 303394095 YRXGIHHEOBWSRB-UHFFFAOYSA-N 440.527 2.380 10 20 IECD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2=O 731856870 UTZWRHPXKVINAH-WLENULPWSA-N 429.517 2.401 10 20 IECD CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 742805071 FXTMALQCLHPEIV-HOTGVXAUSA-N 445.532 2.435 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743719171 RXDTYYUUHANRPO-UHFFFAOYSA-N 445.541 2.166 10 20 IECD O=C(COC(=O)[C@H]1CCc2c[nH]nc2C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 745630407 YAWOIZFRWMOKAL-ZDUSSCGKSA-N 429.432 2.472 10 20 IECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 754423455 VYYGJYJZEVSAEY-GOSISDBHSA-N 434.562 2.002 10 20 IECD COC(=O)c1ccc(OC)cc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758223808 NILRFVDAUKTONY-GOSISDBHSA-N 430.501 2.052 10 20 IECD C[C@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1 764444892 XDGCHZRZHZXMJO-GJZGRUSLSA-N 431.505 2.333 10 20 IECD O=C(NCc1cccc(Br)c1O)NC[C@@]1(N2CCOCC2)CCSC1 764764328 OOQHIXAINUMEJG-KRWDZBQOSA-N 430.368 2.162 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cc(CNC(C)=O)ccc3OC)c2)CC1 769847421 HOXHLAHLCIYGNH-UHFFFAOYSA-N 446.573 2.274 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)c2)CC1 770149075 WDGARFUFGUBEGD-UHFFFAOYSA-N 432.502 2.393 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 774920526 SBHWOFXTONAAOV-ZBFHGGJFSA-N 444.482 2.160 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4cccc(F)c4)cc3O)cc2)C1 785920889 NOCUNRZGSIESFK-MRXNPFEDSA-N 437.475 2.349 10 20 IECD CCCN(CCCN(C)C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789835024 MXTXXJSLPNVQEV-QZTJIDSGSA-N 436.572 2.246 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](OCC4CC4)C3)cc2F)C[C@@H](C)O1 789837551 ZMKVXEQJKGXIEM-FUHIMQAGSA-N 447.551 2.473 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1cccs1 793733016 KFZTXLZSPIWLIO-SJLPKXTDSA-N 442.585 2.061 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)ccc21 803687908 QXMKOOACQVDWHP-SFHVURJKSA-N 444.576 2.449 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C)CC2)cc1 804316648 HGWDWJYAFJMFLM-UHFFFAOYSA-N 448.564 2.153 10 20 IECD COc1cccc2c1OC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2 804674818 MKKNJCCPUCJMNO-OALUTQOASA-N 440.496 2.028 10 20 IECD CC(C)(O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 806727456 HHVVHPFIKACJKO-HXUWFJFHSA-N 426.513 2.444 10 20 IECD Cc1nc(Cn2nnc(NC(=O)C(=O)N(c3ccc(N)cc3)C3CCCCC3)c2C)no1 815594569 SWAAHIXTRIZCMI-UHFFFAOYSA-N 438.492 2.213 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCNc3ccccc3[N+](=O)[O-])CC2)cc1 842052138 PRZGMZNJAXQUHJ-UHFFFAOYSA-N 442.472 2.297 10 20 IECD CS(=O)(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918205849 UNTRIXKTLRVQCH-UHFFFAOYSA-N 436.509 2.033 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 920927600 ZGBMMPHSCZBVBD-AWEZNQCLSA-N 428.464 2.437 10 20 IECD Cc1n[nH]c(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934854 VOIPCMMHQXZAQE-VBUUOAMHSA-N 434.500 2.071 10 20 IECD CCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799619985 FDHNXJVBSVLVFI-JHDGKUDLSA-N 425.529 2.334 10 20 IECD CC[C@H](C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806081352 CHWJZGVBINYBJN-AKTGSIICSA-N 446.544 2.455 10 20 IECD C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CC1(F)F 1808000409 IMDNCEHPXROKQX-QKMWGZLOSA-N 432.427 2.253 10 20 IECD O=C(CCc1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721254 IGPHKYSUZKOMCD-GFCCVEGCSA-N 428.470 2.401 10 20 IECD COCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817043847 VIOSKIAHDOCTTF-PMGBHYCQSA-N 430.461 2.269 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3ccccc23)[nH]n1)c1cc(O)nc(O)c1 1817845131 ASZHLBPPKHGNJW-QGZVFWFLSA-N 447.455 2.483 10 20 IECD CCc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)co1 1817846390 VIEXSXDFDDEHQL-AWEZNQCLSA-N 426.433 2.386 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccnn3c2)[nH]n1)c1cc(O)nc(O)c1 1817847150 MNIOOGJYOQKPJY-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)CC1 1823772084 WMOSJPSSJVQMND-JXFKEZNVSA-N 429.473 2.053 10 20 IECD Cc1nn(C)c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423757 FWWNYTRBAKOLFF-SFHVURJKSA-N 441.532 2.390 10 20 IECD CCC(=O)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1838687998 XLAFOFAXAWVUJK-UHFFFAOYSA-N 438.908 2.343 10 20 IECD Cc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1845387894 FEGHTPPTBIHQKW-UHFFFAOYSA-N 437.974 2.326 10 20 IECD Cc1nnc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)s1 1845500737 IUPNIYOPQRFBGQ-UHFFFAOYSA-N 436.921 2.361 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)CC2)cc1 110356805 HZNJJBHPXYMLQH-VWLOTQADSA-N 448.523 2.174 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cccc(Cl)c3F)cc2)CC1 726976784 PCQKLXKRIHFUDL-UHFFFAOYSA-N 432.926 2.192 10 20 IECD CN1CCN(S(=O)(=O)c2ccc(NNC(=S)Nc3ccc4c(c3)CCC4)cc2)CC1 727978453 LPSQTYMLJBWDIU-UHFFFAOYSA-N 445.614 2.425 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1 728979116 YFJLQBZRZAIUCC-IUODEOHRSA-N 436.534 2.019 10 20 IECD CN(C)c1ccc(CNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1F 742230258 NUSUTVYMPDRZFQ-UHFFFAOYSA-N 436.440 2.318 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1 743906615 ORPCWIQGTGWTTP-JTQLQIEISA-N 426.878 2.274 10 20 IECD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 746862366 PJROHEACGUIFML-RHSMWYFYSA-N 427.567 2.115 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCN(c2ncccn2)CC1 748009643 UWKHOSGSBLREEN-UHFFFAOYSA-N 445.526 2.007 10 20 IECD COC(=O)C[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CCO1 752336155 IUMBBWICRLTFKB-LJQANCHMSA-N 428.485 2.327 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753737244 DCUXTJVZTLCDFE-UHFFFAOYSA-N 435.521 2.024 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)CC2)cc1F 754211585 GYSNUPARIJKTNN-UHFFFAOYSA-N 427.885 2.098 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 758354356 FYNHXAZFXPPREF-UHFFFAOYSA-N 426.441 2.271 10 20 IECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)c1 759592830 AKZOCXFMZKIPGC-LRAPTIAOSA-N 443.408 2.255 10 20 IECD COc1c(F)cc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 761042814 NAVXFYHKNIWKQV-UHFFFAOYSA-N 437.418 2.329 10 20 IECD Cn1c(=O)oc2cc(S(=O)(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)ccc21 768011556 BYKVXBSOSPFPES-UHFFFAOYSA-N 442.541 2.464 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 768040437 OHPGLOINNSQZMD-HZPDHXFCSA-N 429.558 2.404 10 20 IECD COc1cc(Br)cc(CN2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c1O 769542334 GLHUFSPXTCAIRY-AWEZNQCLSA-N 426.355 2.292 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccco3)N3CCCC3)CC2)cc1 774865085 GMDMALFUAPGWQO-NRFANRHFSA-N 440.544 2.280 10 20 IECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)O)ccc1Br 775286996 UGTNCOZLWBKUHE-UHFFFAOYSA-N 430.232 2.440 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1F 776088041 AGEFNTKLOHTHSX-UHFFFAOYSA-N 445.523 2.245 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4c3cccc4[N+](=O)[O-])CC2)cc1 778288337 XYVUUVAXNZTFAU-MDZDMXLPSA-N 436.468 2.398 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C)CC34CCCCC4)CC2)cc1 778294059 IVWRVPQRPGZKGX-KHPPLWFESA-N 440.588 2.377 10 20 IECD Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 781365369 HBWCONNLYLTUOG-FQEVSTJZSA-N 431.512 2.410 10 20 IECD O=C(Cn1cc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)cn1)NC1CC1 782895657 BZNZHPAWUHNOPJ-UHFFFAOYSA-N 439.516 2.167 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1 785294811 NRMNKMVGSNWMIG-JTQLQIEISA-N 442.440 2.125 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2F)C[C@@H](C)O1 785439020 KBTUPLFNYVHZOF-CALCHBBNSA-N 442.535 2.438 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cc(C)cnc3Cl)CC2)cc1 787870927 CJOXMXFRUDZZRM-UHFFFAOYSA-N 445.951 2.319 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(C(F)(F)F)cs1 788318803 HQBYGOYWTPRCNP-GFCCVEGCSA-N 442.463 2.492 10 20 IECD COC(=O)c1cncc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 788631512 RPOWYSDHTPUQIP-INIZCTEOSA-N 439.921 2.170 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 788951075 HHORGVGNFGNIFH-UHFFFAOYSA-N 442.535 2.441 10 20 IECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)sc1C 789826689 QIVKZFWHPPKGDX-KBPBESRZSA-N 448.564 2.488 10 20 IECD CN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1)C(=O)OC(C)(C)C 803685739 JKTPGOSSYNJGGU-GOSISDBHSA-N 444.576 2.401 10 20 IECD O=C(NCc1cccc(-n2cncn2)c1)C(=O)N(Cc1ccco1)Cc1ccccc1O 805749322 WRPNDNZTCZTKJT-UHFFFAOYSA-N 431.452 2.411 10 20 IECD CCCNC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c3nonc23)c2ccccc2O1 814377649 ALRORFLVPDDJSN-AWEZNQCLSA-N 436.877 2.359 10 20 IECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917912692 RJNBNXMFDRLWIK-UHFFFAOYSA-N 433.599 2.397 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 917998278 HTDPLUVPKMNTIW-ZIAGYGMSSA-N 436.509 2.408 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 918442206 GVZTXESJCXCEEG-UHFFFAOYSA-N 447.438 2.472 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](NC(=O)c1cccs1)C(C)C 1325382544 TYAIPNKJGPIBRF-KBXCAEBGSA-N 434.514 2.204 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1)C2)c1cc(O)c(O)c(Cl)c1 1799770763 DQYRNHQUKXTHFH-CWPLJXCYSA-N 430.888 2.197 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)C1CC(O)C1 1803052252 NXTOBCJNPTZZFS-SFDJYXNVSA-N 445.903 2.237 10 20 IECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc(C)c1O 1803580622 XRGSFSDCWFVYKX-MUJYYYPQSA-N 447.582 2.121 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccncc3F)sc2C1)c1cc(O)nc(O)c1 1817864230 POMGSEARIVWSSF-SNVBAGLBSA-N 429.433 2.023 10 20 IECD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827427971 FQWNJQZRBIEPGB-SFHVURJKSA-N 427.505 2.000 10 20 IECD C[C@@H]1CCc2c(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)n[nH]c21 1847038021 YQGFGJLVTUIBBW-OQHXTRMZSA-N 438.484 2.107 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 725945172 FYERFRPRWZDTNO-UHFFFAOYSA-N 429.429 2.118 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCCCN3CCN(C)CC3)cc2F)C[C@@H](C)O1 728949959 XBAQPALRKWGATJ-RTBURBONSA-N 435.588 2.266 10 20 IECD COCCN(CCC(=O)OC)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 733222277 CEFSSDKOYLLAAW-UHFFFAOYSA-N 440.408 2.022 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(NCc3ccc(N4CCOCC4)cc3)CC2)cc1 742724819 BYFLEFOEICJHPS-UHFFFAOYSA-N 445.585 2.475 10 20 IECD Cc1nn(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1C 746354938 ODNODVAPGPQIBV-UHFFFAOYSA-N 439.438 2.147 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CCCC4)cc3)cn2)C[C@H](C)O1 747570219 HQQUOKDDCRMOTN-ROUUACIJSA-N 440.548 2.441 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)C1 750875973 XDIMIRNFSHWQGB-CTNGQTDRSA-N 437.606 2.322 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC)c(NC(C)=O)c3)CC2)cc1F 754213926 JEBCXOVCSNOHAR-UHFFFAOYSA-N 444.463 2.089 10 20 IECD CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758576812 MCMODGKUVFZNLL-GOSISDBHSA-N 443.569 2.284 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CCCCN3C(=O)C(C)C)CC2)cc(OC)c1OC 759226583 ZXRDWGWTWBQLFO-GOSISDBHSA-N 433.549 2.398 10 20 IECD COc1cc(N2CCN(C(=O)Cc3ccc4c(c3)OCCO4)CC2)cc(OC)c1OC 759238645 ODBYGHGXMYDMJI-UHFFFAOYSA-N 428.485 2.375 10 20 IECD C[C@H]1Cc2cc(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)ccc2N1S(C)(=O)=O 759591224 GEADIDLJBJBPGJ-UKOWJOKBSA-N 431.466 2.248 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 762416127 OFHJIDTXCUEQIB-UHFFFAOYSA-N 429.448 2.046 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC4(CCOCC4)CC3)CC2)cc1 769496992 TXYJOPCCAOUMMJ-UHFFFAOYSA-N 446.592 2.188 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1cccc(S(=O)(=O)N2CCCC2)c1 772776769 RWUFNOOWYSDVMF-VQHVLOKHSA-N 446.481 2.077 10 20 IECD CCN(C)C(=O)c1cccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772898530 MXYGTVCYYQAXMS-UHFFFAOYSA-N 429.492 2.449 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2F)C[C@H](C)O1 774499566 ZVGBIQRWNKYGJK-HOTGVXAUSA-N 448.583 2.481 10 20 IECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c2cccnc12 776503292 AASZUCJTEWJVMG-UHFFFAOYSA-N 435.483 2.414 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H]1CCO 779285574 RXULQNVNWCDCMH-CQSZACIVSA-N 435.458 2.088 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 785305067 UUXWUOIDZDZPJA-CQSZACIVSA-N 437.496 2.473 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1F 786379868 VGIKHAFJUSOFDW-UHFFFAOYSA-N 426.492 2.060 10 20 IECD O=C(NCc1cccnc1-n1ccnc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 787447669 HHBOTSWJJZTNNP-UHFFFAOYSA-N 431.452 2.411 10 20 IECD C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788324651 XNTCNCKILIGZDL-DENIHFKCSA-N 436.556 2.091 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1 788571095 JHGDYQMAGDJQRH-SOLBZPMBSA-N 436.503 2.116 10 20 IECD CN(C)C[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789862477 TYQRSFNAIWCBIJ-NRFANRHFSA-N 440.613 2.145 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1nnc2ccccc2c1=O 791251048 XJACZHWXLVFFQQ-UHFFFAOYSA-N 437.500 2.180 10 20 IECD Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793754658 DPIXNHOQIQJVJR-DZGCQCFKSA-N 435.475 2.292 10 20 IECD O=C1C[C@H](NCc2ccc3c(c2)CCN3Cc2ccccc2)CN1CCN1CCOCC1 796308464 CHZVUJLJBBFZKT-DEOSSOPVSA-N 434.584 2.272 10 20 IECD CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 803133877 DEMHYHDIWWLJLK-LJQANCHMSA-N 442.560 2.442 10 20 IECD C[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 803306471 RASQQIIDNVPWTQ-IRXDYDNUSA-N 429.492 2.423 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C 803949562 MZOAAZOXYAWNEG-LJQANCHMSA-N 449.548 2.280 10 20 IECD C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 806443880 VNNSAKBLHGECHF-JKSUJKDBSA-N 444.498 2.139 10 20 IECD C[C@@H](NC(=O)C(=O)N1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1)c1ccc(N(C)C)cc1 807678091 FMZKJTFSRSCXSG-NXHRZFHOSA-N 430.549 2.255 10 20 IECD O=C(N[C@@H]1CCN(c2ncccc2F)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807912333 IHKHAJWQPWMSNR-QGZVFWFLSA-N 438.459 2.443 10 20 IECD Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)cc1 808546305 HTXAFKPOBARCBJ-QHCPKHFHSA-N 448.567 2.469 10 20 IECD CS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918221277 UBAUWZDAVYSLMD-UHFFFAOYSA-N 436.509 2.480 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 918304170 PTRIMTIGAPWSSM-UHFFFAOYSA-N 446.573 2.380 10 20 IECD COC(=O)CC1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 918741306 GHGXRURNKQHORC-UHFFFAOYSA-N 447.557 2.199 10 20 IECD CCc1nnsc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918903367 OCMZZJZZOOQMKB-CHWSQXEVSA-N 436.509 2.326 10 20 IECD CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194459 DAEKOICQRCJNPM-GHXNOFRVSA-N 437.496 2.354 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Nc2ncc(Cl)cc2Cl)c1 920637287 DOTCBOXJPLFEGC-UHFFFAOYSA-N 434.257 2.261 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3ccc(C(N)=O)cc3)ccc21 1318254015 MSXRIYLALFHMNR-UHFFFAOYSA-N 429.498 2.122 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@@H]1F)C2)c1cc(O)c(O)c(Cl)c1 1781119238 DCVYUSVCOFNNGT-SOKAGXEVSA-N 426.872 2.237 10 20 IECD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)s1 1785509272 YHUSSAGHSKCKJJ-ZMTJCJBESA-N 444.509 2.330 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnn2ncccc12 1800714825 JFWCDOGVHDBCOF-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2[nH]cc3c2CCC3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994263 FHSHGFAACJEEML-KSFYIVLOSA-N 447.495 2.338 10 20 IECD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccccn1 1807999831 WNANBONJIHZWNC-LBUQITIBSA-N 447.495 2.406 10 20 IECD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1822667143 CTYCEUROQMCXED-FPMFFAJLSA-N 441.488 2.206 10 20 IECD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)nc2ccc(Cl)cn12 1843250841 USLZDSPSMCJKII-UHFFFAOYSA-N 441.875 2.233 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2CCNC(=O)C2)C3)cc1 1845399426 XUUCDLDUQZHTMQ-HXUWFJFHSA-N 434.540 2.437 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccccc3OC(F)F)cc2)C1 725826083 YRSUQPFKNSLHPQ-OAHLLOKOSA-N 439.484 2.468 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(-c2ncon2)cc1 727038275 NCKALLMJULHWBB-UHFFFAOYSA-N 435.484 2.200 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 729785382 GUZZCRAQPRYCBM-UHFFFAOYSA-N 437.452 2.278 10 20 IECD Cc1cc(S(N)(=O)=O)cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 735753505 MQLGMLKQVIMOKW-UHFFFAOYSA-N 436.509 2.248 10 20 IECD CN(Cc1ccc(S(C)(=O)=O)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 740906789 JCPGKZCZKHGOQV-UHFFFAOYSA-N 435.521 2.407 10 20 IECD COc1ccc(N2CCN(CCNC(=O)CCc3nc(-c4ccco4)no3)CC2)cc1 742920660 LUIHSAWRKSCPJC-UHFFFAOYSA-N 425.489 2.209 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4ccccc4O)CC3)CC2)cc1 743359755 WHWUVWSSAICSSB-UHFFFAOYSA-N 439.560 2.055 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1c1cccs1 745648636 SKERWDHCKLVSEO-IBGZPJMESA-N 432.521 2.231 10 20 IECD COCCNS(=O)(=O)c1c[nH]c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 746237068 FXCDRWLRGVHJKF-UHFFFAOYSA-N 434.562 2.106 10 20 IECD CN(C)c1ncc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1C 751782881 QSLSIBPHLKDYPZ-UHFFFAOYSA-N 440.470 2.341 10 20 IECD C[C@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)S(C)(=O)=O 754234617 CKQRJLFVCJQEFL-NASPGAHYSA-N 432.614 2.279 10 20 IECD C[C@@H]1Cc2cc(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)ccc2N1S(C)(=O)=O 759591218 GEADIDLJBJBPGJ-FLUIGGAXSA-N 431.466 2.248 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccnc(OCCN(C)C)c3)CC2)cc1 762680292 MDZPDSSMQRGCNB-UHFFFAOYSA-N 427.549 2.453 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(NS(C)(=O)=O)c(F)c3)ccc21 771179064 YXVBNBFKHYIKGM-UHFFFAOYSA-N 427.523 2.058 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 774857518 KEJPQAPKCOFTQM-KRWDZBQOSA-N 438.519 2.362 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(N4CCOC4=O)cc3)c2)CC1 780407082 FIQLTCYDCMJFKV-UHFFFAOYSA-N 444.513 2.113 10 20 IECD COc1ccc(C)cc1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 785525267 UNQZZTYMRTWHLB-GOSISDBHSA-N 425.529 2.376 10 20 IECD CC[C@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccn1 788321102 SMPKHTOWIUFPNJ-KRWDZBQOSA-N 426.517 2.028 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cncc5ccccc45)CC3)nc12 788475082 RAFXWPUQGALUIW-UHFFFAOYSA-N 432.484 2.482 10 20 IECD CCC[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789827731 VEUIDEDQHFDUTR-SEPYTNNBSA-N 435.540 2.209 10 20 IECD COc1cc(Br)cc(CN[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)c1O 796455443 XNSWDLSFXLMAMS-LLVKDONJSA-N 435.262 2.075 10 20 IECD COc1ccc(N2CCN(c3nnc(C(=O)NC(C)C)n3C[C@H]3CCCO3)CC2)cc1F 802692386 GBLPRXQGIVMHIM-QGZVFWFLSA-N 446.527 2.070 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCC1(CN2CCOCC2)CCCCC1 806282689 QJTUZDPDEQHNSX-UHFFFAOYSA-N 440.635 2.140 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cn3cc(Cl)cn3)cc2F)C[C@@H](C)O1 808551619 DNKACVSBXMCSOB-ZIAGYGMSSA-N 438.887 2.149 10 20 IECD C[C@@H](OC(=O)C[C@@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808687890 OQZOSIODBBWLCK-KGLIPLIRSA-N 434.448 2.391 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@@H](C)S1 808855997 NIBMBVVACRKINO-QZTJIDSGSA-N 430.618 2.187 10 20 IECD COc1ccc([C@H](O)C2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 812637648 GZHRBVHCBRKOSE-FQEVSTJZSA-N 434.514 2.358 10 20 IECD CCOC(=O)[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917043421 YEIFXEKKRNKKJH-FVJLSDCUSA-N 435.540 2.473 10 20 IECD CC(=O)N[C@@H](C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 917954754 UGYXFUSOHHWKBG-ZUOKHONESA-N 436.464 2.493 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)OCCCO2 918309655 DBXHUIXQTFQTIS-UHFFFAOYSA-N 425.485 2.282 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2NC1=O 918439204 UWFMLFOWNKWEEY-AWEZNQCLSA-N 440.525 2.214 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OCC(=O)N(C)C)c1 920188229 BKUNMQPAFSBGJK-UHFFFAOYSA-N 438.528 2.317 10 20 IECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 920495827 GCVQZYYWFGFSAE-CYFREDJKSA-N 437.496 2.367 10 20 IECD Cc1ccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)s1 1787295162 PXYOAECQHFZAPJ-CIGKHUDMSA-N 443.525 2.169 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1 1803651598 ANEBDZYVDYDCOH-AEIQOCSMSA-N 426.448 2.100 10 20 IECD C/C=C/C(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1812537950 YFGNISYAFYIFAC-CBBDXRRGSA-N 431.496 2.456 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848384 GXBWZBDAZDXHRF-CQSZACIVSA-N 445.476 2.111 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc[nH]n2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145950 NLLOUNJKKIZHJC-SFHVURJKSA-N 446.471 2.232 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)C2=CCCC2)[nH]n1 1823496220 IGOYFQUKFXEYDD-AWEZNQCLSA-N 433.559 2.372 10 20 IECD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1834988260 WCMKPPWUAOHBEV-UHFFFAOYSA-N 444.557 2.362 10 20 IECD Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)cnc1C 1848296745 ZNYIDGLWOMWHSR-SFTDATJTSA-N 431.496 2.307 10 20 IECD C[C@H]1CCCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)C1 12946967 ZAOYRMCZDKJOSQ-XKYMITNMSA-N 447.582 2.465 10 20 IECD CC[C@H](C)[C@H](NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)OC 26865193 XWPVWHGAHHVIIX-RBZFPXEDSA-N 437.448 2.323 10 20 IECD NC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726600867 KCVNZPRBMLISOI-UHFFFAOYSA-N 425.457 2.334 10 20 IECD CN1CCCc2cc(CNC(=O)NCc3cccnc3N3CCC(C(N)=O)CC3)ccc21 729229684 CSMVPJCPWAFEQY-UHFFFAOYSA-N 436.560 2.165 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)cc1F 731346566 MGCQVRDXJITMSA-UHFFFAOYSA-N 426.492 2.485 10 20 IECD COc1cc(Cl)c(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 731514403 ACVRTTSYAWKAAO-UHFFFAOYSA-N 443.861 2.474 10 20 IECD COCCNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731857048 WPNGKZUXVPCGPJ-IBGZPJMESA-N 448.541 2.138 10 20 IECD Cc1nc(-c2cccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2)n[nH]1 737157613 KUKDRMWULYMKDC-HNNXBMFYSA-N 434.500 2.433 10 20 IECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333948 AZFJDBFZPMYUTR-PBHICJAKSA-N 447.504 2.119 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2ccc(S(=O)(=O)N(C)C)cc21 749324801 ONDOKAGYIVTFQF-UHFFFAOYSA-N 430.574 2.024 10 20 IECD COCCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 751097132 HEGHJGOTOXRSIM-IBGZPJMESA-N 426.517 2.129 10 20 IECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 751238189 YFSPNTJKORUXTF-UHFFFAOYSA-N 432.542 2.469 10 20 IECD C[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 753207372 OBTMQHIOACDAKJ-JTQLQIEISA-N 432.396 2.183 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)CC2)cc1F 753738969 WINFJOFURWRAQU-UHFFFAOYSA-N 426.408 2.286 10 20 IECD C[C@@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc(F)cc(F)c1O 756592793 VNHOTHAEMOITDM-CQSZACIVSA-N 425.501 2.457 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc4c(c3)CCS4(=O)=O)CC2)cc1 757750949 IYQGTNOREHECIH-UHFFFAOYSA-N 429.542 2.447 10 20 IECD CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 760888825 MPARLGGKMSUPNW-OAHLLOKOSA-N 433.530 2.207 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)ccc1O 765042250 UTEOFBWGBRNQIK-UHFFFAOYSA-N 433.895 2.176 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CC(=O)c3ccco3)CC2)cc1 778326863 ZETUQIAXQYUBGK-OAGJVSPASA-N 425.485 2.271 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1CN1CC[C@H](O)C1 781823394 JOMQQYWWBRDZJS-DEOSSOPVSA-N 438.572 2.431 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)nc12 785942474 SRCCQTNIAORGNM-UHFFFAOYSA-N 434.792 2.459 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(N(C)C)cc1 787196933 IIJBQVSRIFETAU-KURKYZTESA-N 439.560 2.255 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3CN3CCOCC3)cc2)CC1 787320959 XVRVDGFKOQOPIO-UHFFFAOYSA-N 436.556 2.117 10 20 IECD Cc1cccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789833705 IOKNLUVGVKTYLJ-QGZVFWFLSA-N 443.519 2.295 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(OCC2CC2)nc1 789860154 IJJBZGLGPLMLNJ-UHFFFAOYSA-N 440.569 2.356 10 20 IECD 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O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N(CCCCO)C1CC1 803449317 VTDFAAZNFAOBNC-UHFFFAOYSA-N 425.476 2.137 10 20 IECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[C@@H](C)C1 804380308 HJRODZZZBVLGFC-AWEZNQCLSA-N 448.501 2.267 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]1C 807097120 LSBDLNHDMZAUAC-IRXDYDNUSA-N 432.565 2.439 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(C)c1 807386737 GWOQCPPKKBFXNZ-UHFFFAOYSA-N 434.290 2.468 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](CCCO)c3ccccc3)CC2)cc1 807432067 JPCFKAMYFIZBKL-JOCHJYFZSA-N 425.529 2.364 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3c(Br)nnn3C)cc2F)C[C@@H](C)O1 810167800 OWIQJTKHWKEPBK-PHIMTYICSA-N 426.290 2.260 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H]1CCS(=O)(=O)C1 918220496 KFFUKWZOFCLBBQ-HLLBOEOZSA-N 427.542 2.158 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1 1325382589 VPWKFEISWCKCPJ-QFBILLFUSA-N 434.395 2.160 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccs1 1794474826 QVUHKGLDODFZFT-BTTYYORXSA-N 437.612 2.179 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C(=O)c1ccccc1 1806234690 FOTYVCQHAOTJJT-UTKZUKDTSA-N 446.463 2.090 10 20 IECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ccn1 1810787821 QMZABOBODNIXGF-UTKZUKDTSA-N 433.468 2.225 10 20 IECD Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1 1816721725 ONUHZEPFDHEDFN-AWEZNQCLSA-N 439.497 2.121 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnoc1 1818185135 QXQMYYPFGKWNAH-SFHVURJKSA-N 447.455 2.497 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)c2ccco2)CC1 1823772086 WMOSJPSSJVQMND-OXJNMPFZSA-N 429.473 2.053 10 20 IECD C[C@@H](NC=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740266 MEQKQQNMLZZWEJ-CXAGYDPISA-N 437.924 2.119 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCCN(C(N)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 10598721 UNCBPHHDAMKVFG-MRXNPFEDSA-N 441.484 2.382 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(CS(C)(=O)=O)cc3)cc2F)CC1 303277012 HNIYSKVNCGHJSY-UHFFFAOYSA-N 433.549 2.442 10 20 IECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 726794091 ZAJBGZLZPYHYRA-CQSZACIVSA-N 439.484 2.154 10 20 IECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1Cc1cccc(F)c1 743553877 SMLXTTMJEBHDPR-UHFFFAOYSA-N 444.482 2.355 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1OC 752097314 ROWGOIZGJVUNIN-UHFFFAOYSA-N 426.517 2.450 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(N4CCCC4)nn3)CC2)cc(OC)c1OC 759220216 FUPDMHLTMOUPRG-UHFFFAOYSA-N 427.505 2.065 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC[C@H](S(C)(=O)=O)C2)c([N+](=O)[O-])c1Br 763543730 NQKGLLFGWSSOQB-QMMMGPOBSA-N 438.256 2.288 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccnc3OCC(F)F)CC2)cc1 765859185 IARGFTIAINVJCD-UHFFFAOYSA-N 434.443 2.412 10 20 IECD CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)o1 768080989 IVDIZUUJUPSHFY-UHFFFAOYSA-N 432.484 2.434 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccc(N2CCOCC2)cn1 772434782 HHPXIQUYEZOAPL-UHFFFAOYSA-N 425.533 2.449 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1OC 773994838 PAMMMBWQLAYXNR-OAHLLOKOSA-N 435.546 2.316 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(OC)c1 782078103 RBLMZNCJPQEKLC-UHFFFAOYSA-N 447.513 2.038 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnnn1C1CC1 791930338 YGWRKNCOXQYTQB-JTQLQIEISA-N 434.503 2.067 10 20 IECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 792046037 ZZQNRFZSKVJLHT-NVXWUHKLSA-N 433.553 2.101 10 20 IECD C[C@@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@@H]1C 793731615 GEEZJHCWCFKZRF-HNBVOPMISA-N 428.577 2.193 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)c3ccc4c(c3)OCO4)CC2)cc1 795928098 JMAFTWCUJSVVJQ-MRXNPFEDSA-N 426.469 2.419 10 20 IECD CCn1ncc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C(F)(F)F 799256617 UIEZWKPZGYMPIS-UHFFFAOYSA-N 443.401 2.357 10 20 IECD C[C@@H](NC(=O)C(=O)N(CCO)[C@@H]1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803309860 DLVSMDZCUGGXFM-WZONZLPQSA-N 437.540 2.209 10 20 IECD CON(CC1CCOCC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448954 JFCADRKUXVWFLW-UHFFFAOYSA-N 441.475 2.190 10 20 IECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCCCSc1nccs1 806282432 KSWGELWCFLFGDE-UHFFFAOYSA-N 431.543 2.439 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(F)(F)F)[C@H](CO)C3)cc2)C1 806494458 QMVVUGTWSWRAGF-RYRKJORJSA-N 442.482 2.091 10 20 IECD CN(CCc1ccncc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769931 JTUFIHAOIJRTBD-QGZVFWFLSA-N 432.471 2.469 10 20 IECD COC[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@@H]1CCCO1 809451433 RLEMGHPFHDPJKN-RTWAWAEBSA-N 429.517 2.185 10 20 IECD CCOC(=O)Nc1scnc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 813426333 DHLHMHVYROQCHI-UHFFFAOYSA-N 433.534 2.272 10 20 IECD O=C(CN1CCC(C(=O)N2CCCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917032752 SUPJBEYCYIMLJO-UHFFFAOYSA-N 446.567 2.003 10 20 IECD CS(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c1 917912923 ZRIGBLKIGCPULF-UHFFFAOYSA-N 426.585 2.122 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(Cc4ccsc4)CC3)cc2)C1 918117185 ATIQUIXJMGWCEP-FQEVSTJZSA-N 441.601 2.477 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(S(=O)(=O)NCC2CC2)c1 918138736 QVCBXWQJWQLDTH-UHFFFAOYSA-N 447.532 2.281 10 20 IECD CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)ccc1C 918444167 OJJJWQJDAODAGI-UHFFFAOYSA-N 433.530 2.328 10 20 IECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c1 920194869 KKJDULPYNOSVOM-UHFFFAOYSA-N 427.501 2.112 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)C(F)(F)Cl)C2)C1 1784178908 XBJZAEDPEBBFQY-HNNXBMFYSA-N 425.215 2.026 10 20 IECD Cc1c[nH]cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1787602537 GQDALEDCBFXHPA-QITLCBANSA-N 433.892 2.295 10 20 IECD Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1811605163 MTPDQMZZYMQFHE-KKSFZXQISA-N 435.484 2.168 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC(O)C2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811796272 HAZULPNLNMMHBQ-FGAHCWIFSA-N 445.903 2.237 10 20 IECD CCC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818148024 VSROXZZAWQDSIG-KRWDZBQOSA-N 436.472 2.174 10 20 IECD Cc1ccoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498769 VRQUMXYKSLMKHN-ZDUSSCGKSA-N 447.542 2.477 10 20 IECD C[C@H]1CCc2c(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)n[nH]c21 1843730554 WKOFWIDNIYVVSS-LJLILKBBSA-N 438.484 2.107 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCCn2cccc2)C1 1846633402 JFQWVAKJPWVWKC-UHFFFAOYSA-N 433.512 2.265 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 22015424 CRCKRZHFYAMDOB-UHFFFAOYSA-N 447.532 2.120 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Cn3nnc(-c4ccc(C)cc4)n3)cc2F)CC1 303263736 DKUWFHKPYLYRCR-UHFFFAOYSA-N 437.523 2.246 10 20 IECD Cc1c(CNC(=O)C(=O)NCCNc2nccc(C(F)(F)F)n2)n(C)c2ccccc12 559634644 PBZKVDNVWOXZQT-UHFFFAOYSA-N 434.422 2.140 10 20 IECD C[C@@H]([C@@H](C)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)S(C)(=O)=O 733311255 QOSXANHFKDMNCS-KGLIPLIRSA-N 428.510 2.154 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735519753 UEUBUJWNMBPISD-KRWDZBQOSA-N 435.484 2.404 10 20 IECD CCS(=O)(=O)Nc1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739768401 SCCCMKRRTVEDNU-UHFFFAOYSA-N 430.530 2.402 10 20 IECD O=C(CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Nc1ccccn1 751065111 MFIULJUNMBNEDT-UHFFFAOYSA-N 446.510 2.408 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 751138148 ZXMUSEKHECNPPZ-KRWDZBQOSA-N 426.535 2.324 10 20 IECD O=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751228299 PAUSYNHEGKZNEW-UHFFFAOYSA-N 447.532 2.158 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 752727043 SVKHOYQNQVLCAZ-HNNXBMFYSA-N 442.491 2.180 10 20 IECD CS(=O)(=O)NCc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 753624133 SITSBOFHNMLTHS-CYBMUJFWSA-N 443.472 2.329 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 754878097 KOQQUFJLRCEVBW-KRWDZBQOSA-N 426.565 2.246 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1=O 757905191 DUEWLGDDZYGLLL-UHFFFAOYSA-N 447.835 2.059 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](Cc4c[nH]c5ccccc45)C3=O)CC2)cc1 761188287 YOLVJZNWBFKLQN-HSZRJFAPSA-N 447.539 2.462 10 20 IECD COc1cc(Cl)cc(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1O 761208206 VYBOXBZEXZJRJF-UHFFFAOYSA-N 439.965 2.280 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)NC(=O)c4ccoc4)n3)CC2)cc1 771064509 DDNCMFRYFQRRIZ-OAHLLOKOSA-N 439.472 2.054 10 20 IECD CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)N1CCCC1 775419921 CETFUEPIZGQHIY-PNCHPQGNSA-N 448.583 2.292 10 20 IECD O=C(Nc1cnc2c(c1)COCC2)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 777256228 VRUPPWKUAPMHFB-OAHLLOKOSA-N 446.454 2.479 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCC(=O)Nc3ccccc3)CC2)cc1 778277171 BFUCUXCYAYWUQQ-VAWYXSNFSA-N 436.512 2.045 10 20 IECD COC(=O)c1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 782459661 WMVSQZMBUHYHNA-UHFFFAOYSA-N 440.468 2.191 10 20 IECD Cc1nc(Cn2nnc(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c2C)no1 782624572 JUQPGVNQWRDUMF-UHFFFAOYSA-N 428.408 2.354 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C2CC2)cc1 788010669 OYXXMEDGCPCJKK-UHFFFAOYSA-N 449.599 2.182 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCn3c(nnc3-c3ccccc3)C2)cc1 788955567 XPBRMUHDMVHJSQ-UHFFFAOYSA-N 432.528 2.450 10 20 IECD Cc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 793722104 JXZAPPGABHJOJF-UYAOXDASSA-N 436.556 2.499 10 20 IECD Cc1cnn(C)c1S(=O)(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 795548136 JDJIYEPACAAJJS-UHFFFAOYSA-N 427.533 2.024 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)cc1 797431592 SWFUMXXRVSWDFE-UHFFFAOYSA-N 434.883 2.234 10 20 IECD O=C(NC1CCN(c2nccs2)CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803173545 JKKTXIRLRRTFBZ-SFHVURJKSA-N 444.557 2.142 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3[C@H](C)C[C@@H]4CCCC[C@H]43)CC2)cc1 803747688 TYXYEINXVCXHFO-XQBPLPMBSA-N 428.577 2.113 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CCCC2)CC1 805157922 LJFFUIIPEXVCCH-GOSISDBHSA-N 430.593 2.470 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccncc1OC[C@H]1CCOC1 806511872 LCRCOXLLYIACBZ-IBGZPJMESA-N 426.517 2.333 10 20 IECD COCc1cnc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 807010077 VMNRBEKXRKXSBY-AWEZNQCLSA-N 438.937 2.368 10 20 IECD CO[C@@H]1C[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1(C)C 807769694 UXZXLRYRAJTWQC-RRQGHBQHSA-N 425.476 2.303 10 20 IECD O=C(COC(=O)c1cnn2cccnc12)Nc1cccc2c1C(=O)c1ccccc1C2=O 883992988 TZVJFAFRIRAQSO-UHFFFAOYSA-N 426.388 2.300 10 20 IECD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1ccc(N2CCSCC2)cc1 917385977 GEIOUECTLMVFIN-UHFFFAOYSA-N 436.537 2.128 10 20 IECD COc1ccc(N2CCCN(C(=O)CCNS(=O)(=O)c3ccccc3F)CC2)cc1 917822372 VACMLOBBDGQRMF-UHFFFAOYSA-N 435.521 2.242 10 20 IECD C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 918246873 UASNGKJDHJNSAF-IAGOWNOFSA-N 438.528 2.257 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc2c(cc1Cl)OCO2 918438627 IUGYFERNEYDMCA-UHFFFAOYSA-N 449.866 2.424 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1 1782740227 JPBSVDUEURVLPC-NKZDFZCZSA-N 436.917 2.070 10 20 IECD O=C(Cc1cnc2ccccn12)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1805467364 PPFCPJIFDLFNFI-UHFFFAOYSA-N 449.511 2.228 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812477967 WDRMEAPCMZKYDH-FUOQNJDISA-N 449.486 2.238 10 20 IECD CCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828246961 LNKVBPBUAMUMAU-JTQLQIEISA-N 440.616 2.352 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc(C(F)F)no2)C1 1843117363 NKWLDHWQQZSDIQ-UHFFFAOYSA-N 443.410 2.222 10 20 IECD COc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(O)c1 1844881062 LAZNEGQDJWKZSJ-XBXARRHUSA-N 440.452 2.048 10 20 IECD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502213 AJBQOYGGPGOZJX-LSDHHAIUSA-N 448.903 2.324 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(O)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 11027105 GMWHJEYCXOMZKK-UHFFFAOYSA-N 428.466 2.487 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCNS(=O)(=O)c1ccc(F)cc1 16134811 OAUSRTJOASXQNG-UHFFFAOYSA-N 449.548 2.379 10 20 IECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCCC3)cc2)c1 106158360 MRZILKYLGRHSJI-UHFFFAOYSA-N 431.558 2.450 10 20 IECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N1CCOc2cc(N(C)C)ccc21 542964459 KSDYIEMOWFEINF-INIZCTEOSA-N 433.534 2.356 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)NCC4CC4)C3)cc2F)CC1 730134056 LQBRRTYXILZSNP-FQEVSTJZSA-N 445.583 2.415 10 20 IECD CC(=O)N1CCN(C(=O)CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)CC1 731036121 FTUHXAZEJGNKSX-UHFFFAOYSA-N 430.549 2.155 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)c1 734073672 UONXCTXKDDMNMW-UHFFFAOYSA-N 444.507 2.325 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)c1O 737285856 LSGZKZWYFFCYCY-UHFFFAOYSA-N 439.390 2.256 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc2nc(O)nc(O)c2c1 742800423 RBAZGUNOHVETIM-GFCCVEGCSA-N 431.399 2.436 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3[C@H](O)C(F)(F)F)CC2)cc1 750634420 KDDYZBVVVAOTBT-MOPGFXCFSA-N 444.498 2.305 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](C)(c4cc(C)oc4C)C3=O)CC2)cc1 750823477 VZGYSHNYXOUAQJ-QHCPKHFHSA-N 440.500 2.021 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(C2OCCO2)CC1 751061958 ZMXVZCNSMKYJMD-UHFFFAOYSA-N 438.527 2.480 10 20 IECD CCN(CCS(C)(=O)=O)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753204606 VRVBWADVJJNDJF-AWEZNQCLSA-N 428.510 2.156 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3cc(F)cc(F)c3)CC2)cc1 754056832 DRJFRYJWNNTQPV-NRFANRHFSA-N 448.514 2.027 10 20 IECD CC(C)C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1=O 755210929 LPRDJCRXABXMKN-CTNGQTDRSA-N 428.577 2.432 10 20 IECD C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)cc(F)c1O 756704525 GWLXFNIXWDKQNH-WCQYABFASA-N 439.347 2.433 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 758486863 VEEUDMPCVPJQTE-GFCCVEGCSA-N 444.456 2.359 10 20 IECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759358095 ABOCYFBLFZHEDZ-OKILXGFUSA-N 446.479 2.117 10 20 IECD Cc1cc(C(=O)CN(C)[C@@H](C)C(=O)OC(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 759791328 DIWDTJYELPBMKH-INIZCTEOSA-N 435.546 2.196 10 20 IECD COc1cc(N2C[C@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc(OC)c1OC 763279637 NHPHYGALBQQQSL-DZGCQCFKSA-N 444.484 2.224 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1nc(-c2nccn2C)cs1)c1ccc(N2CCOCC2)cc1 768722553 VUXFOETYPPAXHE-CQSZACIVSA-N 440.529 2.196 10 20 IECD CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1 775207828 JRDCOAIMJCLAHJ-UHFFFAOYSA-N 435.487 2.469 10 20 IECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc(O)n1 777136165 BNWNACSWELUCTJ-HUUCEWRRSA-N 431.464 2.322 10 20 IECD CCN(CC)c1ccc(CNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)cc1 779500258 OBOLXIJCJGTZAP-UTKZUKDTSA-N 433.574 2.185 10 20 IECD CCOC(=O)COc1c(Br)cc(C)cc1C=C1C(=O)N(C)C(=O)N(C)C1=O 781543485 MWJUOLQWBKZRCE-UHFFFAOYSA-N 439.262 2.133 10 20 IECD O=C(OCCn1cccn1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400155 UZKXNSSOPTUDQZ-UHFFFAOYSA-N 432.414 2.155 10 20 IECD NC(=O)[C@H]1CCC[C@@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 787820727 IHOGWZWQBZDHIG-UONOGXRCSA-N 434.448 2.235 10 20 IECD CSCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950048 MCTJEJWKLXBDGK-UHFFFAOYSA-N 433.496 2.418 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1 792225294 QRTMJPPQEGEEEC-AWEZNQCLSA-N 435.484 2.345 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@H](C)c3ccc(F)cc3)CC2)cc1 803753203 WXWNRAQHCKWEHP-GOSISDBHSA-N 442.535 2.292 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 804858606 YGETZJJCKJULSL-IBGZPJMESA-N 427.501 2.400 10 20 IECD COC1(CO)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 807953975 CXXNZVMCOGKXPZ-MRXNPFEDSA-N 437.968 2.192 10 20 IECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 917091718 DAYKDESFZGFQQG-UHFFFAOYSA-N 429.542 2.425 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C1CCN(c2ccc3nncn3n2)CC1 917386267 JEWHUQWHVRXOSI-UHFFFAOYSA-N 437.573 2.210 10 20 IECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 918284585 KFEDPJJAABJWDJ-UHFFFAOYSA-N 428.464 2.184 10 20 IECD COCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918439198 UUMNZDMTVISCEZ-UHFFFAOYSA-N 442.541 2.080 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3Cc3ccncc3)cc2)C1 1116025964 WQSQJUVGWNHELW-JTHBVZDNSA-N 435.572 2.454 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2 1785505993 WXPIMLBOQLKCDD-YHCZKZFASA-N 448.491 2.319 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1793807333 QQZLHFGHYUEVHE-GGPHIMKMSA-N 447.495 2.135 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1793809272 UPMMNTIPAUISRC-KFSMGIKGSA-N 439.468 2.172 10 20 IECD O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804588249 SNQRKCLDWHVYSE-KSFYIVLOSA-N 436.468 2.433 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808470216 UJBJGJBFJXTKHC-LAUBAEHRSA-N 449.486 2.382 10 20 IECD CCC(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831354781 GKMOSOOYYVPSQL-FQEVSTJZSA-N 438.528 2.378 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)cc3)CC2)CC1)c1cc(O)nc(O)c1 1834988964 YJUGAJRNHTUSGS-UHFFFAOYSA-N 442.491 2.131 10 20 IECD C/C(=C\c1cccs1)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841039344 HLXPBYFHTPRIHA-MDWZMJQESA-N 435.596 2.215 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)/C=C/c2cccc(O)c2)C1 1846038969 MIBKZEFRVGDBTD-ZHACJKMWSA-N 444.491 2.402 10 20 IECD O=C(c1nccc2occc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038590 FGBLVURUKNAHCL-HWKANZROSA-N 435.436 2.475 10 20 IECD O=C(Cc1cccc(F)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039230 VSIPFHQTZDADNA-SOFGYWHQSA-N 426.444 2.402 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)n(C)c2ccccc12 550171129 FSMVTTDZPBLPFD-NRFANRHFSA-N 434.540 2.293 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097766 XYNLCKXHZJVDHS-WJOKGBTCSA-N 441.553 2.213 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 741665496 NCOQITIAVFXSHJ-UHFFFAOYSA-N 431.558 2.235 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)Cc3ccc(N4CCOCC4)cc3)CC2)cc1 741734410 RGIITEIHCBHMFZ-UHFFFAOYSA-N 438.572 2.312 10 20 IECD CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)n(C)c1 755100104 QACVAHDFMQUJKR-UHFFFAOYSA-N 434.562 2.027 10 20 IECD CS(=O)(=O)c1cccnc1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 757841051 PGGYZXPAVTXQHQ-UHFFFAOYSA-N 442.520 2.353 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cnn(-c4ccccc4)c3)CC2)cc1 759136078 ZJJGKKASKSVTPK-WJOKGBTCSA-N 438.553 2.478 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 760092031 UZJLXVVDSCZVIJ-ZIAGYGMSSA-N 430.480 2.406 10 20 IECD CCS(=O)(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 760546423 VFJLVWNGFSGMKW-MRXNPFEDSA-N 438.571 2.356 10 20 IECD CC[C@H](CCO)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 762835516 HGWWXNSLJLIZGD-CYBMUJFWSA-N 437.474 2.240 10 20 IECD O=C(NCCc1ccncc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 764319467 XASANHWBRSCBOC-UHFFFAOYSA-N 442.453 2.469 10 20 IECD C[C@H]1CN(Cc2ccccn2)CC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765981497 VJMCORPAPYUEGG-WMZHIEFXSA-N 428.602 2.317 10 20 IECD C[C@@H]1CO[C@H](CO)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 769001130 XTHDXXLBHWZDCA-DVTVXSLWSA-N 426.585 2.338 10 20 IECD COC(=O)C1(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCCC1 770237808 ATVPHUOVSJHDDV-IRXDYDNUSA-N 435.540 2.473 10 20 IECD C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 772056584 HPEQIVGBJFTHOW-NSHDSACASA-N 448.391 2.288 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)cc1 774143950 CWPZIMAZGWLMHW-UHFFFAOYSA-N 448.545 2.168 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccn1 774884919 JCCXZNITEMWJPS-CQSZACIVSA-N 436.434 2.431 10 20 IECD CN(C)C(=O)C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 775218540 SRAKRQSXVLLKKF-NRFANRHFSA-N 442.535 2.088 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCCN(C(=O)c4ccccc4)C3)CC2)cc1 779610048 PQZTXJMIAPDACS-JOCHJYFZSA-N 443.569 2.452 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 787094743 YRPATMKQXYIGTR-UHFFFAOYSA-N 440.519 2.271 10 20 IECD CC[C@@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccn1 788321105 SMPKHTOWIUFPNJ-QGZVFWFLSA-N 426.517 2.028 10 20 IECD Cc1csc(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 788602247 ALRZIYISSCWTFD-CQSZACIVSA-N 438.500 2.497 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCO[C@@H](c4ccco4)C3)cc2F)C[C@@H](C)O1 789822953 BURXFHLVHVTORI-WHSLLNHNSA-N 445.491 2.249 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1F 791361853 WVXQYPVKKFDIKD-UHFFFAOYSA-N 433.509 2.143 10 20 IECD C[C@@H]1CCCC[C@@H]1CCNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793724950 PQLSBZKOASKVHH-MISYRCLQSA-N 428.577 2.337 10 20 IECD C[C@@H](NC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 799383500 PUCKZBOOYXATGV-CYBMUJFWSA-N 426.489 2.370 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)OCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 803935989 FLFBUEDEGYIKPY-UHFFFAOYSA-N 447.557 2.305 10 20 IECD CN(C[C@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1)S(C)(=O)=O 804970045 UXKRZTJFHCIBGR-GOSISDBHSA-N 440.635 2.053 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 807372922 QJOPOUNMANKZFL-IBGZPJMESA-N 428.920 2.286 10 20 IECD COc1ccc(N2CCN(C(=O)N[C@H]3CCCN(C(=O)N4CCCC4)C3)CC2)cc1F 807458935 LKMDAOBLJPNQEU-KRWDZBQOSA-N 433.528 2.346 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1cccnc1N1CCOCC1 807511229 IGNTXFCOUYUZKX-UHFFFAOYSA-N 425.272 2.186 10 20 IECD C[C@@H](CO[C@@H]1CCOC1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 808276775 CYKZPFCPEMKUDI-LAUBAEHRSA-N 429.517 2.185 10 20 IECD COc1ccc(N2CCCN(C(=O)CNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1 810181938 XKWDGMKRQAOFIB-UHFFFAOYSA-N 431.558 2.329 10 20 IECD C[C@@H](NC(=O)N(C)Cc1ccccc1S(N)(=O)=O)c1ccc(N2CCOCC2)cc1 814288481 YNETYVDHLQVJAB-MRXNPFEDSA-N 432.546 2.073 10 20 IECD CS(=O)(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 917386888 MHGBBNAPUGTKRL-UHFFFAOYSA-N 431.583 2.492 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)CC2)cc1 917821397 GDMBBGGUHMWQRH-UHFFFAOYSA-N 433.486 2.359 10 20 IECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 918081034 WPSUFPCQUBFAOW-QGZVFWFLSA-N 448.317 2.360 10 20 IECD CC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C[C@@H]21 1783961204 DQJLMLGATJJDPY-SNJCGAMXSA-N 439.556 2.458 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccc(F)nc1 1788840801 FKGZPKOCVCVXQP-JDFRZJQESA-N 449.866 2.192 10 20 IECD Cc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c(C)c1 1791930511 LIMGDMPYEUCPPO-WDSOQIARSA-N 439.512 2.325 10 20 IECD Cc1cc(C)n2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)c2n1 1801193974 UNJCGSWHUPWRIR-BJWYYQGGSA-N 435.484 2.323 10 20 IECD Cn1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)c1 1823708656 LPVJNIOSCBUKBC-JTQLQIEISA-N 447.904 2.481 10 20 IECD O=C(c1ncc(Cl)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426845 KEMWKPKRSNTCNT-INIZCTEOSA-N 445.907 2.483 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnoc1)CC2 1828198411 BWKVKFNXUAXYTL-RDNKVPPGSA-N 442.453 2.187 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)/C=C/c2cc(F)c(F)c(F)c2)C1 1846274559 UMFQIQOYLFBAKA-NSCUHMNNSA-N 433.386 2.441 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 108808331 PUNGUXTWNCRHLD-HXUWFJFHSA-N 449.507 2.228 10 20 IECD C[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc2O1 730018567 XOYRNMBRVQEPIF-DOTOQJQBSA-N 429.542 2.190 10 20 IECD CC1CCC(N2C[C@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2=O)CC1 731325178 ROSLSBVBGSUSEF-GWFKXHKXSA-N 440.588 2.432 10 20 IECD COC(=O)CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C(C)C 733995892 HIBPWHLZLLYLKN-UHFFFAOYSA-N 435.546 2.198 10 20 IECD COc1ccc(O)c(CNC(=O)c2cncc(C(=O)NCc3cc(OC)ccc3O)c2)c1 734016948 PTBRPOBQMKXVGZ-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1 737134539 NDBURPVWDXRKDV-UHFFFAOYSA-N 436.512 2.276 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccc(N4CCO[C@H](C)C4)nc3)CC2)cc1F 753846501 FVLXUCDKVVGMFE-QGZVFWFLSA-N 443.523 2.486 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4cc(C)c([N+](=O)[O-])cc43)CC2)cc1 754109836 OYQLIUFCLYXAMB-FQEVSTJZSA-N 426.517 2.457 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cc(Br)cn(C)c2=O)C2CC2)cc1 754926759 DLNFJBUQLVKSLE-UHFFFAOYSA-N 447.333 2.344 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1F 760193812 ZUOKMCRCIGSTRZ-UHFFFAOYSA-N 449.426 2.385 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766983945 VFQGOHGGIGXTCP-GCJKJVERSA-N 444.601 2.340 10 20 IECD CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)C1 771054960 WRFORQWBRFLQRB-QAPCUYQASA-N 443.997 2.188 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)Cc2ccc(O)cc2)cc1 781083871 GYBXLSDMOUGTTK-QFIPXVFZSA-N 425.529 2.325 10 20 IECD Cc1cc(C(=O)COC(=O)CN2[C@H](C)CC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 785733285 OQFCWLGZLRZOEW-HUUCEWRRSA-N 447.557 2.340 10 20 IECD C[C@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 787327745 MVUPNYYDCLSTOG-KBXCAEBGSA-N 429.492 2.436 10 20 IECD CCO[C@@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1(C)C 788783802 VMMJVHUIXYIWQU-NFBKMPQASA-N 436.572 2.333 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(CN(C)C)CCCC3)cc2F)C[C@H](C)O1 789817793 IPYWAFFVAVCBPR-ROUUACIJSA-N 448.583 2.294 10 20 IECD CC(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789823251 DCJIBSKECXVVCE-CALCHBBNSA-N 435.540 2.472 10 20 IECD C[C@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832560 AKEHDTDMLZXGJO-AOMKIAJQSA-N 440.519 2.408 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298152 QDWNTHQZNRRXNS-AUSIDOKSSA-N 437.540 2.171 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@H]([C@@H]3CCCO3)C2)cc1)C1CCCCC1 803677356 NEHHDJURRXYNRW-VXKWHMMOSA-N 429.561 2.478 10 20 IECD O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)NCc1ccc(N2CC=CC2)cc1 805999889 DZKGDHPEEIZUPC-UHFFFAOYSA-N 448.567 2.470 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)[C@@H]3CN(C)CCO3)cc2Cl)C1 807956715 ROKOOEUSAJRFGY-QINHECLXSA-N 436.984 2.028 10 20 IECD COC(=O)C1(CS(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 812500926 KDIMGHUNCYUUBR-INIZCTEOSA-N 430.954 2.273 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1Cl 914565628 TZGREWPCZBTUNH-UHFFFAOYSA-N 446.938 2.076 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cc(OC)ccc3OC)CC2)cc1 916233934 QPZSAVTTWUDRIU-UHFFFAOYSA-N 428.533 2.334 10 20 IECD Cc1ccc(NC(=O)CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 916987750 WFHNRYOBFAMPKB-UHFFFAOYSA-N 428.508 2.157 10 20 IECD CNC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 918097584 JMGBTSLTUHEFAI-UHFFFAOYSA-N 428.558 2.364 10 20 IECD COC(=O)c1cc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)oc1C 918117809 JRVLBNQWAIBCJE-KRWDZBQOSA-N 442.516 2.418 10 20 IECD CN(C)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918437807 BLGKYOHNVJLTBJ-UHFFFAOYSA-N 428.508 2.103 10 20 IECD CCc1c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cnn1C 919172833 ORFFOYXPUKYNFU-UHFFFAOYSA-N 444.513 2.077 10 20 IECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 919816270 WPOSCFAHUACPJI-IBGZPJMESA-N 425.620 2.450 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1 920239241 YKYBOGTYJZXOAD-GOSISDBHSA-N 434.562 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 920253993 DLKAAVYZZBIPBU-UMHMGIAYSA-N 448.567 2.415 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3ccc(OC)c(S(=O)(=O)N(C)C)c3)CC2)cc1 1116417990 UBECXVQRTAYMKM-UHFFFAOYSA-N 447.557 2.307 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3nc(C)ncc3Br)CC2)cc1 1191242893 GCSVUUGXPDQSEZ-UHFFFAOYSA-N 448.365 2.498 10 20 IECD CC(C)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1783426203 HIZZOTFDSXOOER-XMMPIXPASA-N 439.512 2.302 10 20 IECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1C 1799492641 BFTGDFBQCUUXMQ-CLLJXQQHSA-N 434.880 2.059 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)c(C)n1C 1821110168 CGLFTMBRLMGKOZ-CYBMUJFWSA-N 441.513 2.444 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1 1823496351 LQLBMDSOSISDRZ-JTQLQIEISA-N 449.480 2.215 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)c[nH]1 1823497807 HRBCXDWKLMSOIS-CQSZACIVSA-N 446.558 2.212 10 20 IECD C[C@H](NC=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830330935 FNHNSKPJXGYDKY-SUMWQHHRSA-N 437.924 2.119 10 20 IECD CC(=O)c1c[nH]c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 18610563 VJPYHBLFILGQBT-UHFFFAOYSA-N 443.481 2.312 10 20 IECD CCC(=O)OCC(=O)c1cc(C)n(-c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 138463115 SZFVOLFBANGWPB-UHFFFAOYSA-N 434.514 2.251 10 20 IECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2ncn3nccc3c2=O)cc1 303465334 GPYZWTIOZJTLID-UHFFFAOYSA-N 432.484 2.199 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)CC4CCCCC4)CC3)nc12 725802985 XYVVUKKBNRMWMI-UHFFFAOYSA-N 429.521 2.226 10 20 IECD NS(=O)(=O)c1ccc(CN2C(=O)/C(=C/c3cccc4c3OCO4)SC2=S)cc1 726626431 CGMBXLZBYZDZQT-NVNXTCNLSA-N 434.520 2.464 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CSCC(=O)Nc3cc(C)on3)cc2F)CC1 730235064 LLVHNGWLMMMHDW-UHFFFAOYSA-N 449.552 2.252 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C3)nc12 733201908 PHGKHHOQTOOYDR-ZIAGYGMSSA-N 433.509 2.441 10 20 IECD NC(=O)NC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745905933 SPVJYYSFNWJGFZ-GJZGRUSLSA-N 425.480 2.347 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc4ccsc4c3)cc2)C1 752234308 BLGRZOPNPSADBU-OAHLLOKOSA-N 430.555 2.477 10 20 IECD CC(=O)NC[C@H]1CCn2ncc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2C1 752836013 OZMHDQPDCDLXNJ-SFHVURJKSA-N 427.574 2.065 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753737219 CSPMFBZMFOJDGN-UHFFFAOYSA-N 436.505 2.217 10 20 IECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(F)c1F 756153586 UDBYQIDDHZHRHA-UHFFFAOYSA-N 440.468 2.409 10 20 IECD O=C(Cn1c(=O)nc(O)c2ccccc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771058962 OVWRBCVXYKYLCW-INIZCTEOSA-N 442.903 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(-n5ccnn5)c4)n3)CC2)cc1 771059284 ZRQOOFHJXHUBND-UHFFFAOYSA-N 445.483 2.217 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(N(C)C)cc1 773860194 WMMGKWYCKSBMFL-HNNXBMFYSA-N 430.530 2.108 10 20 IECD COC(=O)c1c(F)cccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 781444301 XJHIIIBKIHPUMU-OAHLLOKOSA-N 430.432 2.464 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)cc2)C1 785538202 SYRPJYDETSDHSE-FGTAOJJYSA-N 425.451 2.360 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccccc2F)c2nccn2C)cc1F 785601235 APQXKCJGZVMWQI-IBGZPJMESA-N 427.455 2.286 10 20 IECD COCc1nnc(-c2cccc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)c2)o1 786657449 YELCMUBUIDLRIT-UHFFFAOYSA-N 449.511 2.482 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C[C@H](O)Cc4ccccc43)cc2F)C[C@@H](C)O1 789352030 CYTZTDOQKOHBFZ-MBOZVWFJSA-N 427.520 2.479 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCN(C)C)CC3)cc2F)C[C@H](C)O1 789817212 GXKLVXRIMLPDAH-ROUUACIJSA-N 448.583 2.246 10 20 IECD C[C@@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793719038 KVGMHKFPBIRAMG-WBVHZDCISA-N 440.569 2.212 10 20 IECD COC(=O)c1cc(F)cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1F 795052782 JMQSPACXVFSXKB-UHFFFAOYSA-N 437.418 2.455 10 20 IECD C[C@H]1C[C@H](N2CCOCC2)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796378461 QQQQQEKESKELMZ-WMZOPIPTSA-N 433.508 2.196 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4ccccc4C)CC3)CC2)cc1 804315953 WCQDLNNVEQRGEZ-UHFFFAOYSA-N 436.556 2.437 10 20 IECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 806867456 SUQWVSYTYWTXJY-ZDUSSCGKSA-N 439.438 2.400 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1 807099386 UIWJJCAPCAJYNX-KRWDZBQOSA-N 432.565 2.441 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCS1 808854905 NKWGPCGKEICYAN-OAQYLSRUSA-N 430.618 2.189 10 20 IECD CS(=O)(=O)C[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 813662555 YPRJVFGNHIBZNO-CABCVRRESA-N 431.505 2.333 10 20 IECD CN(CC(=O)NCCc1cnn(-c2ccccc2)c1)Cc1ccc(N2CCOCC2)cc1 857758285 COJDTBUEUHPIAU-UHFFFAOYSA-N 433.556 2.500 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(NC(=O)C2CC2)cc1 916676779 RWUGIFGJNBUCMW-UHFFFAOYSA-N 427.526 2.200 10 20 IECD Cc1cc(CC(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 916746335 LTVRYWJNMWLEEU-UHFFFAOYSA-N 444.963 2.485 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)n(C)c4ccccc43)cc2F)C[C@H](C)O1 917712137 HNJDLUMIUVHGGW-HOTGVXAUSA-N 426.492 2.409 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)CC2)cc1 918665041 MIZZRADOJBQVCX-UHFFFAOYSA-N 435.521 2.437 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(CC(=O)N2CCOCC2)cc1 919775592 ATRKOKZSCXJCTL-UHFFFAOYSA-N 438.528 2.246 10 20 IECD CC(C)(C)NC(=O)CN1CCN(C(=O)CN2CCCc3cc(OC(F)F)ccc32)CC1 919803266 ZCNNMTQHULNYJC-UHFFFAOYSA-N 438.519 2.100 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 920091277 NNMVVEOPTLAXKY-AZUAARDMSA-N 448.583 2.295 10 20 IECD Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1 1787290408 UHHXLFYERATOCE-IHPCNDPISA-N 439.512 2.027 10 20 IECD Cc1cnn([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804291948 ZRCCULDDJHIPBP-RYFIZMMISA-N 440.500 2.221 10 20 IECD Nc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)s1 1827426264 QQRUFPVAUMKVDP-AWEZNQCLSA-N 431.518 2.079 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccsc3)CC2)CC1)c1cc(O)nc(O)c1 1834988024 KHUZVSUAKHYNKQ-UHFFFAOYSA-N 430.530 2.053 10 20 IECD CC(C)/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435693 YHRUJZISTFNDJZ-YEFOHOTDSA-N 438.908 2.033 10 20 IECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)nc1 1842046551 YXLFCVSICGSKJP-WEVVVXLNSA-N 437.496 2.356 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc(CO)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 23646496 FYTODGMZKGVBEP-UHFFFAOYSA-N 442.493 2.274 10 20 IECD COc1cc(/C=C2\SC(N3CCCCC3)=NC2=O)ccc1OCC(=O)N1CCOCC1 26456071 GIFNPEJNWACKPO-RGEXLXHISA-N 445.541 2.389 10 20 IECD CCc1nsc(N2CCCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)n1 561628692 QJKNUJCKORFSKH-UHFFFAOYSA-N 440.573 2.256 10 20 IECD Cc1nc2cc(O)nn2c(C)c1CCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 725887482 PAELBXTXQQPISJ-UHFFFAOYSA-N 441.507 2.401 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@@]3(N4CCOCC4)CCSC3)CC2)cc1 726613212 ORGVGPHMLVBCMR-QFIPXVFZSA-N 434.606 2.171 10 20 IECD COCCN(Cc1cccnc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727941419 YICJLQQPJKLNLO-HXUWFJFHSA-N 425.533 2.142 10 20 IECD CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727993305 WQONYDDGXZSPBG-MJGOQNOKSA-N 432.590 2.096 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ccc(-n4cccn4)cc3)CC2)cc1 729875754 CFEQJHLRKHNHNK-WJOKGBTCSA-N 438.553 2.478 10 20 IECD CN1CCC[C@@H](CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C1 731058414 XURSGMHZFJKSGK-AWEZNQCLSA-N 448.501 2.173 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](N4CCCC4=O)C3)CC2)cc1 732444410 UCNYINBYYZNXIX-NRFANRHFSA-N 443.592 2.004 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 736985836 YDIIMFRKEDPVQJ-GOSISDBHSA-N 439.516 2.343 10 20 IECD CC[C@@H](O)CCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738616 VVENZRGMLHPNOK-GOSISDBHSA-N 430.528 2.293 10 20 IECD Cc1cc(C(=O)CN2CCN(CCCCO)CC2)c(C)n1-c1ccc2c(c1)OCCO2 746488445 USOPSWJXJGDCRO-UHFFFAOYSA-N 427.545 2.438 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](Cc3cccc(F)c3)n3nnnc3C)CC2)cc1F 753739363 QZPHWUAQNWZRMN-HXUWFJFHSA-N 442.470 2.401 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)[C@]12CCCO2 759319640 CSQJTMUYVJVQFK-TXTKFYIRSA-N 449.548 2.271 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4cccc(C)c4)n3N)CC2)cc1 768438178 BROOXYFHMSAYDA-UHFFFAOYSA-N 438.557 2.417 10 20 IECD COc1cc(CN2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc(OC)c1OC 768463796 MKCCEHOXNZNUEM-LJQANCHMSA-N 430.501 2.162 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@H]4CSCCS4)n3)CC2)cc1 771067974 PXSAPMQPYWPKGW-QGZVFWFLSA-N 434.587 2.361 10 20 IECD O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771416146 LFLJSFBMCBNZDO-KUHUBIRLSA-N 438.527 2.322 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1-c1ccccc1F 772472192 PHDOSLXOTFMRTN-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(C(C)(C)O)cc3)CC2)cc1 775216761 FNVPMACMSRHQQH-SEYXRHQNSA-N 437.540 2.444 10 20 IECD CN(C)C(=O)CN1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775644771 UHKQYJNVNGKSIP-UHFFFAOYSA-N 435.160 2.123 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 776823601 ROAONFBFJNYLHI-MOPGFXCFSA-N 432.565 2.190 10 20 IECD O=C(COC(=O)c1nccn2ccnc12)Nc1cccc2c1C(=O)c1ccccc1C2=O 777096864 ZOFZQPHSIJGEKW-UHFFFAOYSA-N 426.388 2.300 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccn(-c4ccccc4)n3)CC2)cc1 778248617 WKNWMRXEVLVGEB-VAWYXSNFSA-N 445.523 2.402 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-c4cc[nH]n4)cc3)cc2)C1 780045860 AZVVSQZXUVUXIF-GOSISDBHSA-N 446.511 2.033 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1 785304210 NNTJEBTYKJGSBS-MRXNPFEDSA-N 439.512 2.339 10 20 IECD COc1cccc([C@H]2[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)CCN2C2CC2)c1 785443554 NIIAGQGIROGLGA-GOTSBHOMSA-N 436.556 2.472 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCc3nc4ccccc4[nH]3)CC2)cc1 788460183 OSZCFJUYYRUGIF-UHFFFAOYSA-N 435.528 2.359 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccn(-c4ccccc4)n3)CC2)cc1 793661362 ANAQHEUVQXAGKO-UHFFFAOYSA-N 433.512 2.282 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCCC1 793725556 QHBRCVJHJLFOCA-PZJWPPBQSA-N 428.577 2.480 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c1O 797533061 AVYXGAKYWKSNMC-UHFFFAOYSA-N 433.892 2.141 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1 799122558 SKSPYTOZYUPAIR-UHFFFAOYSA-N 431.923 2.391 10 20 IECD CCC(CC)NC(=O)c1nnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1C 800729753 GTQIUJOCKPDTER-UHFFFAOYSA-N 446.552 2.086 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4ccccc4c(=O)n3C)CC2)cc1 803868582 HUVZBSGKZYTBLX-UHFFFAOYSA-N 435.480 2.053 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3C[C@H](OC(C)C)C3(C)C)cc2F)CC1 805010027 RTAPOTSHWYROTC-RTWAWAEBSA-N 448.583 2.292 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cc4n(n3)CCCC4)cc2F)C[C@H](C)O1 806842360 IZGZEHSFGSERCY-GJZGRUSLSA-N 429.496 2.227 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1C[C@@H](C)S(=O)(=O)[C@H](C)C1 810112551 XZUZGNXWNZRXDH-RBSFLKMASA-N 440.521 2.296 10 20 IECD COc1ccc(CCNC(=N)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC 849070208 HXYSTCVKAKXPQM-LJQANCHMSA-N 439.560 2.262 10 20 IECD Cc1cc(C(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 917929369 FEAMZFNRBIBBND-QGZVFWFLSA-N 445.541 2.182 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccnc(N4CCN(C)CC4)c3)CC2)cc1 918008662 QZCAUFBVUFOEHG-UHFFFAOYSA-N 438.576 2.264 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 918444284 OLMCJOGITAFERW-UHFFFAOYSA-N 431.514 2.164 10 20 IECD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920194828 JHAMITCZGNZVCO-UHFFFAOYSA-N 438.528 2.225 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(N2CCOCC2)cc1 920927383 WEXINQCGBZVUAH-KRWDZBQOSA-N 436.512 2.466 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCSC3)C2)C1 1785478402 XYBDYNQLIRZTJU-RNODOKPDSA-N 440.949 2.338 10 20 IECD N[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cccnc1 1800715514 RGBNQXIMJPXSBL-DFGXFYAUSA-N 444.919 2.488 10 20 IECD Cc1cc(C)c(OCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(C)c1 1841530540 ZZDBUKKSWPBBJY-UHFFFAOYSA-N 425.485 2.314 10 20 IECD COc1cccc(CNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1O 727762485 LMLOKUWNFFCWDL-AWEZNQCLSA-N 430.457 2.096 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 732208036 RHZDTDLXZDOCSP-INIZCTEOSA-N 438.544 2.124 10 20 IECD CC(C)OCCN1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 747579326 LPCDJDRGBYZEJK-UHFFFAOYSA-N 436.572 2.475 10 20 IECD O=C(NCCn1c(O)nc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 752892994 LSLVQICUUFPSSI-UHFFFAOYSA-N 427.480 2.342 10 20 IECD CCc1ccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1S(N)(=O)=O 753886042 UBAAGPPYQPSILT-UHFFFAOYSA-N 436.509 2.398 10 20 IECD Cc1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 762461582 ZSWOBKIGOFIHSO-UHFFFAOYSA-N 435.933 2.138 10 20 IECD Oc1c(Br)cccc1CN1CCN(Cc2nnnn2-c2ccccc2)CC1 769315396 AXOAXVCMGRSVGQ-UHFFFAOYSA-N 429.322 2.448 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)N4CCc5ccccc54)CC3)cc2)CC1 775654629 NGPCPIVCKZZAIF-UHFFFAOYSA-N 433.600 2.145 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(O)(C(F)F)CC3)CC2)cc1 779519964 PESXGFIBNKTELB-UHFFFAOYSA-N 426.508 2.009 10 20 IECD CCOC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 781449444 KWDSREXZKQHIKG-UHFFFAOYSA-N 443.475 2.218 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1 785561408 QXCCEUAKDWORBS-QHCPKHFHSA-N 436.556 2.093 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1 785644513 DSGOYNLMJLNQPH-LJQANCHMSA-N 429.517 2.222 10 20 IECD CCN(CC)C(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 787177942 PCFAQANPGGHPDI-UHFFFAOYSA-N 428.508 2.306 10 20 IECD COCCN(Cc1cccs1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789834206 KGJYLVZNDVENMW-UHFFFAOYSA-N 449.548 2.140 10 20 IECD COC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccco1 803449319 VTJJGFKNSPHSAT-QGZVFWFLSA-N 437.443 2.470 10 20 IECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 806840241 PIEFKJYYFMHYJF-UHFFFAOYSA-N 445.541 2.095 10 20 IECD Cc1occc1C(=O)NC1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807675235 VLDXZRVUZMCCSE-HNNXBMFYSA-N 426.517 2.252 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccc(N(C)C)cc1 807676640 IBGHIMCYBQARKG-INIZCTEOSA-N 425.489 2.187 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3ccnc(N(C)C)n3)cc2Cl)C1 807954327 OUXJFAWZVZKJAD-OAHLLOKOSA-N 444.967 2.365 10 20 IECD CCOC(=O)[C@@H](F)C1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 817690658 FKGNZGWWLMOAKH-INIZCTEOSA-N 442.490 2.228 10 20 IECD CC(C)=CC(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 825198235 GFZRTRDAGFAMNV-SXGWCWSVSA-N 448.522 2.242 10 20 IECD Cn1ccsc1=NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 913687118 UVZCINDLYBGUAN-UHFFFAOYSA-N 434.455 2.242 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1 914793075 WFORVIWIJQHTRS-KRWDZBQOSA-N 445.541 2.401 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3nn(-c4ccccc4)cc3O)CC2)cc1 917945050 LSWMJYXGKKPCEB-UHFFFAOYSA-N 436.468 2.092 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)COc3ccccc3)cc2F)C[C@@H](C)O1 918140193 KGGVITSVDWRUHG-IAGOWNOFSA-N 429.492 2.251 10 20 IECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918311853 WFZHEZIDGWMFOC-UHFFFAOYSA-N 438.528 2.259 10 20 IECD Cc1c([N+](=O)[O-])cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 919840673 IJLAGZFJRVCGNT-UHFFFAOYSA-N 434.430 2.299 10 20 IECD CC[C@H](C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1784295046 GJEAAIGAVYVPIB-VKRLORBYSA-N 440.544 2.195 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ncc[nH]2)C3)cc1 1799620440 NOUZJKXJFXUKIM-CEQLMSFQSA-N 433.512 2.334 10 20 IECD COC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1800268474 OFAKSUIMQSDJHM-BJWYYQGGSA-N 440.456 2.237 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2c1CCC2)c1cc(O)c(O)c(Cl)c1 1800982732 GWWHAUDMOIUJEH-BTTYYORXSA-N 430.892 2.460 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1C[C@@H]2CC[C@H]1C2 1801733507 PEFVRPLMXSGVEE-IZKTWJBDSA-N 435.615 2.311 10 20 IECD CN(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806463144 IXWUGZHUTRWJOR-IFXJQAMLSA-N 432.908 2.027 10 20 IECD COc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)ccn1 1810547242 UIAHWOINGNDETO-UHFFFAOYSA-N 426.473 2.055 10 20 IECD COCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823474941 GIQLHXMDOAIXDS-VFADXPBXSA-N 430.461 2.269 10 20 IECD COC1(CC(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)CCC1 1838032191 FWNMEMUBZNLDLQ-UHFFFAOYSA-N 447.532 2.064 10 20 IECD COc1ccc([C@@H](O)C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1 1841185192 MMHFAOAKDKSRDI-GOSISDBHSA-N 446.887 2.310 10 20 IECD CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1O[C@@H](C)C(=O)N(C)C 13351932 LBXYSGMJWQKYDN-GPILYODUSA-N 438.527 2.227 10 20 IECD C[C@H](NC(=O)NC1CCN(C2CCN(C)CC2)CC1)c1ccc(N2CCOCC2)cc1 726246777 QOFDYRODOBCZOR-IBGZPJMESA-N 429.609 2.442 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NCc2ccc(N(CC)CC)cc2)C1 728948113 DPKZSVYPSYXPRK-IBGZPJMESA-N 432.565 2.476 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](CN(C)C(=O)OC(C)(C)C)C3)nc12 729474785 NGKKGWWAZTXOHF-CQSZACIVSA-N 433.509 2.300 10 20 IECD C[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2O1 730018569 XOYRNMBRVQEPIF-RDJZCZTQSA-N 429.542 2.190 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)CC2)cc1 731669043 BZDICQGMVCXCIQ-SFHVURJKSA-N 432.565 2.285 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(CSC)c3)CC2)cc1 731764608 ZADRTXKNZVPCNU-UHFFFAOYSA-N 442.585 2.435 10 20 IECD NC(=O)CCOc1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 731897831 RETNGTWIHQQQPG-UHFFFAOYSA-N 426.517 2.471 10 20 IECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c1 734015235 BTMNRFTUHFGVAI-AWEZNQCLSA-N 449.485 2.026 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 734470831 HMULHNUQXHSXQO-HXUWFJFHSA-N 431.558 2.448 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1 741095516 MPSSTMVELFWUAQ-UHFFFAOYSA-N 437.493 2.205 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccc(OC)c3O)CC2)cc1 745351131 OLRNFWCIAOGFPN-UHFFFAOYSA-N 428.533 2.421 10 20 IECD CC(C)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)OC(C)(C)C 745692324 UTJDBMQTJNFYPB-KRWDZBQOSA-N 447.580 2.491 10 20 IECD Cc1cc(C(=O)Cn2c(-c3ncccn3)noc2=O)c(C)n1-c1ccc2c(c1)OCCO2 750949876 PTUSHUZJCAXBHD-UHFFFAOYSA-N 433.424 2.355 10 20 IECD COc1ccc(O)c(CNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)c1 751414698 BYHWGRCHWNZBSR-UHFFFAOYSA-N 428.532 2.176 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc4ccsc4c3)cc2)C1 752234288 BLGRZOPNPSADBU-HNNXBMFYSA-N 430.555 2.477 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCO4)CC2)cc(OC)c1OC 759103493 SFGZWRKQUXAKDS-UHFFFAOYSA-N 434.514 2.158 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3C[S@](C)=O)CC2)cc1 762641300 SNTPKSHCJFIXSQ-PMERELPUSA-N 429.542 2.251 10 20 IECD COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765078846 GCHKDMJSUXZTHP-MRXNPFEDSA-N 444.469 2.191 10 20 IECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc1Cl 766786495 DVSMHMPSBOPILB-UHFFFAOYSA-N 437.855 2.193 10 20 IECD CCOC(=O)c1n[nH]c(C2CCN(c3ccc(/C=C/C(=O)OC)cc3[N+](=O)[O-])CC2)n1 767458980 MGZCDRUEMGCPQB-FNORWQNLSA-N 429.433 2.460 10 20 IECD CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 769192639 OOUBNUGWWNNKII-FQEVSTJZSA-N 446.592 2.376 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3([C@H](C)CCO)CCC3)CC2)cc1 778419537 LTFYCDZIUJOQPJ-CSHXORCISA-N 429.561 2.205 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c1O 783325031 ZAWYYWAGMBCNHO-UHFFFAOYSA-N 428.424 2.029 10 20 IECD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1[N+](=O)[O-] 783379149 QNXPAPQALPPJBN-MRXNPFEDSA-N 428.397 2.345 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CN(C(=O)OC(C)(C)C)C3CC3)cc2)CC1 786655598 GCUBPUPJYHGKCW-UHFFFAOYSA-N 430.549 2.371 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)cc2)CC1 786753922 TVIBFTQEZQRJRQ-UHFFFAOYSA-N 443.569 2.259 10 20 IECD Cc1nc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 789812533 MEOMWQLPQUMQLK-LJQANCHMSA-N 432.521 2.407 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H]3CCO[C@H](C)C3)cc2F)C[C@@H](C)O1 789819092 LIDMEJOURNUIQD-ZJPYXAASSA-N 435.540 2.377 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2c(F)cc(F)cc2C1 789847391 QSKDBGOREUPGPO-UHFFFAOYSA-N 447.457 2.266 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H](C)c1ccccc1 793716419 BKGLXFKGRVCJDV-LQWHRVPQSA-N 436.556 2.313 10 20 IECD O=C(CN1CC[C@@H](c2ccccc2)S1(=O)=O)NCc1ccc(N2CCOCC2)c(F)c1 793857716 WDOLOWJYVSJUAP-NRFANRHFSA-N 447.532 2.055 10 20 IECD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 794241314 DQJVBKXJZNCWMT-IJXRJRJASA-N 442.560 2.117 10 20 IECD CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(CC(=O)c2cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c2C)[C@H]31 796329566 LTMLVCHYNMAROL-QDUHRBGYSA-N 443.569 2.279 10 20 IECD Cc1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nc2ccccc12 803305437 MLJOIGSSHRIRST-MRXNPFEDSA-N 433.512 2.268 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1F 803663804 BBWXAENUXZCHCO-QGZVFWFLSA-N 427.524 2.447 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCC[S@](=O)Cc2ccccc2)C2CC2)cc1 805408407 UGSXGVGKVGJCHX-PMERELPUSA-N 427.570 2.309 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(F)cc1F 807386771 IOERBVQBMHWPCW-UHFFFAOYSA-N 443.200 2.474 10 20 IECD Cc1occc1C(=O)NC1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807675236 VLDXZRVUZMCCSE-OAHLLOKOSA-N 426.517 2.252 10 20 IECD CC[C@@H]1CO[C@@H](C)CN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768227 FXFMMZDLIAHXHM-HRCADAONSA-N 425.476 2.399 10 20 IECD C[C@@H](OC(=O)C[C@@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808689703 GOQGFXIOFHCGPX-KGLIPLIRSA-N 434.448 2.391 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 810165219 ZWVVSQLKHYJHGN-UHFFFAOYSA-N 435.546 2.145 10 20 IECD COc1cc(N2CCN(C(=O)NCC[C@@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc(OC)c1OC 813786131 KNNGORAHKMMFGB-HKARXFIJSA-N 433.549 2.485 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 917916554 OTLAMSYQUPDVGV-UHFFFAOYSA-N 425.576 2.262 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2OC)cc1 918428956 FIQVDYIENNYRTC-UHFFFAOYSA-N 426.517 2.498 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)CS4)CC2)cc1 918462563 XQCDTXAQVMZKOY-UHFFFAOYSA-N 440.525 2.417 10 20 IECD CCNS(=O)(=O)c1ccc(CC(=O)N2CCN(c3ccc(OCC)cc3)CC2)cc1 1321059670 KXUCQRHYYQXWDB-UHFFFAOYSA-N 431.558 2.275 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CNS(=O)(=O)c3ccccc3)cc2F)C[C@H](C)O1 1324159782 ZUOVZXQHANUZPI-HOTGVXAUSA-N 435.521 2.034 10 20 IECD CN1CCN(CC2=S=C(C(=O)Nc3ccc(N=S4(=O)CCCC4)cc3)C=C2)CC1 1627080706 HAFPNHGWYAIXNS-UHFFFAOYSA-N 432.615 2.414 10 20 IECD C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1)c1ccccc1 1787295256 ZCTXDKFUNQAACE-LQJIQPLVSA-N 439.512 2.280 10 20 IECD Cc1ccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)s1 1791586612 MDIGDUUCODDZIR-CIGKHUDMSA-N 443.525 2.169 10 20 IECD COC(OC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824341741 GNPIVSZWSHBDBS-UGAXZCSASA-N 448.516 2.055 10 20 IECD CN(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826713252 KBVZKBQHFQJVIV-QRBZPYHOSA-N 445.560 2.388 10 20 IECD O=C(/C=C/c1cnccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429401 VEPDCCNLTACGHJ-PXPVJAHISA-N 437.500 2.230 10 20 IECD Cc1nc2ncccn2c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501429 OMHBGHKSCUUMEU-UHFFFAOYSA-N 441.875 2.233 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3csc(-c4ccccn4)n3)nc12 726640443 CNZUHJNOXCKAKD-UHFFFAOYSA-N 425.426 2.487 10 20 IECD CC(C)(C)NS(=O)(=O)CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726704932 BZYYYWLAUHVRNZ-UHFFFAOYSA-N 448.536 2.274 10 20 IECD O=S(=O)(NCCCSc1nccs1)c1ccc(S(=O)(=O)NC2CC2)cc1 733900334 XEYLBAQTWHCQML-UHFFFAOYSA-N 433.602 2.045 10 20 IECD CN1C(=O)COc2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 743247380 IMBCQUANDDUBQD-MRXNPFEDSA-N 437.500 2.065 10 20 IECD O=C(OCCN1C(=O)NC2(CCCC2)C1=O)c1cccc2c1C(=O)c1ccccc1C2=O 744474011 MXRAKODALGAQGQ-UHFFFAOYSA-N 432.432 2.483 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(-n4cncn4)cc3C)CC2)cc1 745415155 YGUAJORVGVOVBX-UHFFFAOYSA-N 435.484 2.090 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)CC3(C)C)nc12 746479869 ADDPTNSXCMCJAH-UHFFFAOYSA-N 433.509 2.443 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(OC[C@@H]4CCCO4)CC3)CC2)cc1 751607517 OZIDBGIXAOQYLI-QHCPKHFHSA-N 446.592 2.187 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 754813140 CCLXYWGVINUREL-UHFFFAOYSA-N 433.284 2.490 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c1 760660089 PSPRPWCBWKOKAC-PZJWPPBQSA-N 436.505 2.407 10 20 IECD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NCCc3ccc(O)c(O)c3)nn2)CC1 762264393 VTYVCOQVVCTYMN-UHFFFAOYSA-N 431.493 2.234 10 20 IECD CN(C)CCNC(=O)c1cccc(CNC(=O)NCc2cccc(Br)c2O)c1 764767585 CZOWQLCQNDYBCN-UHFFFAOYSA-N 449.349 2.446 10 20 IECD COc1cccc([C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2nccn2C)c1 769636757 IILAEOXQCDIETJ-GOSISDBHSA-N 430.486 2.025 10 20 IECD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 771621634 DDQBKCDHFJMMJR-KRWDZBQOSA-N 437.562 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(CC(F)(F)F)CC3(C)C)CC2)cc1 775564179 QLIVQGAJTJNTPV-UHFFFAOYSA-N 428.499 2.302 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(Cl)c(C(N)=O)c3)CC2)cc1 778238784 UDCCIYARKWHEBQ-HJWRWDBZSA-N 442.903 2.291 10 20 IECD COC(=O)[C@H]1CCCCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 781346303 GAMUNXPYEHRFLM-HXUWFJFHSA-N 447.557 2.342 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)CC2)cc1 784392523 IDKDARLQTAAXLF-YADHBBJMSA-N 427.545 2.221 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)cc2)CC1 786655062 CKBCYBIQNWQVRR-UHFFFAOYSA-N 425.489 2.259 10 20 IECD Cn1ncc2c1CCC[C@H]2NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789595658 LHHGEQOEFQIQEX-RDTXWAMCSA-N 447.486 2.300 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccc(Cl)nc3)cc2F)C[C@H](C)O1 789828755 YHSUHWWAJDDGLZ-GJZGRUSLSA-N 448.926 2.463 10 20 IECD C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 793912602 YOGVEYZUZPJQQI-LJQANCHMSA-N 430.593 2.108 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c2ccccc12 797390116 OBSWJMXPFJCTFD-UHFFFAOYSA-N 438.436 2.361 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3ccc(S(=O)(=O)C(F)F)cc3)CC2)cc1 799506182 WRHRMYQTQQUKTH-UHFFFAOYSA-N 439.484 2.452 10 20 IECD CCCOc1ncccc1CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 803146467 OPHNZIIYOHABEM-UHFFFAOYSA-N 426.517 2.234 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccc(N2CCOCC2)cc1 803303248 JGYTZEVYHZYBKG-MJGOQNOKSA-N 447.601 2.261 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804315463 LTJIABLDKFPTTI-XMMPIXPASA-N 445.560 2.218 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C[C@@H](C)O)c3ccccc3)CC2)cc1 804318581 OIBQBRJFNOFXKP-QUCCMNQESA-N 439.556 2.451 10 20 IECD CCOC(=O)C(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N(CC)CC)cc2)cn1C 804945072 OXXCEZLKPLAWAZ-UHFFFAOYSA-N 435.546 2.438 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)cc1 808542846 VEGNVGODWDAVJQ-IBGZPJMESA-N 438.528 2.079 10 20 IECD CCCCn1cc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(C)n1 809184145 CYGBDYIUQYNZLG-UHFFFAOYSA-N 427.549 2.355 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(C(=O)N2CCOCC2)cc1 916681291 QDQNWAMGUACVLI-UHFFFAOYSA-N 442.491 2.456 10 20 IECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1-c1ccccc1 917832464 ANWQHWXCIHRKQV-IBGZPJMESA-N 445.523 2.173 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(Cc2cccnc2)CC1 918220283 AHFTUDYCLZVYAK-UHFFFAOYSA-N 427.524 2.209 10 20 IECD CN(C)C(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918224987 YMRVYNMXXNEUFN-UHFFFAOYSA-N 444.507 2.129 10 20 IECD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)n1 918335703 RVFDBSHHRZFXPS-UHFFFAOYSA-N 448.614 2.299 10 20 IECD CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C)cc1 918339740 GPNDHRAOJXNVIZ-QFIPXVFZSA-N 443.569 2.114 10 20 IECD O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 921201402 NNQDIIRVRADISS-UHFFFAOYSA-N 449.548 2.450 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(Cl)nc3C(=O)OC)CC2)cc1 1320343713 ANXXATXQFLAFDU-UHFFFAOYSA-N 439.921 2.431 10 20 IECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1327440745 YKHIOQWYHOJMKF-GOSISDBHSA-N 440.629 2.460 10 20 IECD Cc1cccc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)[nH]c12 1778451314 XSAKIXAJKJPRTM-HSZRJFAPSA-N 436.468 2.040 10 20 IECD C[C@@]1(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1(F)F 1785399043 WXNNAJLQKLWGAM-ROUUACIJSA-N 430.835 2.240 10 20 IECD Cc1onc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)c1C 1790242900 AYNKGGFLBMRHFX-JDFRZJQESA-N 449.891 2.263 10 20 IECD CCc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807992922 FADUMFZRCQNBRF-VGSWGCGISA-N 447.495 2.479 10 20 IECD COc1cc(F)ccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846765282 HPVKILNVTUJPJZ-XBXARRHUSA-N 442.443 2.482 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 27578592 DQIVNNZKMHTNMU-UHFFFAOYSA-N 445.541 2.107 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC([C@@]4(C)NC(=O)NC4=O)CC3)ccc21 467502036 JFMTUPQDSQFSIK-HSZRJFAPSA-N 426.517 2.355 10 20 IECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 726098938 VFQXCGPIVWXFCR-IEBWSBKVSA-N 434.606 2.313 10 20 IECD CC[C@H](C)NC(=O)CN1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728195311 JNRDSWDHOQYJRP-KRWDZBQOSA-N 425.529 2.361 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)CC2)cc1 729259661 SQNLJBAOLBGAGF-NRFANRHFSA-N 447.624 2.446 10 20 IECD Cc1cc(C(=O)CN2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(Br)cc1 730806894 XUTIKWBYCFOMIP-UHFFFAOYSA-N 433.350 2.142 10 20 IECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 734065449 BRXWYPIQBIGIPG-WAIKUNEKSA-N 446.498 2.373 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)cc2F)C[C@@H](C)O1 734270546 UCVLMRUUSGRZRH-QWFCFKBJSA-N 447.599 2.407 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3cccc4cccnc34)cc2)CC1 735496826 FNUORHHRJVZHKM-UHFFFAOYSA-N 445.566 2.089 10 20 IECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3cccc(OC)c3O)c(C)c2)CC1 737285576 IRRYIPBOOZMEOV-UHFFFAOYSA-N 426.517 2.106 10 20 IECD CCN(CC)C(=O)C1(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 741792844 WQXGDAODYHLCRS-UHFFFAOYSA-N 448.583 2.439 10 20 IECD NS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742805788 NYMIBFSTUBDITF-MRXNPFEDSA-N 439.484 2.475 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CS[C@H]2CCS(=O)(=O)C2)cc1 747481550 OAOOSZQKODHQRZ-OALUTQOASA-N 426.604 2.181 10 20 IECD COC(=O)c1nscc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 751061971 DWZDHHKYSPRJFF-UHFFFAOYSA-N 447.485 2.478 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NCCCN3CCCCCC3=O)cs2)cc1 751930993 LYBMRMCXTKYNAW-UHFFFAOYSA-N 444.557 2.382 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1F 753838494 DWPUPBYRKIZJOQ-UHFFFAOYSA-N 441.463 2.240 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1=O 754464099 GWWWUISWYJUIMH-QGZVFWFLSA-N 429.473 2.330 10 20 IECD C[C@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc(F)cc(F)c1O 756592792 VNHOTHAEMOITDM-AWEZNQCLSA-N 425.501 2.457 10 20 IECD C[C@@H](NCCS(=O)(=O)N1CCOCC1)c1cc(Br)cc(Cl)c1O 756690000 WUGWXVSAAJAPAH-SNVBAGLBSA-N 427.748 2.121 10 20 IECD C[C@@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc([N+](=O)[O-])ccc1O 756712963 RKAPUAKBGYCSTI-HZPDHXFCSA-N 428.493 2.247 10 20 IECD CC[C@@]1(C(C)C)NC(=O)N(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 758964677 NVUQRXCWYIPYEH-QFIPXVFZSA-N 434.537 2.149 10 20 IECD COc1ccc(N2CCN(CCNc3ncccc3S(=O)(=O)NC(C)C)CC2)cc1 763037006 XHRSFSGWIKLLLG-UHFFFAOYSA-N 433.578 2.011 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2 768035769 JFTYMPGEFQIUKQ-UHFFFAOYSA-N 445.523 2.453 10 20 IECD CC[C@]1(C(C)C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768517802 VCQRPBKVJTUOMD-CKNGIIGNSA-N 448.539 2.412 10 20 IECD CCC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 771202976 VDUVICWETTWHAG-GOSISDBHSA-N 436.512 2.236 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3cnn(-c4ccccc4)c3)CC2)cc1 779218595 MYBXWTXXTYREKA-DEOSSOPVSA-N 435.572 2.496 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccsc1)N(C)C)c1ccc(N2CCOCC2)cc1 787655237 QXTQJJMRBZJCFR-JXFKEZNVSA-N 430.574 2.181 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(Oc2ccc(F)cc2)CC1 788318580 FFHCTRNEKBNQSJ-UHFFFAOYSA-N 441.503 2.349 10 20 IECD C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789837297 YOTCCFGLNPYYRI-QGZVFWFLSA-N 448.583 2.030 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1 789854195 DLFLFOJJCWKTEB-QGZVFWFLSA-N 445.507 2.426 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CC(=O)N4C)CC2)cc1 790096107 YXGWAOIQIYSSNO-MDZDMXLPSA-N 434.496 2.058 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@@H](C)O3)ccc1O 790408448 ZQLCJADPOSWNOB-SECBINFHSA-N 432.907 2.078 10 20 IECD C[C@H](NC(=O)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 803308531 GKEGPAPKXPIDRF-IRXDYDNUSA-N 448.564 2.072 10 20 IECD C[C@H]1OCC[C@]12CN(C(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)CCO2 803676557 MIKUPKUXMNFUAZ-KOSHJBKYSA-N 429.561 2.478 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 806281435 YDCZDFLTBDPMRF-QGZVFWFLSA-N 446.598 2.091 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(O[C@@H]2CCOC2)c1 807100356 JZXTUZVNFLDTJL-OAQYLSRUSA-N 425.529 2.470 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CN(C)C(=O)c3cccs3)CC2)cc1 914719913 RUYCZYBIAGIDAN-UHFFFAOYSA-N 430.574 2.157 10 20 IECD O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NCc1ccc(N2CCOCC2)c(F)c1 917163119 CJYFBIHPKVBDCA-UHFFFAOYSA-N 430.871 2.286 10 20 IECD NC(=O)COc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 917380573 FUEWCJDQVSXZRW-UHFFFAOYSA-N 437.418 2.336 10 20 IECD C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919699570 SOFANLPRVCQXIU-INIZCTEOSA-N 442.539 2.109 10 20 IECD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 919779446 SCZFDEOEEARMDR-QGZVFWFLSA-N 446.573 2.334 10 20 IECD CCn1c(=O)n(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc21 919971366 SMTGZHDFKUZVML-UHFFFAOYSA-N 426.492 2.240 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(CN2CCCC2)c1 920083604 XEXZWMURYXMJGU-UHFFFAOYSA-N 427.570 2.447 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(N2CCOCC2)cc1 920927384 WEXINQCGBZVUAH-QGZVFWFLSA-N 436.512 2.466 10 20 IECD O=C(CCc1ccc(O)nn1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791029614 OBAMBDBGNZGTAK-UHFFFAOYSA-N 449.467 2.369 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994395 WCDHDUKQBLEPSI-IAQYHMDHSA-N 442.369 2.108 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CCc2cccnc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995044 WXTVHBFRGFBUHN-WZONZLPQSA-N 447.495 2.235 10 20 IECD O=C(C[C@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721647 NMPHTTKXEQELLK-QWHCGFSZSA-N 432.502 2.134 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCC(CO)CC2)[nH]n1)c1cc(O)nc(O)c1 1817843675 WJMPFSGOEGZKSA-MQBCKMQZSA-N 443.504 2.321 10 20 IECD Cn1ncnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290864 LAMUAZWAJGACSI-ZDUSSCGKSA-N 445.867 2.223 10 20 IECD NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294236 ASSPHDOSAQYWCL-CYBMUJFWSA-N 435.868 2.046 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@@H]1CC=CCC1 1833269321 CGGMIJKWVVMVIM-MRXNPFEDSA-N 428.533 2.034 10 20 IECD C[C@@H]1CCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987032 BJYKTVYEQCVTPA-BEFAXECRSA-N 430.549 2.114 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc3ccccc3o2)C1 1843725286 MPUWAQRUCNSEPU-UHFFFAOYSA-N 429.523 2.110 10 20 IECD O=C(c1cnc2ccoc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038819 JRIPLPMYJRCTTR-HWKANZROSA-N 435.436 2.475 10 20 IECD COc1cc2c(cc1NCC(=O)NC(=O)N[C@@H]1CCS(=O)(=O)C1)oc1ccccc12 11619433 FHBZYNQIDAYAQB-GFCCVEGCSA-N 431.470 2.019 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@@](O)(c1nccn1C)C(F)(F)F 105570502 OZLOKUIDCMBBOQ-LJQANCHMSA-N 426.439 2.055 10 20 IECD CN(CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ncnc2[nH]cnc12 726566724 BLPAFVRAQJVBIT-UHFFFAOYSA-N 431.447 2.176 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(=O)OC)cc3)cc2F)CC1 730391241 KNZOMAIGVQVCKL-UHFFFAOYSA-N 442.491 2.009 10 20 IECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 731858271 JQBNTAXGKFFFEO-KRWDZBQOSA-N 441.440 2.234 10 20 IECD CN(C)[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cl)c1 732274481 UGLYJROLTYFDNU-FQEVSTJZSA-N 435.977 2.494 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccnc(OC2CCOCC2)c1 733342368 FSTXWYRVDOTXBT-UHFFFAOYSA-N 426.517 2.475 10 20 IECD C[S@](=O)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 735045523 HSWNWQSDVFNBID-IPTXASRGSA-N 447.401 2.145 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1 737127648 VMQNTYOXPDALAC-UHFFFAOYSA-N 432.546 2.052 10 20 IECD CN1CCCc2cc(CNC(=O)c3ccc(F)c(S(=O)(=O)Cc4ncon4)c3)ccc21 746182765 SJDHHKAEZZSUDJ-UHFFFAOYSA-N 444.488 2.495 10 20 IECD CCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 746355149 UARJZXSFMHXLGU-UHFFFAOYSA-N 425.411 2.013 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H]4CN(c5ccccc5)C[C@H]4C3)CC2)cc1 754011504 LIWSSJIFTJHQHU-OTNCWRBYSA-N 436.600 2.246 10 20 IECD COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N(C)C)cc2C)cc1 760170149 JVDRVTGWJDSORM-UHFFFAOYSA-N 447.557 2.148 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCS(=O)(=O)CC[C@H]3C)cc2F)C[C@@H](C)O1 763196117 QWIOMKUGVPBAFA-OAGGEKHMSA-N 427.542 2.158 10 20 IECD C[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)S(=O)(=O)C1CCOCC1 765383349 BSJLDQXTXMCIBZ-CQSZACIVSA-N 446.516 2.355 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2c(c1)OCO2 769020328 CACRJCWWKDGQIV-UHFFFAOYSA-N 436.512 2.202 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3cccs3)N(C)C)CC2)cc1 774857942 OVNPWHBKPCOJNT-IBGZPJMESA-N 430.574 2.261 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 775031494 ANLQSWGIOVAFAL-OAQYLSRUSA-N 436.556 2.171 10 20 IECD Cc1cc(C(=O)CN2CCC(O)(C(F)F)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778311227 NAIILDLPVVCODS-UHFFFAOYSA-N 441.500 2.016 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(c4cc(C)[nH]n4)CC3)CC2)cc1 778418355 DLJOHUIDYLNIGA-BQYQJAHWSA-N 437.544 2.338 10 20 IECD Cc1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 780822039 WLIQMHOMXYDDPK-NJSLBKSFSA-N 433.484 2.414 10 20 IECD Cn1cc(-c2nc([C@@H]3COCCN3C(=O)NCCCSc3nccs3)no2)cn1 780844366 VZGZPLKHUHTXMB-ZDUSSCGKSA-N 435.535 2.192 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H](C)Cc3ccsc3)CC2)cc1 785527866 GBWRTABCQLDPED-GOSISDBHSA-N 444.601 2.132 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCNC(=O)c3ccc(F)cc3)cc2)CC1 786259904 SCHUCEAULBMONK-UHFFFAOYSA-N 440.519 2.321 10 20 IECD Cc1cc(C(=O)CN2C[C@@H](O)Cc3ccccc32)c(C)n1-c1ccc(S(N)(=O)=O)cc1 789354108 OPHANEKRHYKTND-IBGZPJMESA-N 439.537 2.348 10 20 IECD CCN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951342 VUMYMFMLEQQCOI-QGZVFWFLSA-N 443.466 2.186 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cc(Cl)ccc3F)cc2)CC1 790189170 QAIAFHWJNMTPRO-UHFFFAOYSA-N 432.926 2.192 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCSC[C@@H]2c2cnn(C)c2)c1 790469306 BQCXAOAEILHATF-OAQYLSRUSA-N 430.574 2.451 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 793915600 ZNILHEVHDPSMNY-GUDVDZBRSA-N 430.593 2.263 10 20 IECD O=[N+]([O-])c1cc(NS(=O)(=O)c2ccccc2S(=O)(=O)C(F)(F)F)ccc1O 794872241 HPFQGXNREPTNAM-UHFFFAOYSA-N 426.350 2.395 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1cc(S(=O)(=O)N2CCCC2)ccn1 797675322 NMAODHMIOYSEQH-UHFFFAOYSA-N 445.545 2.024 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC4(CCN(C)CC4)C3)CC2)cc1 799030856 WFXBNMZWZFOPCH-CMDGGOBGSA-N 440.588 2.234 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@]4(C3)OCc3ccccc34)CC2)cc1 804317339 ACYQJYMPKKNOLY-RUZDIDTESA-N 435.524 2.438 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)CCCC2)CC1 805155164 XBGRKWMFKVLSSP-UHFFFAOYSA-N 430.593 2.251 10 20 IECD O=C(NCc1cccc(Br)c1O)NC[C@H](N1CCOCC1)C(F)(F)F 805847854 FTZWOKDNCSHSIN-LBPRGKRZSA-N 426.233 2.217 10 20 IECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 806386963 SEMSEGVEWZIXFC-MRXNPFEDSA-N 439.560 2.317 10 20 IECD Cc1cc(Cl)cnc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 812959576 JTHIDYCKCQNFNV-HNNXBMFYSA-N 429.908 2.000 10 20 IECD Cc1cc(NCCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n(C)n1 816482228 YRBVGBCEAVWVBB-UHFFFAOYSA-N 435.531 2.138 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1N1CCCCC1 918644553 CZSXXHUBWVONEG-UHFFFAOYSA-N 428.558 2.237 10 20 IECD CCCC(=O)N1CCCC[C@H]1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 919618929 XRIZFVZSFXJFMZ-FQEVSTJZSA-N 431.533 2.068 10 20 IECD C[C@@H](C(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1)n1cccn1 919812889 KSYRLVIPSNMNRM-ZDUSSCGKSA-N 443.485 2.412 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)c1ccccc1)C2)c1cc(O)nc(O)c1 1777849693 YLICLDBVGACRCU-HCLVMJGWSA-N 443.475 2.331 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1F 1780272003 HAQPGSVJOUYUAT-VGOFRKELSA-N 429.448 2.073 10 20 IECD O=C(Cc1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429439 VJDBXUVUVOQMNC-LJQANCHMSA-N 440.500 2.069 10 20 IECD O=Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847038809 JATWOTJRDLPJFO-XVNBXDOJSA-N 428.466 2.208 10 20 IECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726567391 JYAMUIVVEQZOSN-UHFFFAOYSA-N 442.488 2.265 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)cc2F)C[C@H](C)O1 733851009 VOPJEMZUUPUHIC-KBPBESRZSA-N 440.475 2.189 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)NC(=O)OC(C)(C)C)cc1 742748982 BXWWXBUFUGACLM-QGZVFWFLSA-N 432.481 2.240 10 20 IECD COc1cc(CNCc2ccc(N(C)C)c(F)c2)ccc1OCC(=O)N1CCOCC1 746693483 QQLGOUJQCFTMCU-UHFFFAOYSA-N 431.508 2.428 10 20 IECD O=C(O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 751212929 HVIDZOZPSITLKP-UHFFFAOYSA-N 444.918 2.074 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1cccc(S(N)(=O)=O)c1 751466290 MTYGPPBYOFIQEL-UHFFFAOYSA-N 449.348 2.013 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3cc(S(C)(=O)=O)ccc3C)CC2)cc1F 754039742 FOCZRPAOIJHIAO-UHFFFAOYSA-N 442.534 2.057 10 20 IECD C[C@@H](O)CN(C)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 755440836 MFMNZMHHITVRPQ-QVASGMJFSA-N 429.361 2.490 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)CCC3CCCC3)CC2)cc(OC)c1OC 759403362 RMXMERNJRISXAW-UHFFFAOYSA-N 433.549 2.448 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)Cc3ccc(F)cc3)CC2)cc1 766750449 HIJYSUVUKIESCE-OAQYLSRUSA-N 444.551 2.249 10 20 IECD Cc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)c1 766880154 KBWHNGKKDGJLJE-FQEVSTJZSA-N 436.560 2.124 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(F)cc3C(=O)N(C)C)CC2)cc1 768033271 FXEKEQZKUDSBDA-UHFFFAOYSA-N 442.491 2.214 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c1 768720038 FPSDUXOEFKDNAB-UHFFFAOYSA-N 435.362 2.255 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccc3c(c2)CCCO3)cc1)C1=S=CC=C1 773903291 QUBYBPCYTZEAIM-UHFFFAOYSA-N 442.518 2.346 10 20 IECD Cc1sc2ncc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)c(=O)n2c1C 775950468 AQABBMLOESYBKG-UHFFFAOYSA-N 428.514 2.254 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@H](Cc4ccccc4)C3)CC2)cc1 778423157 MMUHNZDUMXKABZ-FJIRUFBNSA-N 449.551 2.370 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)cc1 779585195 ZIYBTQGFYCOSSP-OAQYLSRUSA-N 431.558 2.361 10 20 IECD O=C(Cn1cnc2c(Cl)cccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 783146461 BVKVAECBWHUJAT-UHFFFAOYSA-N 430.867 2.342 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 785422340 JZCNTGZOKZXOCJ-UHFFFAOYSA-N 426.473 2.347 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc1 785527339 KACXBRXYJAURJN-VAMGGRTRSA-N 430.593 2.264 10 20 IECD COCC1(C)CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 788895042 DLIJELFFXZOKPH-UHFFFAOYSA-N 428.512 2.120 10 20 IECD C[C@H]1CN(C[C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H](C)O1 788934350 WMVQAVNMDRYCCV-JQVVWYNYSA-N 428.577 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)CCN3CCOC(C)(C)C3)cc2F)CC1 788983098 XBSAQTHQNYBRPU-UHFFFAOYSA-N 435.588 2.220 10 20 IECD CC(C)COC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccco1 789797638 CCQZXSQWUGMYRX-LJQANCHMSA-N 447.507 2.402 10 20 IECD C[C@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793719031 KVGMHKFPBIRAMG-RDJZCZTQSA-N 440.569 2.212 10 20 IECD CC(C)NS(=O)(=O)NCCNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799985607 ZFBVUHOHQJEYJY-HNNXBMFYSA-N 446.017 2.208 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H](CCCO)c1ccccc1)c1ccc(N2CCOCC2)cc1 803299938 OWDNNZRHUNEGED-XMSQKQJNSA-N 425.529 2.330 10 20 IECD C[C@@H](O)C[C@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448576 CLQQVSTVDJXFTA-RHSMWYFYSA-N 425.476 2.135 10 20 IECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(N(C)C)cc1 807674781 QVRKPVWXMRIXJW-RXVVDRJESA-N 436.556 2.280 10 20 IECD COc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1[C@@]1(C)NC(=O)NC1=O 808113519 BSRDUKOIEPUUFN-QGZVFWFLSA-N 443.840 2.049 10 20 IECD C[C@@H](NCCS(=O)(=O)N(C)C)c1cc(Br)cc(Br)c1O 810261188 BZLZSJNHKOSCBU-MRVPVSSYSA-N 430.162 2.459 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc4c(c3)OCO4)CC2)cc1 916235012 WYQMGJPEOBVOAF-UHFFFAOYSA-N 426.517 2.388 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(C)c(S(=O)(=O)N(C)C)c3)CC2)cc1 916570740 ROTGSQOSUYBIGD-UHFFFAOYSA-N 446.573 2.015 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(C(=O)c2ccco2)CC1 918219894 QIMYVVKRHCTSBI-UHFFFAOYSA-N 430.480 2.047 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21 918444261 PTGWFZPWYBONKG-NRFANRHFSA-N 437.496 2.157 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4ncccc4c3)cc2)C1 918464386 UHCLHKLDDSRJLE-SFHVURJKSA-N 431.496 2.191 10 20 IECD COc1cccc(C(=O)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 918702981 FSDGRUJBQPOUPL-IYBDPMFKSA-N 429.492 2.494 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1327554620 FXFHWAVNOOQOBP-HNNXBMFYSA-N 439.484 2.352 10 20 IECD Cn1cc(C(N)=O)c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 1337146463 OCDMDTSRPJUSKP-WQLSENKSSA-N 435.556 2.201 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2 1785503286 GTOIDZJMDQDBDB-DNCBKAQQSA-N 428.485 2.003 10 20 IECD CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)no1 1788987313 DAXZBMKKERJPGG-MIUNTBIASA-N 449.891 2.209 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1)C2)c1cc(O)c(O)c(Cl)c1 1799770861 PRNTWSVGXPLHPN-YVWYUNDQSA-N 448.878 2.336 10 20 IECD CCN1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1804291510 OOYQUOBNKCIBTR-QGZGNFAASA-N 443.544 2.187 10 20 IECD Cn1nc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)C2)cc1O 1807493818 XCMSNJZRRUQDDB-UHFFFAOYSA-N 448.907 2.349 10 20 IECD Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995688 TUPZDXNLCYNBOE-HRAATJIYSA-N 435.484 2.168 10 20 IECD Cc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721852 QIEYBFKCWXAIGN-LBPRGKRZSA-N 425.470 2.192 10 20 IECD COC[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195006 HCNQNLCQGWOUGB-IRJIXIJJSA-N 447.513 2.168 10 20 IECD COc1ccc(-c2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)n[nH]2)cc1 1843249972 WPTJLDCSAAXGFG-UHFFFAOYSA-N 449.467 2.022 10 20 IECD O=C(c1cnoc1C1CC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038990 IEKMYUAUISHBPY-FNORWQNLSA-N 425.441 2.199 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 23472090 JCRSOXPOQZNJNP-UHFFFAOYSA-N 429.429 2.118 10 20 IECD COc1cc(Cl)ccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 728014466 AQINYIZPQKOEAN-UHFFFAOYSA-N 434.879 2.219 10 20 IECD COc1cccc(CNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)c1O 729858831 DMONOCMSJAEOKH-UHFFFAOYSA-N 431.493 2.494 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)c3ccccc3OC)CC2)cc1 734938454 LAQWYRSQPQJWKN-JOCHJYFZSA-N 442.560 2.249 10 20 IECD CC(C)(C)c1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 737131625 SAJQIRFNDKGIBB-UHFFFAOYSA-N 429.496 2.129 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cccc1C(=O)N1CCOCC1 741099880 KSWIHAFBYLLGOH-UHFFFAOYSA-N 448.523 2.099 10 20 IECD COc1cc(OC)cc(N2C[C@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)c1 752518587 ZKCLJBWHDAQZHO-GOSISDBHSA-N 439.512 2.210 10 20 IECD COC(=O)C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 753011504 WUBREHYEZWYTAK-RHSMWYFYSA-N 427.448 2.230 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(Br)o3)cc2)C1 759005282 WGLPQTNRCIEMSA-ZDUSSCGKSA-N 442.335 2.222 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCN(c4ccccn4)C3)CC2)cc(OC)c1OC 759292239 FGDVUVVLVIMRQO-KRWDZBQOSA-N 441.532 2.218 10 20 IECD COc1ccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759410125 PMVYBQGKHIVQGE-UHFFFAOYSA-N 429.473 2.008 10 20 IECD C[C@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCSCC1 759811963 QFPMRKIJXYSSJN-CQSZACIVSA-N 438.505 2.381 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc(OC)c1OC 759880183 YSIDISAEZZRIKA-UHFFFAOYSA-N 442.516 2.432 10 20 IECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](NC(=O)NC2CC2)C1 760905221 FISXRYFDGPHBFC-GOEBONIOSA-N 446.507 2.325 10 20 IECD CN1CCCN(c2ccc(-c3noc(-c4cc(NS(C)(=O)=O)ccc4O)n3)cn2)CC1 761912102 QNHBTAJTNXBJHS-UHFFFAOYSA-N 444.517 2.018 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccnc(OCCN(C)C)c3)CC2)cc1 762681338 NLAQTEQYNKGGKO-UHFFFAOYSA-N 427.549 2.499 10 20 IECD Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1=O 768466986 UQKHSEUQNNIUAX-UHFFFAOYSA-N 444.469 2.003 10 20 IECD COCCCOCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773997064 ORSLXKGOGJCRRL-UHFFFAOYSA-N 428.532 2.380 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(F)cc1F 774920523 SBHWOFXTONAAOV-HOCLYGCPSA-N 444.482 2.160 10 20 IECD COC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cc1[N+](=O)[O-] 777612149 HRHUOJIZLFXOPO-UHFFFAOYSA-N 436.446 2.411 10 20 IECD Cn1cc([C@@H](CO)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 778401655 DKAPGLUIKRYRBF-VLHYRRCOSA-N 436.584 2.313 10 20 IECD Cc1nc(Cn2nnc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c2C)no1 782677086 QMGMAEYFCJOXFU-STQMWFEESA-N 443.483 2.009 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCCN(CC2CCCCC2)CC1 788311546 WZIIOQREERCXQD-UHFFFAOYSA-N 442.604 2.254 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)cc1 788976999 GIXRGDCHQWSAHZ-OYRHEFFESA-N 443.636 2.166 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC4(CCC4)[C@@H]3[C@H]3CCCO3)CC2)cc1 794086002 JFJBGINBIOTJHE-VLDLJUOBSA-N 439.556 2.460 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c(O)c1 797390874 XORBAFJBRABQCC-UHFFFAOYSA-N 442.497 2.102 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 803300487 SWNUPOZVCSLRNI-KRWDZBQOSA-N 439.512 2.130 10 20 IECD CC(C)CO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 803661584 GYGIWKVTEZRIHH-CQSZACIVSA-N 435.500 2.283 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccncc3OCC(F)(F)F)ccc21 803688938 GGTQMSYQCZPSMI-UHFFFAOYSA-N 436.434 2.338 10 20 IECD Cc1cccc(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 805719783 KETGUQUJLHPWBT-QGZVFWFLSA-N 432.471 2.435 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 806912765 KYHYFXWGKMNUOT-UHFFFAOYSA-N 442.466 2.433 10 20 IECD O=C1CSc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2N1 807387676 RAANHJFIQRLPEB-UHFFFAOYSA-N 436.287 2.454 10 20 IECD Cc1ccncc1CN(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851261 ARBGXTNQYXAHLF-UHFFFAOYSA-N 435.572 2.197 10 20 IECD CN(C)CCc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 809801476 XHRCIJQCBLLSBR-QFIPXVFZSA-N 439.556 2.320 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)CCC3Cc4ccccc4C3)cc2)CC1 809814245 FGKPENCPTNKVFM-UHFFFAOYSA-N 448.610 2.146 10 20 IECD COc1cc(/C=C2/SC(=S)N(C3CC3)C2=O)ccc1OCC(=O)N1CCOCC1 814285676 ZRLKOTYIOJNHSJ-GZTJUZNOSA-N 434.539 2.296 10 20 IECD C[C@@H](c1ccc(F)cc1)N1CC[C@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 815197867 SNNBEZKUZKIDDE-SGTLLEGYSA-N 436.461 2.422 10 20 IECD Cc1cc(C(=O)COC(=O)CC[C@H]2CCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 914969867 FMXUPKAECUSGOD-QGZVFWFLSA-N 434.514 2.427 10 20 IECD C[C@H](NC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1)c1ccc(N2CCOCC2)cc1 920870699 AMJYYBRHIKBGMK-INIZCTEOSA-N 437.500 2.458 10 20 IECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1319712611 OXSCSJKYKHXPPZ-QHCPKHFHSA-N 436.535 2.207 10 20 IECD CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1800654863 XYHWQRYUOJRHFT-NDJUXDTMSA-N 431.533 2.158 10 20 IECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)cn1C 1817695315 LDGASHOMKDRGBH-CYBMUJFWSA-N 427.486 2.136 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1 1824896287 VOYMFYNCGVLHIU-NBGZAXBNSA-N 433.461 2.243 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C(Cl)(Cl)Cl)C1 1846037892 RMRHFOYUJZYDRF-HWKANZROSA-N 435.691 2.390 10 20 IECD Cc1nn(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c(C)c1[N+](=O)[O-] 8930862 KTNCKVUSHQDYPA-UHFFFAOYSA-N 431.474 2.346 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)n(C)c2ccccc12 579273134 GLPZZENLIYMZMY-IBGZPJMESA-N 436.487 2.159 10 20 IECD COc1cccc(CNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1O 727761159 LLLGTVWHDZSVRX-HUUCEWRRSA-N 434.514 2.129 10 20 IECD Cc1cc(C(=O)COC(=O)CN2C(=O)C(=O)N(C)C2=O)c(C)n1-c1ccc(F)c(Cl)c1 733567179 WVQRGMZWRNVPRP-UHFFFAOYSA-N 449.822 2.033 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1 734073845 XNDXMWZTMDFDAV-HZPDHXFCSA-N 427.501 2.265 10 20 IECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736195023 IJLDOIHNZJUDTQ-UHFFFAOYSA-N 447.539 2.208 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(C[C@H]2CCOC2)CC1 736392504 PMTSAIRSOXTBGA-OAQYLSRUSA-N 430.593 2.195 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1O 737283973 JAJFWTVMJDEDQM-OKILXGFUSA-N 431.464 2.408 10 20 IECD CC(C)(C)OC(=O)NC1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 740142030 IFJIGPXAEPFXKG-UHFFFAOYSA-N 427.523 2.329 10 20 IECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743958405 VKHGBUPTMCFTMW-UHFFFAOYSA-N 425.485 2.236 10 20 IECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1O 748046818 QBHOYDOYSXSSIU-UHFFFAOYSA-N 437.449 2.149 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCC(=O)N(C)C3CCCCC3)CC2)cc1 748666849 RQUUUNFESQEJEE-UHFFFAOYSA-N 445.608 2.298 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1F 754213474 SPNVIDCEBRFLEF-UHFFFAOYSA-N 438.463 2.011 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc4nc(C)cc(C)n34)CC2)cc1 758195043 BNUFUUUACINDRK-SFHVURJKSA-N 428.562 2.025 10 20 IECD COCCc1noc(CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 758698939 ADJFVSUHPKZLSE-GJZGRUSLSA-N 435.500 2.353 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccn(CCc4ccncc4)n3)CC2)cc1 759025837 HRRIWYHUBLSMNT-UHFFFAOYSA-N 448.527 2.207 10 20 IECD COc1cc(N2CCN(CC(=O)Nc3cccc(NC(C)=O)c3)CC2)cc(OC)c1OC 759886251 KYSAFKJNHXIHES-UHFFFAOYSA-N 442.516 2.432 10 20 IECD CC(C)CS(=O)(=O)N1CCC(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 762295675 JNQWZYHGZPYIAL-UHFFFAOYSA-N 443.953 2.260 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccccc3S(=O)(=O)CCN(C)C)CC2)cc1F 767686896 WDXMVHQAUZNPAX-UHFFFAOYSA-N 449.548 2.132 10 20 IECD C[C@@H]1CN(C(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)C[C@@H]1O 769129293 RLOBYMXOXYRQBC-OXQPUQPGSA-N 441.372 2.490 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 769635372 CUDUUCGIPZHFRJ-KBPBESRZSA-N 437.493 2.099 10 20 IECD O=C(COC(=O)C1(O)CCSCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 769810452 IOEVNBMRQINEPE-UHFFFAOYSA-N 425.462 2.202 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(N)nc(Cl)c4)n3)CC2)cc1 771068609 RXTUUEWHKOJKEJ-UHFFFAOYSA-N 428.880 2.267 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1)c1ccc(N(C)C)cc1 773855303 GEQMYNRSXMKWFE-INIZCTEOSA-N 425.533 2.459 10 20 IECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(C(=O)NCC(F)(F)F)n(C)c2)c1 775707024 UCTDKQXCYXVOOF-SNVBAGLBSA-N 435.424 2.071 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCSCC(F)(F)F)CC2)cc1 778424166 YMORLUNCCNYFHB-VOTSOKGWSA-N 431.480 2.312 10 20 IECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cc1 784112177 NKUGZLWERAEEBN-UHFFFAOYSA-N 435.528 2.367 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCCO4)cc2)CC1 786121566 HOTTVOXVHMZTST-UHFFFAOYSA-N 429.542 2.159 10 20 IECD COC(=O)c1cncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 788595587 LXDKEAGYTFIWLO-KBPBESRZSA-N 437.493 2.099 10 20 IECD C[C@@](O)(C1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1)C(F)(F)F 788929044 FYZCCFUUZKBYKG-HXUWFJFHSA-N 427.467 2.455 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Oc4ccc(F)nc4)CC3)CC2)cc1 792390339 ZPIIBQOXVDHGSH-FQEVSTJZSA-N 444.551 2.256 10 20 IECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 793907897 DQUVHSLWZBPQDH-YRPNKDGESA-N 430.593 2.183 10 20 IECD Cc1cc(C(=O)CN2CC[C@@H]3NC(=O)OC[C@H]3C2)c(C)n1-c1ccc2c(c1)OCCO2 799181088 XPLPODOYTACWBZ-APWZRJJASA-N 425.485 2.478 10 20 IECD Cc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 803305695 OFWCGAUZARODGJ-FQEVSTJZSA-N 436.556 2.358 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC[C@@H]1C 803448613 UUEQDOHJTNREIR-KBXCAEBGSA-N 425.476 2.256 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCOc2ccc(F)cc21 805602522 KVXOYEUGYKMJOD-FQEVSTJZSA-N 427.476 2.261 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 806278116 NESHCPYBHBZNPO-INIZCTEOSA-N 432.571 2.049 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(N2CCOCC2)c1 807289322 PTINXSBKQYZZIG-UHFFFAOYSA-N 434.540 2.140 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)c2c(F)cccc2F)CC1)c1ccc(N(C)C)cc1 807675739 AGBZRKXYPZHEMX-OAHLLOKOSA-N 444.482 2.193 10 20 IECD CNC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 807951814 AZZKYXJCHBPCQZ-IVZQSRNASA-N 434.968 2.177 10 20 IECD O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 815729598 BMMRCPQSLKEFQN-UHFFFAOYSA-N 449.429 2.421 10 20 IECD O=C(Cn1cnc2sc3c(c2c1=O)CCC3)NCc1ccc(N2CCOCC2)c(F)c1 917146723 GXFQUFDTXBWFHH-UHFFFAOYSA-N 442.516 2.239 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1F)N(Cc1ccccc1O)C[C@H]1CCCO1 917364035 AKHPLQVHHRPCHQ-QGZVFWFLSA-N 436.505 2.408 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918038791 ZDUUQRYSVHLTPW-LJQANCHMSA-N 437.544 2.341 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cn2)CCO1 918205925 XNTLJLLTGCHPAD-KRWDZBQOSA-N 443.523 2.282 10 20 IECD Cc1nnnn1-c1cccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 918293750 GCIOOVDSELZSSN-UHFFFAOYSA-N 432.440 2.437 10 20 IECD C[C@@H](Oc1ccc(F)cc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918971942 CFDFTOWKKDMZIT-OAHLLOKOSA-N 434.439 2.428 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)c2C)cc1 925670007 FJOCHCKFTMZHRP-IAGOWNOFSA-N 427.501 2.372 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C2CC(O)C2)CCO3)cc1 1781752263 KRVFKKHLSSRWBP-XBEWDXHHSA-N 437.540 2.309 10 20 IECD C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1)c1ccccc1 1787295257 ZCTXDKFUNQAACE-UHMOLFJZSA-N 439.512 2.280 10 20 IECD Cc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1796930798 CDUPUGUWOUKYMJ-NUZGMZIFSA-N 445.523 2.364 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cn2cnnn2)C3)cc1 1800513156 AKEDYJHYUOKJCO-NUZGMZIFSA-N 433.516 2.033 10 20 IECD CC(F)(F)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334516 LLGABPZBJPNGAI-ZSBIGDGJSA-N 433.546 2.166 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2cccc(F)c2)C1 1842708061 QINISOWKEJSDFA-SOFGYWHQSA-N 426.444 2.402 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3ccc(OC)c([N+](=O)[O-])c3)C=C2)cc1 466299367 PGICTQOXCXVMLZ-UHFFFAOYSA-N 441.465 2.264 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)Cc3c[nH]c4ccccc34)cc2)C1 729598616 HNOKTFMISZWXTD-UYAOXDASSA-N 449.555 2.272 10 20 IECD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 729755122 SXYWGNVMUPQPQO-UHFFFAOYSA-N 439.516 2.101 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COCC(=O)N(C)Cc1ccc(N(C)C)cc1 729833115 CVTJBPQFGHRMIR-UHFFFAOYSA-N 426.561 2.452 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738899074 JJRUAKGRIBDQFG-UHFFFAOYSA-N 444.557 2.253 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 742244648 SUZNDAUVOZDRPB-QFIPXVFZSA-N 447.539 2.453 10 20 IECD COC(=O)c1c(F)ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1F 746401687 HSVNNGZWFSVDBJ-UHFFFAOYSA-N 440.468 2.409 10 20 IECD O=C(CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ccccc1 748463348 OPMGYSZIGZELHP-UHFFFAOYSA-N 428.508 2.293 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(OC[C@H]4CCCO4)CC3)cc2)C1 751783871 XJATVPHBPIZQRZ-DENIHFKCSA-N 444.576 2.258 10 20 IECD COC(=O)COc1ccc(N(C)Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)cc1 753590882 DZYQYTSRTSPCDQ-HNNXBMFYSA-N 441.937 2.393 10 20 IECD COc1cc(OC)cc(OCCCN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 754039057 SAJFSBHUDYESIM-UHFFFAOYSA-N 438.502 2.322 10 20 IECD C[C@]1(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCO1 755122297 NMCUNMQOZFINKI-JOCHJYFZSA-N 428.512 2.311 10 20 IECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1cc(-n2nnnc2C2CC2)ccc1F 759590241 VVVDJDJCQAWCLY-KRXBUXKQSA-N 439.403 2.285 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2cc(OC)ccc2O)c(OC)c1 761289775 GXIRZRDILACOAV-UHFFFAOYSA-N 444.531 2.040 10 20 IECD C[S@@](=O)Cc1noc(-c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 762122774 UQSFQGILXDASNA-MUUNZHRXSA-N 438.443 2.030 10 20 IECD CC(=O)N1CCN(c2ccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2[N+](=O)[O-])CC1 763281662 WOHOPSXKOSXUCR-CQSZACIVSA-N 442.472 2.036 10 20 IECD Cc1nn(C)c(=O)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 765107070 LFACDBAKGYBDIT-SFHVURJKSA-N 443.548 2.459 10 20 IECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N2CCOCC2)cc1 772526615 UHOUYTYVFDOPIO-LJQANCHMSA-N 447.561 2.018 10 20 IECD C[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)c(F)c1 773090895 HLGKNAZXDWBAOJ-HOCLYGCPSA-N 428.551 2.209 10 20 IECD CCCNC(=O)[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c2ccccc2O1 773845374 HZKVHOIINWEIGB-IIBYNOLFSA-N 438.528 2.250 10 20 IECD C[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774538236 OISMFOZHWPBMLV-NQIIRXRSSA-N 436.556 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(Cl)c(C(N)=O)c3)CC2)cc1 778238783 UDCCIYARKWHEBQ-CMDGGOBGSA-N 442.903 2.291 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC[C@H](OCCO)C1 780306915 UUOHKOLTAVHMPA-KRWDZBQOSA-N 431.455 2.225 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)C2)s1 782302042 GEZVCWQZQSYGTF-CQSZACIVSA-N 439.511 2.295 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1 785524838 QWUTWVYNNDDFKX-MRXNPFEDSA-N 446.573 2.014 10 20 IECD C[C@H]1CCCN(CCNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 787674437 FFHZHMSPPMUUTL-INIZCTEOSA-N 438.519 2.221 10 20 IECD COCc1ccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)o1 788332458 NBKAYSFODNNUAD-HXUWFJFHSA-N 427.501 2.243 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O 788932968 SPJJPQARPVZKGJ-NRFANRHFSA-N 426.561 2.343 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@]3(C)CCCO)cc2F)C[C@@H](C)O1 789823083 YRKSLTKPDNSWEM-SAHWJRBASA-N 435.540 2.209 10 20 IECD Cc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C2CC2)o1 789840802 NDQIWNDUDLZOBX-UHFFFAOYSA-N 429.492 2.496 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]4[C@@H](CCN4C(=O)OC(C)(C)C)C3)nc12 795104016 QYOYENFDLNNQFZ-YOEHRIQHSA-N 445.520 2.443 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)c(O)c1 797389636 QYCVZQAEYZIVLY-UHFFFAOYSA-N 439.262 2.435 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H]1Oc1ccccc1 803665214 ZCPAALYRTHBTHL-HMXCVIKNSA-N 429.492 2.249 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCc3nccc(C(F)F)n3)CC2)cc1 806334636 RKZVJQGULCECRC-UHFFFAOYSA-N 434.491 2.434 10 20 IECD CN(Cc1ccccc1O)C(=O)NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 918218192 PWJONSIQWCEMRT-LJQANCHMSA-N 427.501 2.408 10 20 IECD CC(=O)Nc1cccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 920995176 VEVLBQYRXCROKY-UHFFFAOYSA-N 432.571 2.366 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN1C(=O)NC(C)(C)C1=O 1349194111 RYAJIVBUQWYIAY-UHFFFAOYSA-N 441.326 2.407 10 20 IECD Cc1cc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1783067430 MBXURNWYIMPERV-WZONZLPQSA-N 443.475 2.382 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cn[nH]c2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146502 MKSHEMSGPFTITQ-SFHVURJKSA-N 446.471 2.232 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1)c1ncon1 1820018846 XHCRSVGXKPLSID-GFCCVEGCSA-N 432.824 2.477 10 20 IECD CO[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1826163738 PUYVUTRJSIMJBG-PSASIEDQSA-N 425.894 2.468 10 20 IECD O=C(Cc1ccc(F)cc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441800 DLPNYZVLKBZHGQ-UHFFFAOYSA-N 434.471 2.365 10 20 IECD C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N3CCOCC3)cc1)C2=O 108807071 CHSLXCRWEMJTNK-MZNJEOGPSA-N 442.560 2.276 10 20 IECD Cc1cc(-n2c(C)cc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)c2C)no1 727177856 PPPULKMGLGHWFL-ZROIWOOFSA-N 440.572 2.141 10 20 IECD O=[N+]([O-])c1cc(CNCCS(=O)(=O)NC[C@H]2CCCCO2)ccc1N1CCCCC1 732232210 GJANTWNPFLDXCL-GOSISDBHSA-N 440.566 2.163 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](N4CCCCC4=O)C3)CC2)cc1 732824196 JXARJTPIXMSFBZ-NRFANRHFSA-N 443.592 2.004 10 20 IECD COC(=O)C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc21 741795300 YXPXEUMIALBLKM-SFHVURJKSA-N 441.503 2.445 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1C 743046858 NSGSEUAADQUKNV-UHFFFAOYSA-N 431.514 2.284 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(Cc4ccccn4)n3)cc2)C1 743167378 MODPEHOYXYMPMC-SFHVURJKSA-N 433.516 2.350 10 20 IECD CCCCc1ccc(-c2csc(NS(=O)(=O)c3cn(C)c(=O)n(C)c3=O)n2)cc1 748794026 UJCDXEUOJKEXGB-UHFFFAOYSA-N 434.543 2.351 10 20 IECD O=C(O)c1cc(F)c(Br)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 753524781 XRAWWJQLVQFKSZ-UHFFFAOYSA-N 434.195 2.491 10 20 IECD COC(=O)c1cc2c(cc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)OCO2 753817461 KRFVIUONFNWYDC-UHFFFAOYSA-N 439.468 2.398 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4c(cnn4-c4ccccc4)C3)CC2)cc1 754009013 HKKTUEKQHHMSBT-XMMPIXPASA-N 447.583 2.422 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 761066176 QISIGCKQXOFEFX-UHFFFAOYSA-N 446.554 2.419 10 20 IECD CCNc1ccc(S(=O)(=O)C(F)F)cc1NS(=O)(=O)c1cccc2nonc12 765081484 QUUHQALUCOFDED-UHFFFAOYSA-N 432.430 2.452 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765926666 OVTLMJAWVGWRAF-UHFFFAOYSA-N 434.290 2.468 10 20 IECD O=C(Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 768459820 PZUAQLOJTBQSMY-UHFFFAOYSA-N 448.347 2.079 10 20 IECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c1 769540747 OXBFFAHYKFEUAN-UHFFFAOYSA-N 440.468 2.396 10 20 IECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nnc2n1CCC2 769715675 BPQVDRQABJPFAJ-NSHDSACASA-N 433.515 2.283 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCCCN4CCCC4)n3)CC2)cc1 771064434 CIPWKYQVZWIYOB-UHFFFAOYSA-N 427.549 2.388 10 20 IECD O=C(COc1cccc(C(=O)NC2CC2)c1)NCc1ccc(N2CCOCC2)c(F)c1 772882393 HKVWZJDBTMIJMO-UHFFFAOYSA-N 427.476 2.250 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(F)c(OC)cc3C)CC2)cc1 773271833 YMYLJJOTURQAHI-UHFFFAOYSA-N 444.507 2.028 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CN3CCOCC3)c3ccc(C)cc3)nc12 774834089 YBTZHOSCBVGDBZ-FQEVSTJZSA-N 439.516 2.083 10 20 IECD CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)C(=O)C1 777397408 WUOJJUCRTBPDPJ-KMDWOBIYSA-N 445.516 2.181 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781456021 CAWPKLSYTPXLAK-ZDUSSCGKSA-N 447.438 2.404 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3S(=O)(=O)C(C)C)cc2)CC1 786655126 DHYYDMRJIRTHHT-UHFFFAOYSA-N 443.569 2.467 10 20 IECD CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933770 XQUCJPKOMJXRPK-LJQANCHMSA-N 443.569 2.272 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1 797431070 FZMBESJSXXDLCF-UHFFFAOYSA-N 425.410 2.262 10 20 IECD O=C(NC[C@H]1CSCCS1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450611 MDFMRGMUTVOTNI-INIZCTEOSA-N 445.557 2.338 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCO[C@H](C2CC2)C1 803451798 WKBZHQNPCUCNMR-LPHOPBHVSA-N 437.487 2.447 10 20 IECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 803975615 JRBMMWILSICYHN-NQIIRXRSSA-N 437.540 2.467 10 20 IECD O=S(=O)(CCCCF)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804964398 GJCUQZRHTIXBFD-UHFFFAOYSA-N 425.505 2.111 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cc(F)ccc4C3)cc2F)CC1 805008761 BGSBGGCBEHFTEK-UHFFFAOYSA-N 442.510 2.308 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1 807291811 IAWAXNYJDODJFL-HYBUGGRVSA-N 448.567 2.085 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC(C)(C)O1 807768997 CTNQNRASYUDJME-HUUCEWRRSA-N 425.476 2.399 10 20 IECD CCOC[C@@H]1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807770588 NAGQSVPAFOMNEL-HZPDHXFCSA-N 425.476 2.258 10 20 IECD C[C@H]1CN(CCCNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CCCO1 807931922 ZBQXKADPYAXFMK-SFHVURJKSA-N 429.517 2.131 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCC[C@@H]3COC(=O)NC3CC3)CC2)cc1 810036978 DAILJFDBDQIEEE-HXUWFJFHSA-N 430.549 2.087 10 20 IECD NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 810368636 CFQOGIXCZMFKNQ-UHFFFAOYSA-N 447.438 2.269 10 20 IECD CCCN(C(=O)[C@H](C)N1CCCN(c2ccc(OC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 917087813 IMRLODGOZSJMPZ-AZUAARDMSA-N 437.606 2.022 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1cccc(-n2cnnn2)c1 917418062 YDPVUYVNFGOQNS-UHFFFAOYSA-N 428.499 2.250 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CC(=O)N(c2ccccc2)C1 921076978 LCNLKHUZPYUJAR-QGZVFWFLSA-N 426.492 2.392 10 20 IECD CN1CCN(c2ccc(CN3CCC[C@@H](S(=O)(=O)NC4CCCC4)C3)cc2F)CC1 1320243325 YAPNKQMSVNLPQK-HXUWFJFHSA-N 438.613 2.404 10 20 IECD Cn1ccc(=O)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427680 CAALRODVMHBIAR-UHFFFAOYSA-N 434.452 2.253 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(Cl)cc1 1789581413 LJNPBRKLGSYHKM-JQFCIGGWSA-N 431.876 2.053 10 20 IECD COc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc(F)c1F 1800586556 OWFKVPXDADBHST-CLLJXQQHSA-N 433.411 2.345 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2C=CS[C@@H]12 1801327188 KUDCAIUGHWJNAO-OEWYJSRKSA-N 428.510 2.330 10 20 IECD O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806515398 MURRVCGKQUJNMD-JPYJTQIMSA-N 432.480 2.450 10 20 IECD CC(C)N[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)C(C)C 1815282486 YUDYVXHOEPFFSD-SCLBCKFNSA-N 447.561 2.198 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827289319 FFIBXFSYZZLAHY-GOSISDBHSA-N 427.505 2.325 10 20 IECD O=C(c1nc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736815 KLLONQKHOOEJQQ-HNNXBMFYSA-N 433.896 2.416 10 20 IECD Cc1cscc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835174085 HQELDQOJERGJRF-UHFFFAOYSA-N 444.557 2.362 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2nccc3[nH]ccc23)C1 1843279971 QPXCFGLMVPTCRU-HWKANZROSA-N 434.452 2.210 10 20 IECD O=C(c1cc(C(F)F)no1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441923 IMKSFXWKIMFZOA-UHFFFAOYSA-N 443.410 2.222 10 20 IECD COc1cscc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843565380 KLVUYNWSBHUSRN-GQCTYLIASA-N 430.482 2.404 10 20 IECD CCCN(Cc1ccccc1O)C(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 727168836 YBYZIBIITQTQMN-UHFFFAOYSA-N 445.585 2.446 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCCCN3CCN(C)CC3)cc2F)C[C@@H](C)O1 728949957 XBAQPALRKWGATJ-KDURUIRLSA-N 435.588 2.266 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1=O 729628699 XTVYLYXXBLDHAD-CZTZKLFOSA-N 428.577 2.033 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCN(C(=O)C(C)C)CC3)cc2F)CC1 730134402 AIAPQPLDWRLESW-UHFFFAOYSA-N 433.572 2.368 10 20 IECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 731359228 GPFOWQURVVOXPT-UHFFFAOYSA-N 440.635 2.195 10 20 IECD CN1CCC[C@@H](N2CCN(CC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CC2)C1 734487279 PEOJHGVVMNTDDC-LJQANCHMSA-N 446.551 2.112 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1N1CCNC1=O 742080007 NNKZZBLWCRNZGD-UHFFFAOYSA-N 438.528 2.364 10 20 IECD Cn1nc2c(cc1=O)CN(C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745903042 BHYBBLAZPSPOJU-HNNXBMFYSA-N 433.459 2.118 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H]1CC(=O)N(C2CC2)C1 750639787 YHUKNUKPBMOSQI-CQSZACIVSA-N 426.439 2.105 10 20 IECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 751318177 KPHDMBWUOWVGGE-AWEZNQCLSA-N 440.543 2.225 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)C3CCC(NC(C)=O)CC3)CC2)cc1 753095958 RCRDGSXFJAYUHN-UHFFFAOYSA-N 445.608 2.296 10 20 IECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 753106773 JCJRKWLXQHPSCI-YKFAQDCNSA-N 445.589 2.316 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)[C@@]12CCCO2 759319643 CSQJTMUYVJVQFK-VIZSFHNOSA-N 449.548 2.271 10 20 IECD CC1(O)CN(C(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)C1 765449731 JFUPUBDVPXMDEJ-SDQBBNPISA-N 427.345 2.244 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1 765977899 KJHDNZFGYYKNNX-HYBUGGRVSA-N 443.613 2.301 10 20 IECD Cc1ncc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(N)n1 767406645 GRPDMDYOBBJWLS-LLVKDONJSA-N 430.420 2.327 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnn3C(C)(C)C)cc2F)CC1 772217903 FSHIAHUTVWKYPY-UHFFFAOYSA-N 430.528 2.174 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 773922838 OGPBOIBAPFZMQA-HSZRJFAPSA-N 435.540 2.190 10 20 IECD COc1ccc(O)c([C@H](C)NCCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 775372638 DVSWTUCCEHXJDQ-INIZCTEOSA-N 436.530 2.151 10 20 IECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C[C@@H](O)C(F)(F)F 778202053 CMNLWYBGCXJOGS-SUNYJGFJSA-N 435.462 2.301 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccnc(SC)c3)CC2)cc1 778417798 AQLUMMREGYWXDN-BQYQJAHWSA-N 426.542 2.333 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3C(=O)OC)cc2F)CC1 781515348 YAKJQJYWSDDHSF-UHFFFAOYSA-N 442.491 2.009 10 20 IECD COc1ccc(N2CCN(C(=O)CN[C@H](CO)c3ccc(Br)cc3)CC2)cc1 782077306 DDIADCVRUAOKPM-HXUWFJFHSA-N 448.361 2.430 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(-n2nnnc2SC)c1 784026141 DMHWBZSJYKKMLT-UHFFFAOYSA-N 426.502 2.467 10 20 IECD O=C(Nc1cnn(CC2CC2)c1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765946 DMZQUCOHYMRLQF-QGZVFWFLSA-N 431.924 2.371 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 785527020 IMRUFPUTGCEUAR-PCCBWWKXSA-N 442.604 2.409 10 20 IECD Cc1nnnn1[C@H](Cc1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 786126053 AMVJMJRIJYDCCU-OAQYLSRUSA-N 436.516 2.033 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)CC1 787323882 FRWHVNMPSDBMOH-HSZRJFAPSA-N 435.572 2.279 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Oc1ccccc1F 789845277 VKPFHVKTCVUUOE-OAHLLOKOSA-N 447.482 2.126 10 20 IECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N2CCOCC2)cc1 793739803 DOVXFDVGZNJZEL-QHCPKHFHSA-N 438.572 2.175 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCC3CN(S(C)(=O)=O)C3)cc2Cl)C1 799976184 IZLSMOVSKOSZGO-CQSZACIVSA-N 428.986 2.267 10 20 IECD Cn1cc(Oc2ccccc2C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 801136376 FOWHSSFXPDFUIM-UHFFFAOYSA-N 440.525 2.377 10 20 IECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(O[C@@H]2CCOC2)c1 803660933 JPSMJPKEEWPSIM-GOSISDBHSA-N 429.492 2.300 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCN(C)C)Cc3ccc(C)o3)CC2)cc1 804315227 HRIGHSDJXYTPDM-UHFFFAOYSA-N 442.560 2.272 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCOC4(CCOCC4)CC3)cc2)CC1 805023488 HWPPHCAVOCAWCK-UHFFFAOYSA-N 429.561 2.337 10 20 IECD CNc1nc(C)cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 805617023 QSHFSHBOOKUUBA-GJZGRUSLSA-N 445.495 2.053 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1 806282882 XFJJWFAWZOVWII-ZIAGYGMSSA-N 441.600 2.154 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290148 QVUFOOHMSQVSMU-YLJYHZDGSA-N 442.560 2.441 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 807290225 FTHNEFMDMFLOTK-HXUWFJFHSA-N 438.915 2.254 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 808582774 KFYYFNBKHMCFLS-FQEVSTJZSA-N 440.931 2.478 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3cc(C(N)=O)ccc3F)CC2)cc1 916699798 XJSARCVVKDEEEA-UHFFFAOYSA-N 429.496 2.267 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)c3cnn(C(C)(C)C)c3)CC2)cc1 916731677 MEPYTRMMFXUOLI-UHFFFAOYSA-N 427.549 2.158 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)OC)c2)cc1OC 917758387 UIRSEDUXCILCAO-UHFFFAOYSA-N 428.488 2.044 10 20 IECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCc1ccc(Cl)cc1 920637168 AURQTCHWWUIXHE-NSHDSACASA-N 426.878 2.279 10 20 IECD C[C@@H](NS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1ccc(N2CCOCC2)cc1 920866056 VCTHFOIXXGTLIB-MRXNPFEDSA-N 432.546 2.127 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N3CCC(C(N)=O)CC3)c2C)cc1 925670285 JQEKSXHUQAZKKY-INIZCTEOSA-N 427.501 2.372 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320089327 VGIVWZJGNXGGNJ-ZCYQVOJMSA-N 435.572 2.291 10 20 IECD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)Nc3c(Cl)ccc4nonc34)CC2)c1 1342950065 GBFMXVILIBLDBC-UHFFFAOYSA-N 449.920 2.275 10 20 IECD CC(C)O[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007288 OUOSUGDWHQKCMG-RNODOKPDSA-N 426.897 2.008 10 20 IECD CCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1783131368 ONYSKWYSUSDOBL-HSZRJFAPSA-N 426.517 2.045 10 20 IECD Cc1nscc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794520425 VWKONJYFQWSOQJ-DRXBFXEBSA-N 437.905 2.033 10 20 IECD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc2c1OCCO2 1796687350 WLSJPCTZNZLOQB-MUJYYYPQSA-N 439.468 2.138 10 20 IECD O=C(CCc1ccccn1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804708234 UTHXITIDCPSRNF-HXOBKFHXSA-N 447.495 2.235 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3ccccn23)[nH]n1)c1cc(O)nc(O)c1 1817845181 FCNGLXCMZNBLEK-OAHLLOKOSA-N 447.455 2.483 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cn3ccccc3n2)[nH]n1)c1cc(O)nc(O)c1 1817845407 MBHWPIXMRPWTMQ-MRXNPFEDSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ncc(Cl)cn2)CC1 1825683375 ABGXLSKCLZVPCN-INIZCTEOSA-N 445.907 2.483 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 733368708 DOPMMSJFMUUYGL-UHFFFAOYSA-N 443.447 2.473 10 20 IECD CCOC(=O)c1ccnc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 737398201 NTXVIPKRPKRWDO-OAHLLOKOSA-N 427.461 2.480 10 20 IECD O=C1CCc2cc(F)c(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 738895286 JCFNNYVLNNWNQX-UHFFFAOYSA-N 446.504 2.267 10 20 IECD Cc1nc(-c2cccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)n[nH]1 738929734 UYTCNINJBWJLSP-UHFFFAOYSA-N 440.529 2.337 10 20 IECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740609920 OZVQKRNWBVJCDX-UHFFFAOYSA-N 434.474 2.106 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OCC(=O)N(C)C)c1 741099522 CJGCOUDXRNCPBJ-UHFFFAOYSA-N 436.512 2.093 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCCc4nc(O)ccc43)CC2)cc1 743359377 TXUIZPDDZHGJGB-NRFANRHFSA-N 425.533 2.295 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1 743560880 WHSIVFFSMFLCBD-MZYLBHOOSA-N 434.540 2.479 10 20 IECD C[C@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746155523 LGBOESDTLUPBTK-HDICACEKSA-N 426.540 2.431 10 20 IECD CCc1cccc2c1N(C(=O)C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)CC2 746990438 OCGWZEJERSIPLP-HXUWFJFHSA-N 434.540 2.156 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 751779499 JGDJWWGXDLGESL-UHFFFAOYSA-N 447.580 2.126 10 20 IECD O=S(=O)(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn([C@H]2CCOC2)c1 752000424 ZLTNDZNLKFQGGR-ZBFHGGJFSA-N 442.488 2.393 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 752871981 PVUBBPKWKDDDNO-YXBWYFRISA-N 441.528 2.257 10 20 IECD C[C@@H]1OCC[C@@]1(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 753054266 ZZUIQBOWYKBZCM-HXPMCKFVSA-N 435.458 2.399 10 20 IECD O=S(=O)(c1ccc2c(c1)CCN2S(=O)(=O)c1cccc2nonc12)N1CCCCC1 765034253 IOVOHKZBURTPBY-UHFFFAOYSA-N 448.526 2.149 10 20 IECD Cc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnn1C1CCOCC1 766817996 VVSAAHAAFBXMNM-GOSISDBHSA-N 425.533 2.175 10 20 IECD COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769869562 AXQQACMTCCAOCQ-KRWDZBQOSA-N 447.513 2.324 10 20 IECD Cn1c(=O)n(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 771055115 XMHFUNXZBOYZTO-KRWDZBQOSA-N 428.920 2.480 10 20 IECD Cc1ccc(S(=O)(=O)CCCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 774928162 ZSFCVCYXQUUTBJ-UHFFFAOYSA-N 427.500 2.093 10 20 IECD C[C@@H](C(=O)NC(C)(C)C)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 776849712 LVJOVSJCCKZIPP-ZACQAIPSSA-N 436.572 2.291 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1nc(-c2ccccc2)ccc1=O 777826720 RGMXVXBSEATNFF-UHFFFAOYSA-N 441.871 2.471 10 20 IECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 781443295 MHXJIYZLEQSLII-KRWDZBQOSA-N 442.468 2.334 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 781443580 OQTWZSHNASUFPH-UHFFFAOYSA-N 437.500 2.328 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1C(=O)N1CCOCC1 787497254 BFLDJXSATXEIIW-UHFFFAOYSA-N 448.523 2.099 10 20 IECD CC[C@@H]1CN(C)c2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311997 AEJVGWNLMOOJME-OAQYLSRUSA-N 436.556 2.397 10 20 IECD Cc1nc2ccc(C(=O)OCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2n1C 796024101 DAMRDQWDLLUQBA-UHFFFAOYSA-N 440.475 2.331 10 20 IECD CC(=O)N1CCN(Cc2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)CC1 799184742 HQUOVWHJRQPDRJ-UHFFFAOYSA-N 431.543 2.156 10 20 IECD CC1(C)C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803450557 KYUPQLIEIFOTGY-HNNXBMFYSA-N 425.476 2.447 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCc4cnn(C(C)C)c4C3)CC2)cc1 804317737 NVRWOYRHPVNDNR-IBGZPJMESA-N 439.560 2.231 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](CCNC(C)=O)C3)CC2)cc1 806333334 HMCMIJVQOFABJT-NRFANRHFSA-N 445.608 2.155 10 20 IECD CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 810349811 MPVPJCIBARHYIG-UHFFFAOYSA-N 430.436 2.388 10 20 IECD COc1ccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1S(N)(=O)=O 812431832 QLHWGUKAUOUXBR-UHFFFAOYSA-N 434.301 2.354 10 20 IECD CN(C)c1ccc(C2(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)CC2)cc1 815065387 AYNTWNNHDSZGEG-UHFFFAOYSA-N 427.570 2.335 10 20 IECD Cc1cc(CCNS(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c(C)n1-c1ccccc1 818021275 WQXIULNVZZYPGD-UHFFFAOYSA-N 438.509 2.145 10 20 IECD C=CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 919348658 XDSFBZDZVKUIKP-UHFFFAOYSA-N 441.459 2.260 10 20 IECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 1254720908 CBXYZZJKQZPGGJ-MSOLQXFVSA-N 430.574 2.386 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c1 1318418900 BDWZRHYPLANVJM-OAHLLOKOSA-N 437.949 2.123 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CC12CCS(=O)(=O)CC2 1321436952 VXBHWFVEIIGABH-KRWDZBQOSA-N 446.491 2.373 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1830436476 LBUSEDZXUJQHPF-IBGZPJMESA-N 441.532 2.309 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2c(F)cncc2F)C1 1844539933 NBNKMYXRUGKDTK-HWKANZROSA-N 431.395 2.007 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(N4CCCC4)c3)cc2)C1 726291768 OINZEUHVOCCWGE-LJQANCHMSA-N 449.555 2.243 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(OCC(N)=O)cc3)cc2F)CC1 730116354 XMHPJKWSDABKLH-UHFFFAOYSA-N 429.496 2.153 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 737144166 AQPFULOIRLQZNS-UHFFFAOYSA-N 446.511 2.441 10 20 IECD COc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(OC)c1OC 738885148 SLRHJUKWAUUMMO-UHFFFAOYSA-N 449.529 2.269 10 20 IECD COC[C@H]1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 740474241 UGNONAGOHRBSDV-SFHVURJKSA-N 428.512 2.120 10 20 IECD COc1c(F)cc(CC(=O)NCc2ccc(N3CCCCC3)cc2)cc1S(N)(=O)=O 742475324 GKIBSJCDBGVGFG-UHFFFAOYSA-N 435.521 2.331 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1OC 743254967 VZPRXLPXYGIKDE-UHFFFAOYSA-N 432.451 2.095 10 20 IECD COCC(=O)Nc1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743286807 STEIFWIXVPVSDB-UHFFFAOYSA-N 441.532 2.224 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 748229341 PDSIUJZJRONIHG-UHFFFAOYSA-N 441.488 2.142 10 20 IECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 749628319 JIQROODXGAHYRC-UHFFFAOYSA-N 426.517 2.450 10 20 IECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1-n1nnnc1C(C)C 753123751 WUDHMWBRCBXKJB-UHFFFAOYSA-N 430.490 2.424 10 20 IECD O=C(COC(=O)c1csc([C@H]2CCCO2)n1)NCc1ccc(N2CCOCC2)c(F)c1 756455446 BYBUVWKVHKJFRR-GOSISDBHSA-N 449.504 2.444 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)OCC(=O)N4)CC2)cc(OC)c1OC 760084640 NUTRQVANHMIVKC-UHFFFAOYSA-N 427.457 2.006 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H]3COc4cc(OC)ccc43)CC2)cc1 760614167 OAGJQHIDPQBKIX-KRWDZBQOSA-N 440.496 2.462 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1 761967093 HJSKRMYDCQRQPC-LLVKDONJSA-N 435.433 2.388 10 20 IECD Oc1ccc(Cl)cc1CN1CCC[C@H](NC2CCN(CCN3CCOCC3)CC2)C1 765993796 MXQKYHIPHQYGHA-QFIPXVFZSA-N 437.028 2.396 10 20 IECD Cc1cc(S(=O)(=O)NCCNCc2ccc(N3CCOCC3)c(F)c2)c(C)s1 771978963 JHVRNOOLSZNLRX-UHFFFAOYSA-N 427.567 2.409 10 20 IECD COC(=O)[C@@H]1C[C@@H](C)CCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 775807752 VLOXMUFVFIVOKG-XOBRGWDASA-N 447.557 2.198 10 20 IECD COCCN(Cc1ccco1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778230555 CODKGZXYZJKGNE-MDZDMXLPSA-N 427.501 2.168 10 20 IECD COc1ccc(S(=O)(=O)N2CC(NCc3cccc(Br)c3O)C2)cc1 779172999 ZKALUHKAQPOHCW-UHFFFAOYSA-N 427.320 2.326 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1F 784766659 JINSVYOKXUHUEV-HNNXBMFYSA-N 448.882 2.003 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)cc1F 787135276 CBHSQIGGCWJWDM-UHFFFAOYSA-N 430.499 2.428 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(CN2CCOCC2)c1 787290838 NIFGEPAJQSSYMV-UHFFFAOYSA-N 436.556 2.052 10 20 IECD CCc1noc(CC)c1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823110 CUTZJAWOOGDERB-HUUCEWRRSA-N 446.523 2.485 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1 794853600 XJNXDGKAQFKXEW-UHFFFAOYSA-N 429.546 2.346 10 20 IECD O=S(=O)(NCCNCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1F 799345332 YIILUWWFTQINMM-UHFFFAOYSA-N 427.929 2.384 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCO[C@@H](C2CC2)C1 803451799 WKBZHQNPCUCNMR-QFBILLFUSA-N 437.487 2.447 10 20 IECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 804083104 JCXAAKXGEMPKJP-FQEVSTJZSA-N 434.540 2.330 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)cc1F 804852840 OSPRORMADAVKQF-FQEVSTJZSA-N 445.539 2.239 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)CC2)cc1 806333033 DAVYYRHTAVQDTM-UNMCSNQZSA-N 429.609 2.476 10 20 IECD Cc1nc2c(s1)[C@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)CCC2 807643565 BMWZSEZGQICAQX-LJQANCHMSA-N 428.558 2.440 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCN(C2CCC2)CC1 807771215 TVGOPJSBJQFZPK-MRXNPFEDSA-N 436.503 2.070 10 20 IECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC(C)(C)O1 808854632 FXMIKPBPEAVMDB-UHFFFAOYSA-N 442.604 2.251 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 809722012 KKXQGPOYOZPGFS-GOSISDBHSA-N 429.517 2.091 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccc(N(C)C)cc1 810387676 CXWSOYRPKANKLF-GFCCVEGCSA-N 434.443 2.311 10 20 IECD COCCOCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920710744 OMFJPNVYLOOADD-CQSZACIVSA-N 425.437 2.385 10 20 IECD COC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccn1 1334405880 TZOIBOLAQBPUNJ-KRWDZBQOSA-N 447.494 2.294 10 20 IECD Cc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1794831301 XJLCIFDCKHDRPP-CLLJXQQHSA-N 436.871 2.498 10 20 IECD C[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1(F)F 1796935571 UOJRRXXATVDIPP-CRKCHWSSSA-N 430.455 2.463 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Cl 1799539373 PRNLNFRRHZQRAU-CLLJXQQHSA-N 437.974 2.452 10 20 IECD CCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812613690 GVBSHKVZVCDFJO-YJBOKZPZSA-N 448.614 2.384 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccc(F)nc1 1820366086 FKIKACJFTZQELO-NSHDSACASA-N 429.433 2.023 10 20 IECD O=C(c1cc(Cl)ccn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441908 UOJVJNKZMRKFTO-UHFFFAOYSA-N 437.887 2.345 10 20 IECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(Cl)nc2)=NN1c1ccccc1 1847174862 JPOSSOMHFLGRAL-ROUUACIJSA-N 437.887 2.343 10 20 IECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCc2cc(Br)cc(F)c21 78404781 ZMKWGIDMUVAFBA-UHFFFAOYSA-N 440.294 2.365 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3N3CCOCC3)cc2)C1 730773106 XANGKLAQWWJSGF-GOSISDBHSA-N 440.519 2.294 10 20 IECD CCOC(=O)[C@H](Cc1ccccc1)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 731842663 IAKDKFOBGQMVLE-QHCPKHFHSA-N 439.556 2.450 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc21 740609420 KFYJSBRPZJDKAG-UHFFFAOYSA-N 442.541 2.098 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)CC2)cc1 754127441 JCYZRJCCMFIRKS-BDTNDASRSA-N 428.577 2.464 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](C)S(=O)(=O)CC3)cc2F)C[C@@H](C)O1 758399882 PLEFUEGWKGSYGJ-BZUAXINKSA-N 427.542 2.158 10 20 IECD COc1cc(N2CCN(CC(=O)N[C@@H]3CCOc4ccccc43)CC2)cc(OC)c1OC 759885679 FIYZUHXWIXYDEG-LJQANCHMSA-N 441.528 2.474 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)(F)F)CC3)cc2F)C[C@H](C)O1 760984508 PAMVBOWJPQIYQP-GJZGRUSLSA-N 447.473 2.445 10 20 IECD CC(C)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1CCCS1(=O)=O 761984455 ZATTUELSDHZNMJ-IEBWSBKVSA-N 443.997 2.186 10 20 IECD COC(=O)c1sccc1N1C(=O)C[C@H](N2CCCN(c3ccc(OC)cc3)CC2)C1=O 762436756 QIFSNLVPHIJXMY-SFHVURJKSA-N 443.525 2.388 10 20 IECD CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 764186014 ROYTWZFLKHBRES-UHFFFAOYSA-N 434.533 2.439 10 20 IECD COc1ccc([C@@H](CNCc2ccc([N+](=O)[O-])c(OC)c2O)N2CCOCC2)cc1OC 774943600 VVGCMXFHCJUNQB-GOSISDBHSA-N 447.488 2.489 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(S(N)(=O)=O)cc3C)CC2)cc1 775213473 XVCKPVXFGJXYOE-UHFFFAOYSA-N 432.546 2.119 10 20 IECD CCOC(=O)c1cc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1C 778295959 UATGDJJLRMQQMW-MDZDMXLPSA-N 440.500 2.054 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 780500369 VJPDHUVNYBPPRE-CTNGQTDRSA-N 449.548 2.064 10 20 IECD CCn1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 781417918 DYFUPDHVQVIUQS-HZPDHXFCSA-N 432.496 2.058 10 20 IECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1Br 781624605 LCKUDLJIARGLGZ-CQSZACIVSA-N 447.333 2.484 10 20 IECD O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)OCC(=O)c1ccc(O)c(O)c1 782461828 GCIDIONRBZCJJU-UHFFFAOYSA-N 433.482 2.071 10 20 IECD O=C(COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)NCC(F)(F)F 785407153 DVBDNWPRTWQLOC-UHFFFAOYSA-N 438.405 2.090 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)Cc3ccccc3F)cc2F)CC1 787974019 JRPNSWZZSFYRKT-KRWDZBQOSA-N 444.526 2.470 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 788324587 VUZAIHVOIGUJAT-OAQYLSRUSA-N 444.963 2.212 10 20 IECD C[C@H]1CN(CCN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)O1 789329879 PZYWDVXMTISLGT-CALCHBBNSA-N 435.524 2.442 10 20 IECD CC[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837226 WWEASJAQJMMAEV-HXUWFJFHSA-N 428.508 2.408 10 20 IECD CO[C@H]1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949548 JQWDDMRKECUZAL-QAPCUYQASA-N 443.466 2.090 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)Cc3ccsc3)CC2)cc(OC)c1OC 793791892 NSBSBOHTCJOPDP-OAHLLOKOSA-N 447.557 2.170 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCCCS(=O)(=O)c2ccccc2)C2CC2)cc1 803365451 NHWOVNFCIWHAIW-UHFFFAOYSA-N 443.569 2.224 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCc3ccccn3)cc2F)C[C@H](C)O1 805691816 LPYBWRLCUYNRBU-IRXDYDNUSA-N 445.491 2.211 10 20 IECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806794348 YAKIIJPVBUOCTB-OAQYLSRUSA-N 439.512 2.130 10 20 IECD CC(C)(C)OC(=O)NC[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807289403 TZLNCCNFOCKKEH-DEOSSOPVSA-N 442.560 2.442 10 20 IECD C[C@@H]1Oc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2NC1=O 918298052 WVFWGKNPXHRWQD-YOEHRIQHSA-N 439.468 2.258 10 20 IECD O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1320543348 JGOSCYDLPZXEQP-IAGOWNOFSA-N 434.518 2.161 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 1320641970 QYJVZMNGLQLBAP-IMJJTQAJSA-N 436.505 2.334 10 20 IECD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cc1 1799769170 PWSFIHXIUPNFFO-CCWDJLKJSA-N 446.887 2.277 10 20 IECD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1)n1cccc1 1799770338 NSCHPMSVTMTSBM-FRQROOTJSA-N 433.892 2.017 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)C1CC1 1813712827 UZJXYSRAMKSVLF-PGRDOPGGSA-N 431.496 2.290 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cn[nH]c3cn2)[nH]n1)c1cc(O)nc(O)c1 1817846340 SLWSJESBOSAWCA-INIZCTEOSA-N 448.443 2.107 10 20 IECD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)n1cccc1 1826590580 DZIXACPLFBKIHD-YPMHNXCESA-N 427.486 2.238 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)nn2)CC1 1829186167 LLRRBFZNDJOFGD-INIZCTEOSA-N 445.907 2.483 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843442710 VMBQLNPGKOGPDF-UHFFFAOYSA-N 432.480 2.305 10 20 IECD Cc1cccc2[nH]c(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)cc12 1844049696 VKHKEYKRCBCGFQ-UHFFFAOYSA-N 442.566 2.154 10 20 IECD COc1ccc(Cc2nnc(SCC(=O)NCc3ccc(N(C)C)cc3)n2N)cc1 27497208 YPQFUAOYYMUMQG-UHFFFAOYSA-N 426.546 2.066 10 20 IECD CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 730074354 BIYMXMRLLLHYRC-PKOBYXMFSA-N 446.617 2.342 10 20 IECD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740920436 ZJEVAGCKJGHVMQ-FQEVSTJZSA-N 425.577 2.291 10 20 IECD CCC(CC)[C@H](C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1)N1CCOCC1 750511311 FFDKZBAEHGLKJC-HSZRJFAPSA-N 447.576 2.024 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751239745 MZUSEGBZGXVEPF-UHFFFAOYSA-N 447.557 2.341 10 20 IECD COCCOc1ccc(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753858868 XJDMNJJYBUCMBR-UHFFFAOYSA-N 431.508 2.298 10 20 IECD CCOC(=O)N1CCC[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759222695 UTISCUHHPJXARF-INIZCTEOSA-N 435.521 2.230 10 20 IECD COC(=O)c1cn([C@@H]2CCCN(C(=O)NCc3ccc(N4CCSCC4)cc3)C2)nn1 762567483 FSRGDLCOVRBMBQ-GOSISDBHSA-N 444.561 2.165 10 20 IECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n(-c2ncccn2)n1 768171346 OKAMLLWYQCUMIB-UHFFFAOYSA-N 431.500 2.417 10 20 IECD O=S(=O)(c1ccc2ccccc2c1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768438016 NYCMDALWWRQTNG-QFIPXVFZSA-N 440.521 2.478 10 20 IECD CCN1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)OC)ccc3OC)c2)CC1 769848061 KTHMJCKFTZGVKI-UHFFFAOYSA-N 433.530 2.425 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1)c1ccc(N(C)C)cc1 773855332 GOOUFEDNEMEVMS-MRXNPFEDSA-N 438.528 2.477 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@](C)(O)c3cc(C)oc3C)CC2)cc1 778296893 DSCGBWOCFQUBAX-OPSAWKISSA-N 441.528 2.134 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 778391193 KHHKJRVDQPUXKX-CUFUVEISSA-N 437.540 2.008 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)OC)c(C(=O)OC)c1 784026747 ZUCLCZIQPOIEFX-UHFFFAOYSA-N 428.441 2.343 10 20 IECD CN1CCC(N(C)[C@H]2CCCC[C@H]2N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785445899 ZYGCMONUYVQSFO-XZOQPEGZSA-N 443.636 2.164 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3cccc(F)c3)cc2F)CC1 785539880 MKRGXMWVYXTOOP-UHFFFAOYSA-N 430.499 2.082 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCOC[C@@H]1CCCO1 785562712 OWFQKOWYYZORHU-INIZCTEOSA-N 443.338 2.205 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc(OC)c3OC)CC2)cc1 787021354 YIDHBLYJXBTDAM-UHFFFAOYSA-N 427.501 2.068 10 20 IECD CCOc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1OC 789801937 XDBZWWUADOYFOQ-UHFFFAOYSA-N 445.491 2.002 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3nccs3)cc2F)C[C@@H](C)O1 789828736 YFDCGQJPIYCAAN-GASCZTMLSA-N 434.537 2.213 10 20 IECD O=C(NCCN1CC=CCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 792902032 ZJRBQANAENSDRU-UHFFFAOYSA-N 439.539 2.003 10 20 IECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC12CCC2 793723465 XAJFFPPCQCCHDO-IEBWSBKVSA-N 426.561 2.043 10 20 IECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)NC)cc2)cc1OCC 797432440 DSSQLWRWZBQDLA-UHFFFAOYSA-N 429.520 2.161 10 20 IECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803308103 SWBPUXAPBNCROI-UZLBHIALSA-N 439.512 2.349 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCN1C(=O)OC(C)(C)C 807291523 XTYALNWGKADNDO-QGZVFWFLSA-N 428.533 2.147 10 20 IECD CCN(CCS(C)(=O)=O)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807951670 DJYRHXLLFLDPOT-OAHLLOKOSA-N 443.997 2.086 10 20 IECD C[C@@H]1SCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@@H]1C 808854958 ORKYOFRXRRDBLA-MSOLQXFVSA-N 430.618 2.187 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3COc4ccccc4[C@@H]3O)cc2F)CC1 812033533 XXHNUWSVMGHMEC-KNQAVFIVSA-N 428.508 2.261 10 20 IECD CCOC(=O)C(CC)(CC)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 817082110 MZJDLUBIDMTSJN-SEYXRHQNSA-N 431.533 2.138 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CCCN3C(=O)C(C)(C)C)CC2)cc1 914719504 MQAMLSGIRJRSAM-NRFANRHFSA-N 430.593 2.361 10 20 IECD CCCC(=O)NC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 917055569 OWBCMTYSPANLAP-ROUUACIJSA-N 448.583 2.436 10 20 IECD Cc1cc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)n([C@@H]2CCS(=O)(=O)C2)n1 917075192 SCLDWZGDBCNDOG-HXUWFJFHSA-N 447.605 2.466 10 20 IECD Cc1nn(C)c(C)c1CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 919025065 VTFNKLXWJCANPD-HUUCEWRRSA-N 446.523 2.192 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](c3ccsc3)N(C)C)CC2)cc1 920254640 LYPCSYCCGWGJBI-HEDKFQSOSA-N 442.585 2.381 10 20 IECD CCOC(=O)c1ccn(-c2cccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2)n1 1116445981 FNBKWLSQTNGBLM-UHFFFAOYSA-N 444.469 2.378 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)cc1 1777847434 AYRCUXSMVDXYHI-NTKDMRAZSA-N 439.512 2.171 10 20 IECD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccn1 1782008328 ZSINLZATJIWMMA-JLCFBVMHSA-N 445.903 2.393 10 20 IECD CCOc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810549355 NCENIJMMDCBLLZ-UHFFFAOYSA-N 440.500 2.445 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc(O)ccc3O)CC2)C1 1810554321 LQKMXJXGOUDMCP-UHFFFAOYSA-N 427.457 2.063 10 20 IECD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccn1 1827067397 VKBJTOGQBFKEGV-AAEUAGOBSA-N 439.497 2.374 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1 1829722809 BULYTCQDZXRNOV-QGZVFWFLSA-N 426.473 2.141 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc(C3CC3)on2)C1 1841176620 OTMFRFOLBFIQRP-UHFFFAOYSA-N 433.468 2.162 10 20 IECD C/C=C/C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843331441 YCOMWKZTVVPQCO-WSSFADSRSA-N 442.560 2.484 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cnc3ccccc3n2)C1 1843622067 BLECJCMAHVWKNO-VQHVLOKHSA-N 446.463 2.277 10 20 IECD CN(C)c1ccc(CNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)cc1 15135058 KHLXMTYALOZFCN-UHFFFAOYSA-N 440.363 2.500 10 20 IECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)c1 21998405 FTKMVUZWLKRCLR-UHFFFAOYSA-N 447.538 2.295 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc4c(c3)COC4)CC2)cc1 727834068 DOONLXPAFHPMGO-UHFFFAOYSA-N 431.558 2.216 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1F 731346315 UYALNENKBZZFAN-UHFFFAOYSA-N 439.509 2.216 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H](C)CS(C)(=O)=O 732993181 CFOPONBGFDIRGB-PMPSAXMXSA-N 429.558 2.404 10 20 IECD COCCNS(=O)(=O)c1cccc(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)c1 735509332 XHOLGTRKRDTGAY-UHFFFAOYSA-N 429.882 2.168 10 20 IECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3cnc[nH]3)cc2)cc1[N+](=O)[O-] 736538640 AFICLHMCHZLEPN-UHFFFAOYSA-N 437.459 2.228 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(OCCN(C)C)c1 739084029 YJSFSBUKRSDROM-UHFFFAOYSA-N 440.544 2.027 10 20 IECD CN(C)CC(C)(C)CNC(=O)C1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 741806884 QXAGXGSEBLLAFW-UHFFFAOYSA-N 445.652 2.127 10 20 IECD NC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742333912 ACWKRTZBJDRFSA-AWEZNQCLSA-N 425.457 2.334 10 20 IECD O=C(NCCNC(=O)c1cccnc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745491219 IOOURWHSZBGUQC-INIZCTEOSA-N 433.459 2.381 10 20 IECD COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NCc3ccccc3O)cc2)C1 748444105 VLQYWMSLMSORPG-INIZCTEOSA-N 447.513 2.288 10 20 IECD CN(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1ccc(F)cc1 748963352 ZXHKYHKTJWCULB-FQEVSTJZSA-N 441.551 2.459 10 20 IECD O=C(NCCCSc1nccs1)NCCC(=O)N1CCN(c2ccccn2)CC1 759574993 MTCVVPPXPJZEDZ-UHFFFAOYSA-N 434.591 2.058 10 20 IECD COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc(C(=O)OC)c1 759595030 PHPAAICHIOVYLB-HWPRWLFBSA-N 443.408 2.255 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(C3CCN(c4ccc(OC(F)F)cc4)CC3)C(=O)[C@@H]2C1 761158208 JJPAMMUVUDGIJC-DYVFJYSZSA-N 437.443 2.473 10 20 IECD COc1ncc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C(N)=O 762226700 XJGVUSWTHHXAGG-BETUJISGSA-N 431.468 2.264 10 20 IECD COc1cc(N2C[C@@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)cc(OC)c1OC 763279642 NHPHYGALBQQQSL-ZFWWWQNUSA-N 444.484 2.224 10 20 IECD COc1cc(O)c(CN2CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)cc1OC 768443598 HFZYYBXKCXCXBR-OAHLLOKOSA-N 437.537 2.262 10 20 IECD Cn1nc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 773471705 BWHZJUBTSUWWJG-SFHVURJKSA-N 434.544 2.317 10 20 IECD CC[C@H](C)[C@@H]1NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777616591 RJZSKXKHHLJEBC-KXBFYZLASA-N 426.496 2.409 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](CN(C)CC4CC4)C3)CC2)cc1 778299641 LOZQIBMVKAEJJR-LCCNJJIFSA-N 440.588 2.090 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(-c3ccccc3)nc2)cc1C(=O)O 780387762 QKIZYZNKNZLYDT-UHFFFAOYSA-N 448.482 2.014 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](O)[C@H]3C(=O)OC)c2C)cc1 781956823 BAYDMNFWVCJMHZ-CTNGQTDRSA-N 428.485 2.062 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)c(OC)c3)CC2)cc1 782106339 NBWCFAFONZJHPA-UHFFFAOYSA-N 444.507 2.110 10 20 IECD Cc1ccc(OCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 785481205 HBIGQMTWWLFUDJ-UHFFFAOYSA-N 429.492 2.091 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(F)CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 786262847 QJVVKQQNIZKCAD-QHCPKHFHSA-N 448.539 2.320 10 20 IECD C[C@H](NC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 787092372 BGIQCDLVQUXZKY-INIZCTEOSA-N 440.519 2.490 10 20 IECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788008648 QHBISQQVYCCAPC-UHFFFAOYSA-N 428.577 2.446 10 20 IECD O=C(NCCOC(F)(F)F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 788747438 AWHSMYJWTLWFFA-UHFFFAOYSA-N 442.417 2.278 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C 789778958 WKYNPYCJHGGZJK-LLVKDONJSA-N 430.411 2.462 10 20 IECD C[C@H](N[C@H](C)c1nnnn1C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 790554289 IXYBMENHQWFSMV-OLZOCXBDSA-N 430.468 2.461 10 20 IECD CCOC(=O)N1CCC(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 802997663 IJWAJIMFHMVGDY-UHFFFAOYSA-N 434.518 2.170 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](SC)C(C)(C)C)cc2F)CC1 805007928 VKAWNDLGTIPQBS-IBGZPJMESA-N 438.613 2.478 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)n3ccc4ccccc4c3=O)nc12 805630170 RZCZNAVULRBVRF-ZDUSSCGKSA-N 436.424 2.231 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2nc(F)c(F)cc2F)CC1)c1ccc(N(C)C)cc1 807672388 YNSMYKMCPAEYSQ-ZDUSSCGKSA-N 435.450 2.091 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)[C@H]3CN(C)CCO3)cc2Cl)C1 807956713 ROKOOEUSAJRFGY-JXXFODFXSA-N 436.984 2.028 10 20 IECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 808095026 PASSKXOSBHACPC-SFHVURJKSA-N 443.500 2.044 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 808619336 YLMAQMHCJSTQTO-LJQANCHMSA-N 446.910 2.391 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 808622951 YWBUAAINWXQQQV-LJQANCHMSA-N 446.910 2.425 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)c4ccc(CC)cc4)CC3)nc12 917102468 YXWOPXZHMDWZDH-UHFFFAOYSA-N 437.500 2.132 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 918368965 BZLGBBVKFRNKLN-UHFFFAOYSA-N 442.472 2.081 10 20 IECD CSc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918463203 IQPAUCZEBMGQGM-MRXNPFEDSA-N 426.542 2.365 10 20 IECD CCO[C@H](C)c1noc(CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1324752708 RGPOSXLDUBBZLH-GOSISDBHSA-N 446.571 2.376 10 20 IECD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)c1ccccn1 1784657556 RXQAJZHMQKHJCY-JLCFBVMHSA-N 445.903 2.393 10 20 IECD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c(C)o1 1785508623 HWVRBSJHZJGMKW-DOHLAZSCSA-N 442.468 2.170 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC=CCC3)C[C@@H]21 1792218327 YIZURCFWCCVZKI-BKYPUVBMSA-N 442.512 2.153 10 20 IECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)N1C[C@H]2C[C@@H]2C1 1800718445 YNENQVZHHNNNFZ-JWQALPOXSA-N 433.936 2.343 10 20 IECD CCn1nc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cc1C 1810547283 WBXHLHUINVKYSA-UHFFFAOYSA-N 427.505 2.176 10 20 IECD O=C(CCc1cccnc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722607 QQWUNXDGGGRQEE-CQSZACIVSA-N 439.497 2.203 10 20 IECD O=C(Cc1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429435 VJDBXUVUVOQMNC-IBGZPJMESA-N 440.500 2.069 10 20 IECD CC(=O)O[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C(C)C 1828767151 IOTAFTYUZWMGKE-RXVVDRJESA-N 447.532 2.314 10 20 IECD Cc1nc(F)ccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844577423 DLSWJFHTZZOMNW-XBXARRHUSA-N 427.432 2.176 10 20 IECD O=C(c1cnnc2ccccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037786 UARUBYHFNHOIQQ-VQHVLOKHSA-N 446.463 2.277 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 110465144 QHHKESPGLMTMJX-UHFFFAOYSA-N 446.573 2.213 10 20 IECD CN1CCN(C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 727843113 SFHLYMIDLILRQT-DEOSSOPVSA-N 437.588 2.311 10 20 IECD CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 729227544 VJIWTOCIFATHRJ-HXUWFJFHSA-N 432.546 2.121 10 20 IECD CON(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731858854 OUINEDKGRCRYRS-GOSISDBHSA-N 434.514 2.396 10 20 IECD Cc1nn(C(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 734491872 ROASVTKICXZWAQ-GOSISDBHSA-N 433.578 2.261 10 20 IECD CCOC(=O)C1CCC(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 743363536 STAMFUAPRNJQJF-UHFFFAOYSA-N 432.565 2.238 10 20 IECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 749639922 OCKCDKXECYFRDG-UHFFFAOYSA-N 444.557 2.476 10 20 IECD COCC[C@H](Cc1ccco1)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 752871982 PVUBBPKWKDDDNO-ZBTAVZRMSA-N 441.528 2.257 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@](C)(c4ccccc4)C3)CC2)cc1 754062802 WLEWZDIACCSFOK-UKILVPOCSA-N 425.573 2.426 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNC3(c4ccccc4)CCOCC3)CC2)cc1 754070556 ZUGIVKKYUNMCBV-HSZRJFAPSA-N 425.573 2.474 10 20 IECD CNS(=O)(=O)c1cc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1C 756335748 JGILSZBYQTYVIU-IBGZPJMESA-N 447.557 2.228 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](c3cccc(F)c3)N(C)C)CC2)cc1 758187988 WNAOKKPXDXNPKA-UPVQGACJSA-N 430.568 2.210 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc(N2CCOCC2)cc1 759030882 ZLNSUXFQKGLIGA-SFHVURJKSA-N 448.527 2.173 10 20 IECD COc1cc(N2CCN(S(=O)(=O)C3Cc4ccccc4C3)CC2)cc(OC)c1OC 759099527 FXZVPTGQRHHLNV-UHFFFAOYSA-N 432.542 2.332 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765925203 FSFJDVXIAPSKQR-UHFFFAOYSA-N 437.246 2.205 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc2[nH]ncc2c1 769026671 ZUEICCKNGQIMSB-UHFFFAOYSA-N 432.528 2.350 10 20 IECD CC(C)N(C)C(=O)C1CCN(C(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 775254118 HCMYPDJOLBLCKA-LJQANCHMSA-N 430.593 2.279 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc(N4CCOC4=O)cc3)nc12 775263532 TXFDWMOBOUAPHG-CYBMUJFWSA-N 425.445 2.419 10 20 IECD Cc1sc2ncc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c(=O)n2c1C 775665631 GXCRFTLWOWZGJC-MRXNPFEDSA-N 439.541 2.005 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cn4c(C)cccc4n3)CC2)cc1 778270004 YECWSYLCGXPWQW-ZHACJKMWSA-N 433.512 2.173 10 20 IECD COC(=O)[C@@H]1CN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c2ccccc2O1 783317315 PIZRVUJCENZGHN-NRFANRHFSA-N 439.512 2.457 10 20 IECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc21 785293248 FPBHUBMIFCKTTA-CQSZACIVSA-N 425.485 2.473 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3C[C@@H](O)C[C@H]3C)c2C)c1 788274734 AFWYZJAWTHQFNX-YJYMSZOUSA-N 428.485 2.305 10 20 IECD Cc1ncsc1CN(C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822545 XCJWBFGVVSWDRT-ZIAGYGMSSA-N 434.537 2.479 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789868734 OZOHRHBZDJIPGJ-UHFFFAOYSA-N 431.558 2.433 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC(C)(C)O1 789948505 BKERCHGKUMMRNZ-CQSZACIVSA-N 443.466 2.184 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC[C@@H]1CCSC1 789954726 LARVUTCZYGLNIM-ZDUSSCGKSA-N 431.480 2.028 10 20 IECD O=C(COC(=O)[C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)NCc1ccc(N2CCOCC2)c(F)c1 796317107 HLAGKXRGCBUFDY-ONUIRIBTSA-N 440.515 2.216 10 20 IECD Cc1ccc([C@@H]2COCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 803302851 CUNRYRSHRNIFBR-PXNSSMCTSA-N 427.501 2.202 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@H](C)c3cccc(C)c3)CC2)cc1 803749575 PWJZUUSLTXQPQC-FQEVSTJZSA-N 438.572 2.162 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 804319103 YRWQNKBDFOCLCS-UHFFFAOYSA-N 426.517 2.280 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCO[C@H](C(C)(C)C)C3)cc2F)CC1 805008278 IOICRNYMZMXZRP-NQIIRXRSSA-N 448.583 2.294 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](C)C[C@@H]3C)CC2)cc(OC)c1OC 806192039 PSHMDMVSQSHFQB-SOLBZPMBSA-N 433.549 2.302 10 20 IECD NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 810368400 VMHJEPFHAKJXTG-UHFFFAOYSA-N 444.438 2.061 10 20 IECD CNS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 1116670148 YJXZOJRFWNQYOO-JTQLQIEISA-N 443.319 2.129 10 20 IECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)Nc2c(Cl)ccc3nonc23)C1=O 1342953259 VMQRZIMRPHSIQE-LJQANCHMSA-N 429.820 2.291 10 20 IECD Cc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004614 IHRHQHJUUJKEEB-NRFANRHFSA-N 431.876 2.212 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccccc1 1795438614 GWTFAWJOFFVYJT-CBOOJTBASA-N 436.464 2.338 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3ccnnc3)C2)CC1 1808185411 XMKPNEXBILAELI-HWKANZROSA-N 438.484 2.152 10 20 IECD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)cn1C 1816724762 GUNFOMZNPDIRTQ-CYBMUJFWSA-N 427.486 2.136 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncc[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818145959 OROUNZRZBUONST-KRWDZBQOSA-N 446.471 2.232 10 20 IECD CC[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1824081107 XYXMFVMCQSGKHG-RTWAWAEBSA-N 440.544 2.170 10 20 IECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1825895133 YELWPJWHKJMNRQ-GOSISDBHSA-N 427.505 2.082 10 20 IECD O=C(c1ccc(O)c(F)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038435 QWWGYXYYDRKSEM-QPJJXVBHSA-N 428.416 2.179 10 20 IECD O=C(c1cccc2c1CCCC2)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056689 XGQZVEMBPDXIQN-UHFFFAOYSA-N 443.594 2.243 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(c2ccccc2F)C1=O 303571880 YOZNMBQCTCUAET-SFHVURJKSA-N 430.455 2.406 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2OC(F)(F)F)SC1=S 727175853 BHAAFSHSIFYGTA-DHZHZOJOSA-N 426.463 2.336 10 20 IECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)c1 734016909 NFUWLEWOFRQVOO-UHFFFAOYSA-N 439.921 2.166 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 746792412 DHPHSGWDQTYNSB-MRXNPFEDSA-N 425.485 2.434 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CS[C@@H]2CCS(=O)(=O)C2)cc1 747481552 OAOOSZQKODHQRZ-RTBURBONSA-N 426.604 2.181 10 20 IECD O=C(NCCc1nnc2ccccn12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748041084 VAVMBRWOEDLMOB-UHFFFAOYSA-N 443.510 2.270 10 20 IECD O=C(Cc1cccc(F)c1)NCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 749014338 IXJCMSIFTQGDEK-UHFFFAOYSA-N 442.535 2.193 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2cc(OC)ccc2O)c(Br)c1 751419811 XMUFVNHETLTXDG-UHFFFAOYSA-N 430.276 2.428 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3nccn3CC(F)(F)F)CC2)cc1 754027373 IJGFKXZAAHAKES-GOSISDBHSA-N 441.498 2.069 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CC2)cc1F 754214489 LTJOAKNUYHZGHB-UHFFFAOYSA-N 432.408 2.038 10 20 IECD C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 755249427 QEOAVFOGLRWTOW-MRXNPFEDSA-N 433.578 2.172 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)cc1 759597270 QHGKTABBPVLJIW-SDQBBNPISA-N 448.497 2.323 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 762656024 CKCFHBSSNHXGHT-VAWYXSNFSA-N 446.511 2.334 10 20 IECD O=C(COC(=O)CCCCc1cnn[nH]1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 768509431 JVEVLSOUSFFCTE-UHFFFAOYSA-N 432.436 2.475 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3nc(C4CCCC4)no3)nc12 770051087 BQHVNPNNLLJACI-UHFFFAOYSA-N 429.433 2.328 10 20 IECD CC[C@]1(CO)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 784721733 NPVCYGSLNXHSBQ-HXUWFJFHSA-N 449.485 2.478 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccnc(N2CCOCC2)c1 787191787 UVOOXXDCGJWSEA-UHFFFAOYSA-N 426.517 2.069 10 20 IECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1ccccc1F 788320229 NUYUZSBFOSTZKX-LJQANCHMSA-N 429.492 2.252 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccccc2N2CCOCC2)C2CC2)cc1 788337645 YQMJEANULZDHTM-UHFFFAOYSA-N 436.556 2.397 10 20 IECD CCOC(=O)c1c(NC(=O)CN2C[C@H](O)C[C@@H]2C(=O)OC)sc(C)c1-c1ccccc1 788604982 YHCFPCFGHHTSJE-HZPDHXFCSA-N 446.525 2.447 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C4CCOCC4)C3)cc2F)C[C@@H](C)O1 789823728 FNHNKYDVDSQORR-MBOZVWFJSA-N 447.551 2.331 10 20 IECD C[C@H]1COc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789846010 YOVWFROEWPSTBV-INIZCTEOSA-N 441.503 2.213 10 20 IECD COC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1OC 790140789 YAYBRLQYZYLSTM-SFHVURJKSA-N 430.501 2.052 10 20 IECD COc1cncc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 791700207 KKTCUBDCILQRBB-LBPRGKRZSA-N 431.404 2.445 10 20 IECD CC1CCC(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)CC1 803310146 DKQXFAOUQXRGAI-SNCIUUNGSA-N 442.604 2.423 10 20 IECD C[C@H](OC(=O)[C@H](O)c1cccnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954874 ZWWAFVJDHJTFFS-RNODOKPDSA-N 430.416 2.461 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 807288675 ZKWUSWZKGXTIGA-KRWDZBQOSA-N 425.920 2.123 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ncn(Cc2ccccc2)n1 807387743 UVTPAGJPWFQIAK-UHFFFAOYSA-N 430.262 2.049 10 20 IECD C[C@H](NC(=O)C(=O)NCC1(CN2CCOCC2)CCCCC1)c1ccc(N(C)C)cc1 807670719 HHWHVFAEVJGOIP-IBGZPJMESA-N 430.593 2.329 10 20 IECD CCO[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771000 QRGAYQSPFUYLDO-QAPCUYQASA-N 425.476 2.401 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O 808543561 XMWFEGFOIDMJCV-LJQANCHMSA-N 438.528 2.031 10 20 IECD CNC(=O)Oc1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 817021910 AGEBENFAGCEXDI-KHPPLWFESA-N 438.484 2.257 10 20 IECD COc1ccc(OC)c([C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918211513 DJMKRDCQNSGYAK-FQEVSTJZSA-N 433.480 2.212 10 20 IECD COc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1OC(F)F 918643730 NNIJXNQFNNLDHP-UHFFFAOYSA-N 440.468 2.461 10 20 IECD CCOc1ccc(N2CCN(CC(=O)Nc3cc(-n4nnnc4C)ccc3F)CC2)cc1 1323177642 OYIRJARTTMIWJT-UHFFFAOYSA-N 439.495 2.269 10 20 IECD C[C@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CC1 1777851619 LMXGSTGCXLBLLK-RSZAZKGPSA-N 431.533 2.447 10 20 IECD Cc1nc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)o1 1779585896 MRSJHQCDKSSYBE-FQEVSTJZSA-N 435.864 2.113 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)[C@@H]1CCC=CO1 1788583129 HZNKBYPPQFUTAS-ZUXXIDCJSA-N 436.892 2.037 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)c2cc[nH]n2)CC1 1824673902 NLVUXBJYSMWVDA-SUQGKYDKSA-N 440.500 2.473 10 20 IECD O=C(c1ccnc(Cl)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039236 XKDGMZZFMCIMNH-HWKANZROSA-N 429.860 2.382 10 20 IECD COc1ccc(N2CCCN(C(=O)c3ccc(OC)c(S(=O)(=O)N(C)C)c3)CC2)cc1 108428198 UYLYDXQTLFMOLY-UHFFFAOYSA-N 447.557 2.307 10 20 IECD C[C@H](c1ccccc1)N(CCn1cnc2c1c(=O)n(C)c(=O)n2C)Cc1ccccc1O 216485149 GICFVLQRGZKYNY-QGZVFWFLSA-N 433.512 2.403 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)n(C)c2ccccc12 472811748 OSUGLQKFAWGBAI-UHFFFAOYSA-N 429.480 2.347 10 20 IECD COCCOc1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 732390633 VAHMROFCLTUUPP-UHFFFAOYSA-N 428.485 2.226 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)n3cccn3)c2)c1O 737284502 PDJZOEKXXIFJAA-CQSZACIVSA-N 437.456 2.052 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1O 737286385 YFPBOJSPAWKQON-UHFFFAOYSA-N 429.542 2.247 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)Cc2nc3ncccn3n2)NC(=O)OC(C)(C)C)cc1 742749970 KPJJXOZJGXTCAK-KRWDZBQOSA-N 439.520 2.115 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(F)c(-n4nnnc4C4CC4)c3)ccc21 743900576 MMIWQTGTUFDERG-UHFFFAOYSA-N 449.490 2.316 10 20 IECD C[C@H](O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 747390710 WIIWIQTVMNPCFL-PKOBYXMFSA-N 442.539 2.245 10 20 IECD CCCCCC(=O)NC1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 748317059 UBJBMQVKHJEQHL-UHFFFAOYSA-N 448.583 2.439 10 20 IECD CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1F 749772615 ZIFVTCLEXCJWDW-UHFFFAOYSA-N 432.451 2.180 10 20 IECD COC(=O)C(C)(C)[C@H]1CCCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 754097515 OXZULHNASXANSX-PZJWPPBQSA-N 433.593 2.089 10 20 IECD COc1cc(N2CCN(C(=O)NCC3(C(=O)N(C)C)CCCC3)CC2)cc(OC)c1OC 759265078 CMAPSTZDZBFMPP-UHFFFAOYSA-N 448.564 2.193 10 20 IECD COc1cc(N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3N)CC2)cc(OC)c1OC 760090826 WLABHQCFVYJWIC-UHFFFAOYSA-N 430.461 2.474 10 20 IECD C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 766972812 LUAYGAPMQUERAN-NSHDSACASA-N 448.391 2.288 10 20 IECD CCCCCCn1cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c(O)nc1=O 769651643 HUVFVHBMFXPILR-CYBMUJFWSA-N 425.507 2.283 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c(C)n1[C@H]1CCS(=O)(=O)C1 772766110 PUJYWEKQYLDNJH-NBUZRDOWSA-N 433.482 2.315 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC)nc3Cl)cc2F)CC1 774219527 JCNHKDHQBMBYKQ-UHFFFAOYSA-N 449.914 2.280 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1Cl 775089050 ZXASTYUHRGIDRC-NRFANRHFSA-N 444.963 2.212 10 20 IECD Cc1cc(Br)cc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)c1O 775712701 BORSNMCVHQREKY-UHFFFAOYSA-N 448.365 2.412 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN(C)Cc3ccccc3)CC2)cc1 778244011 BKXJPNFPNFLJDZ-SEYXRHQNSA-N 436.556 2.148 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1F 781477071 OQMCFFAMKKCQBJ-UHFFFAOYSA-N 441.463 2.124 10 20 IECD COCCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 786280809 BWOMYXAPNXWSGB-UHFFFAOYSA-N 425.529 2.339 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 788404304 WMPAFUPRGVSWDP-SFHVURJKSA-N 441.528 2.074 10 20 IECD COc1cccc(F)c1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841403 WZORZILHBFOAAM-CQSZACIVSA-N 447.482 2.428 10 20 IECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 793353908 SSNCAXARFHMWRZ-UHFFFAOYSA-N 442.515 2.182 10 20 IECD Cc1ccccc1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793671704 HINZTWQIHUYROR-WIYYLYMNSA-N 436.556 2.060 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)CC2)cc1 794085997 JFJBGINBIOTJHE-FIRMHMECSA-N 439.556 2.460 10 20 IECD CO[C@@H]1[C@H]2C[C@@H]3CN(CC(=O)NCc4ccc(N5C[C@H](C)O[C@@H](C)C5)c(F)c4)[C@@H]1[C@H]3C2 796321062 SKZODCBJKXQWKB-IVIQXFNISA-N 431.552 2.411 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CCO)Cc3ccccc3)CC2)cc1 799811544 KSOVATPAJKEGCY-AXUYNXDZSA-N 437.540 2.010 10 20 IECD Cc1cc(C(=O)COC(=O)CNS(=O)(=O)c2ccccc2N)c(C)n1-c1ccccc1 800235249 SXDMTBASEUIXQP-UHFFFAOYSA-N 441.509 2.381 10 20 IECD C[C@H](NC(=O)C(=O)N(C)CCOc1ccccc1F)c1ccc(N2CCOCC2)cc1 803301874 BAIBZIWXWROQRP-KRWDZBQOSA-N 429.492 2.377 10 20 IECD CO[C@H]1CCC[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451779 WATGBKZCZXRZKB-KDOFPFPSSA-N 425.476 2.304 10 20 IECD COCCN(Cc1ccccc1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317322 ZRYFXURUGAWIIK-UHFFFAOYSA-N 425.529 2.455 10 20 IECD CC(C)(O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 806727455 HHVVHPFIKACJKO-FQEVSTJZSA-N 426.513 2.444 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc2c(s1)CSCC2 806847039 HMONYWNEHGVYDB-UHFFFAOYSA-N 432.571 2.366 10 20 IECD COc1cccc(CNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)c1O 807454394 OZJJVKJOUNXJIK-UHFFFAOYSA-N 448.328 2.485 10 20 IECD Cc1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 808853855 IYGKENDDOIEKEC-UHFFFAOYSA-N 441.601 2.258 10 20 IECD COc1ccc(S(=O)(=O)NCC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1OC 811529359 MKFMATOSWPXITD-UHFFFAOYSA-N 449.312 2.311 10 20 IECD CSC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCN(C)CC1 811944387 TVQQBEXBRYEKRZ-GOSISDBHSA-N 433.622 2.015 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 917356229 ZLPAYVLZCNUDDL-UHFFFAOYSA-N 442.493 2.254 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2 1782009497 WGHAQGFVGNYZLP-HNNXBMFYSA-N 425.215 2.026 10 20 IECD CC[C@H](C)[C@H](N)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787995711 WZKNJLCXCOEWHT-UGSOOPFHSA-N 448.614 2.354 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)C1=NO[C@H](c2ccccc2)C1 1796600954 VDOWWLBQXQSLOW-ZMMAXQRCSA-N 436.468 2.262 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cccc(F)n1 1796934965 XZJOOLKRQCXRKO-ACHSLPGTSA-N 435.459 2.265 10 20 IECD O=C(c1ccnc(Cl)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428105 HVMFQGKHAKXONR-INIZCTEOSA-N 445.907 2.483 10 20 IECD O=C(c1cn[nH]c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832876892 QIIQQWGHHAWDHJ-SUQGKYDKSA-N 440.500 2.473 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cnc3ccoc3c2)C1 1843288041 PXLVNBSKHKNTJC-UHFFFAOYSA-N 443.463 2.438 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C2(C(F)(F)F)CC2)C1 1843947297 OMVRBEAKTJCKAK-HWKANZROSA-N 426.391 2.363 10 20 IECD C[C@H](Cc1ccccn1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037560 RYXRTLXKEBTWIP-MNDMWVCDSA-N 437.496 2.294 10 20 IECD CN(C)S(=O)(=O)c1ccc2c(c1)N(S(=O)(=O)c1cccc3nsnc13)CCC2 609984955 MCYLNSPBQSQIRE-UHFFFAOYSA-N 438.556 2.083 10 20 IECD COc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1OC(F)F 727177806 OGUZZKRREJLLAS-XYOKQWHBSA-N 438.499 2.047 10 20 IECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 729532064 RUZDHTXFVBRRIA-OAQYLSRUSA-N 435.532 2.069 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nnc2n(C)c(=O)c3sccc3n12 731845067 QEWKJOARQSBTBY-UHFFFAOYSA-N 447.904 2.177 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc(C4CC4)nc3)cc2F)C[C@H](C)O1 737108433 WMGIGKVNCIWSGW-KBPBESRZSA-N 427.480 2.362 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 742800679 KPHLGASLEJWQIQ-ZDUSSCGKSA-N 430.411 2.217 10 20 IECD CCN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCS(=O)(=O)C1 745903607 HTNBTRPKBODMHQ-GOEBONIOSA-N 431.505 2.475 10 20 IECD CN1CCC(O)(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 747412817 UKEHZUYAXNLOMQ-QINSGFPZSA-N 439.628 2.302 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)NCc3ccc(N4CC=CC4)cc3)cn2)C[C@H](C)O1 747570756 KHVMCGCYWCZBIT-ROUUACIJSA-N 438.532 2.217 10 20 IECD C[C@H](NC(=O)c1ccco1)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 748737458 ABZHTYCQQPTOIE-ZDUSSCGKSA-N 446.415 2.355 10 20 IECD Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 760098397 YKSDNDKNTNZYLO-DENIHFKCSA-N 449.555 2.079 10 20 IECD CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 764923941 GPXKBNCWTNUKSE-QGZVFWFLSA-N 437.512 2.305 10 20 IECD COC(=O)[C@@H](COC(C)C)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767116060 RDHOTQQPUCDRSH-HXUWFJFHSA-N 438.480 2.299 10 20 IECD CNC(=O)Cn1nc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C 767965105 HRKOGFWKUQQBDU-HUUCEWRRSA-N 432.500 2.012 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cc(Br)ccc2O)CC1 768208143 NZPAFRCBEMDZLW-UHFFFAOYSA-N 430.324 2.266 10 20 IECD Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NCCc1ccc(O)c(O)c1 770629265 HVDJOPHJBFDQPL-UHFFFAOYSA-N 430.482 2.450 10 20 IECD O=C(CN1C(=O)NC2(CCCCC2)C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771052588 IDWUOKRBADIHNQ-KRWDZBQOSA-N 448.951 2.381 10 20 IECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(Cc1ccc(N(C)C)cc1)C(C)C 771790601 FGKKGBADWCBKBF-UHFFFAOYSA-N 434.562 2.258 10 20 IECD CCc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)N(C)C)cc1 774946434 IWFBBUWEJFHMOP-QHCPKHFHSA-N 438.572 2.121 10 20 IECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2cc(Cl)cc(F)c2O)CC1 775644720 ORUGLRXZFBTIRT-UHFFFAOYSA-N 440.884 2.273 10 20 IECD C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 775836047 XUKJOAQNVGDNMD-KRWDZBQOSA-N 446.573 2.063 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccc(CO)cc3)CC2)cc1 776036883 AOOXYKXRPOZNCV-UHFFFAOYSA-N 426.561 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCC(Oc4cncc(Cl)n4)CC3)CC2)cc1 778186412 UFGUFXUIAQKLFB-UHFFFAOYSA-N 445.951 2.331 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cc(F)cc(OC)c3)CC2)cc1 778421919 IWCJPBSNSCIHFL-FPLPWBNLSA-N 427.476 2.364 10 20 IECD CS(=O)(=O)c1cccc(Cl)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 784066885 BTHTWEFULAWGDI-OAHLLOKOSA-N 449.960 2.375 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 785299004 YHDHAMQBEXNANZ-LLVKDONJSA-N 431.876 2.329 10 20 IECD O=C(OCCn1ccnc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398623 KZZNRRHBLQFPNI-UHFFFAOYSA-N 432.414 2.155 10 20 IECD COc1ccccc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1nccn1C 785648266 YVUMPPGSVNQMGQ-JOCHJYFZSA-N 445.523 2.327 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1F 785870686 OMJLSUSALHZEAC-IRXDYDNUSA-N 436.572 2.292 10 20 IECD CC(C)(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789841213 UODSCMZWIVHDHC-UHFFFAOYSA-N 435.540 2.209 10 20 IECD CC(C)[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793717123 GYELERBBPTYXAX-AQNXPRMDSA-N 428.577 2.336 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCCC3CCCC3)cc2)C1 793722686 VTEVHPCBUHHKRR-FQEVSTJZSA-N 428.577 2.481 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc4c3OCCCO4)CC2)cc1 793751311 XBSDDAARMQOHBF-UHFFFAOYSA-N 439.512 2.258 10 20 IECD CN1CCC(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 803376503 FDLDQWFZRZQXIF-QGZVFWFLSA-N 438.519 2.221 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3c(C)noc3C)cc2F)CC1 805009320 HJOXYEUKBNIDRY-AWEZNQCLSA-N 431.512 2.066 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](N4CCCC4)C[C@H]3C)CC2)cc1 806333027 DAVYYRHTAVQDTM-IFMALSPDSA-N 429.609 2.476 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(c2nnc3n2CCCC3)CC1 807290348 VCASCKNWNFCMQV-UHFFFAOYSA-N 434.544 2.013 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCN(C2CCC2)CC1 807771214 TVGOPJSBJQFZPK-INIZCTEOSA-N 436.503 2.070 10 20 IECD Cc1cc(C(=O)O[C@@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)c(C)n1-c1ccccn1 914903882 SVJSPHYLNUUYAN-KNQAVFIVSA-N 447.557 2.364 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)OCCO4)cc2)C1 918001889 YOVACGCDGFLSEU-LJQANCHMSA-N 438.528 2.201 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C(=O)c2ccco2)CC1 918199603 KDXORENQVFPYCX-UHFFFAOYSA-N 444.507 2.484 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 918437849 ALLVDVUWVBRZCF-UHFFFAOYSA-N 438.553 2.387 10 20 IECD CN1CCN([C@@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2)c2cccs2)CC1 919790150 MYZGEJACMQOYOD-NRFANRHFSA-N 443.617 2.373 10 20 IECD COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1NS(C)(=O)=O 919791664 BZAGFDXXFPXDFH-UHFFFAOYSA-N 434.518 2.225 10 20 IECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920925792 LTFKFLJIQCSQPG-AWEZNQCLSA-N 444.919 2.352 10 20 IECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)N4CCOCC4)CC3)cc2)CC1 1251713497 KQFJCBUTRKQPPG-UHFFFAOYSA-N 429.565 2.202 10 20 IECD Cn1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc(Br)c1C=O 1318859267 MAAXDMDGYDXYLJ-CQSZACIVSA-N 447.333 2.232 10 20 IECD O=C(Cc1coc(-c2ccccc2)n1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1334558713 QCUCXXWVPZFPOR-UHFFFAOYSA-N 425.510 2.435 10 20 IECD CCO/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1782380722 KTPCBSXOTVJXFW-RLPYETMNSA-N 438.908 2.429 10 20 IECD CCn1nc(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932016 ZLDVKMPNNFIYIH-GGPHIMKMSA-N 448.527 2.256 10 20 IECD CN(C)CC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811798609 SCMLMJVRNJTLLB-IFXJQAMLSA-N 432.908 2.027 10 20 IECD O=C1CC(C(=O)N2CCCC23CN(C(=O)C2(C(F)(F)F)CC2)C3)=NN1c1ccccc1 1843441996 ZRPFEYDNPINXHB-UHFFFAOYSA-N 434.418 2.325 10 20 IECD C/C(=C\c1cccnc1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442369 KYIHOBLNLZWYPH-QGOAFFKASA-N 443.507 2.481 10 20 IECD Cc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1 1846814284 NRSOCHVYBMFWDY-UHFFFAOYSA-N 437.974 2.326 10 20 IECD Cc1csc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)c1 1848202190 PSFIPWUCCKLIIX-GJZGRUSLSA-N 437.612 2.051 10 20 IECD NS(=O)(=O)c1ccc(NNC(=S)Nc2cccc(Br)c2)c([N+](=O)[O-])c1 16941852 ZGJYOUFNMPXONT-UHFFFAOYSA-N 446.308 2.318 10 20 IECD CCc1ccccc1NC(=O)CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 23299587 BJXOGXFNXKRCQM-UHFFFAOYSA-N 437.588 2.188 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C(=O)c2cccc(F)c2)CC1 195564524 FZYAVOPRDIYIHA-UHFFFAOYSA-N 444.482 2.469 10 20 IECD COC(=O)CN1CCN(c2ccc(NC(=O)NCc3ccc(N(C)C)cc3)cc2)CC1 728938613 SRZAPJBTFQYZMS-UHFFFAOYSA-N 425.533 2.369 10 20 IECD CC1CCN(c2ccc(CNC(=O)CCN3CCN(C(=O)[C@H]4CCCO4)CC3)cc2)CC1 732093634 KHLVBIAUQSRHES-HSZRJFAPSA-N 442.604 2.252 10 20 IECD C[C@@H](NC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1)c1ccc(N2CCOCC2)cc1 732571481 DSUFQGJORJMILL-IEBWSBKVSA-N 437.544 2.261 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 735200598 WKRIUBLPBJIPFE-SSEXGKCCSA-N 431.558 2.211 10 20 IECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc(Cl)ccc3-n3cnnn3)c2)CC1 739768056 JXWHKMDVUNOPPM-UHFFFAOYSA-N 425.880 2.270 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C3)nc12 740880060 SDIJOGJVEOXOKO-BBRMVZONSA-N 433.509 2.347 10 20 IECD COC(=O)C[C@H]1C(=O)NCCN1CC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 746870528 FOMCDLWHOMHODY-IBGZPJMESA-N 429.542 2.362 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCN(S(=O)(=O)c4ccc(F)cc4)CC3)ccc21 746981581 WYONCFYLQDCBKU-UHFFFAOYSA-N 446.548 2.424 10 20 IECD CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)=NN1c1ccccc1 750866893 ISSKBTCQGVHRFX-XXBNENTESA-N 447.539 2.228 10 20 IECD COc1cc(N2CCN(C(=O)NCCNC(=O)c3cccs3)CC2)cc(OC)c1OC 759224046 AWPXTLYDMSMTKM-UHFFFAOYSA-N 448.545 2.036 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CC[C@H](CO)CC1 759570448 OQCUNCAKQHWCQF-UAPYVXQJSA-N 442.539 2.293 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 762634936 DHYYPGLOCQBJMS-PBYQXAPXSA-N 430.526 2.417 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC(C(F)F)C1 764720133 UWFVYIJPTGKBNE-UHFFFAOYSA-N 427.385 2.438 10 20 IECD O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NCc1ccc(N2CCCCC2)cc1 765306084 BFCWURWVGIKTAO-UHFFFAOYSA-N 436.560 2.212 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1F 765925575 IOPHNLLZRIWNCT-UHFFFAOYSA-N 438.253 2.251 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccccc3NC(C)=O)CC2)cc1 769477110 JVKSTDBOOCKPBY-UHFFFAOYSA-N 425.485 2.088 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C4(C)COC(C)(C)OC4)n3)CC2)cc1 771058920 WOUGWDJKANEKAB-UHFFFAOYSA-N 430.505 2.010 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnc4sc(C)cn4c3=O)CC2)cc1 771600790 BSWNEXIYOFVQLJ-UHFFFAOYSA-N 441.557 2.015 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(CS(C)(=O)=O)cc1 777827176 XHLQVFOLHDFZFF-UHFFFAOYSA-N 425.890 2.406 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1 788585475 VNYHJDPBVJMISO-SJLPKXTDSA-N 436.503 2.116 10 20 IECD CCn1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 789820357 PXWPZPPFDNPGBE-HUUCEWRRSA-N 445.539 2.205 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)cc2F)C[C@@H](C)O1 789825274 LHAWEPCWMXYNMU-MKXGPGLRSA-N 448.583 2.292 10 20 IECD COC(=O)c1cnc(NCCCN2CCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 790094818 NFXWKMZQYTYHEQ-UHFFFAOYSA-N 429.477 2.409 10 20 IECD Cn1c(=O)c2c(ncn2CCNc2ccc(Cl)cc2C(=O)c2ccccc2)n(C)c1=O 797668611 VKXRJUQTVVKACZ-UHFFFAOYSA-N 437.887 2.430 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccc(-n3cncn3)cc2)C2CC2)c1 802267198 LTKZIJBNQRMWJG-UHFFFAOYSA-N 427.486 2.149 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CCCC2)CC1 805158182 LJFFUIIPEXVCCH-SFHVURJKSA-N 430.593 2.470 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccnc(OC2CCOCC2)c1 805541810 VZKKWDFKSXDDNO-UHFFFAOYSA-N 427.501 2.400 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1)c1ccc(N(C)C)cc1 807678865 LLFNOZXZJVMHDI-INIZCTEOSA-N 429.952 2.323 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCCc5nn(C)cc54)n3)CC2)cc1 809464678 KFQPFMPHXAIUHD-GOSISDBHSA-N 436.516 2.171 10 20 IECD COC(=O)[C@@H]1[C@H]2CN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C[C@H]21 813586681 VFKXVYWDIZQQCF-QLPKVWCKSA-N 427.423 2.102 10 20 IECD CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917833869 UMJDGQQBRACTGB-QGZVFWFLSA-N 429.542 2.112 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)cc2F)C[C@@H](C)O1 917918351 OLBNQPGTESHHJX-OKILXGFUSA-N 449.504 2.363 10 20 IECD Cc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 918203002 UBNKGFZSKJZISR-UHFFFAOYSA-N 446.498 2.464 10 20 IECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918209739 HAGBOQRAHPSREV-UHFFFAOYSA-N 431.558 2.298 10 20 IECD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442372 DZUSXOYJHIYRFA-UHFFFAOYSA-N 426.473 2.367 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](c3ccsc3)N(C)C)CC2)cc1 920254644 LYPCSYCCGWGJBI-SHBDEGQCSA-N 442.585 2.381 10 20 IECD COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N3CCC(C(N)=O)CC3)c2C)cc1 925670286 JQEKSXHUQAZKKY-MRXNPFEDSA-N 427.501 2.372 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(n4cc(Cl)cn4)CC3)CC2)cc1 1325303949 WPPIIQHLEPOXBY-NRFANRHFSA-N 433.984 2.365 10 20 IECD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1)n1cccc1 1790246098 LUIOWKKLPPPIOQ-DFHZNHDVSA-N 447.919 2.407 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnn(Cc2ccccc2)c1 1796601373 AEHNQLNUDTUWET-ACDBMABISA-N 447.495 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)C1CCC(F)(F)CC1 1804334558 QHAMROWNTHRMTK-BTTYYORXSA-N 445.557 2.310 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)[C@H]1C[C@H]1F 1807821259 WDRMEAPCMZKYDH-UYZIEWPDSA-N 449.486 2.238 10 20 IECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cn1 1807989290 AAHGBIPQXROJII-IERDGZPVSA-N 433.468 2.225 10 20 IECD C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)n1cccc1C=O 1810543475 DYOLEKYGCBHNBI-MRXNPFEDSA-N 440.500 2.213 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1 1814186511 RBCDMHBDJDKJDK-QFBILLFUSA-N 444.582 2.058 10 20 IECD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)ccn1 1819783237 SKMVXRRMICDIRW-OAHLLOKOSA-N 438.444 2.239 10 20 IECD COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(F)c1 1843251136 YXHVRQVTAMJZOT-GQCTYLIASA-N 427.432 2.171 10 20 IECD CN1CCc2cc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)ccc21 1843758100 XOQZOTJSUVGQSM-VMPITWQZSA-N 449.507 2.326 10 20 IECD CCOC(=O)N1CCC(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 28064671 OOUQYLXBCXHLCX-UHFFFAOYSA-N 432.565 2.192 10 20 IECD O=C(CCCc1ccc2c(c1)CC(=O)N2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 729326390 MFRPAUDZXXPXBZ-UHFFFAOYSA-N 441.553 2.055 10 20 IECD COCCCn1c(S)nc2cc(C(=O)NCc3cccc(OC)c3O)ccc2c1=O 729859543 SJMGTXRPTJRSMG-UHFFFAOYSA-N 429.498 2.366 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](O)COc3ccc(F)cc3)cc2F)CC1 730133554 YZOLYPKDQHFRJG-LJQANCHMSA-N 448.514 2.346 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(Cl)cc3OC)CC2)cc1 732923269 RNDZHZUGVMUURT-UHFFFAOYSA-N 439.965 2.458 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734701033 FGYJDRNPFRBPRM-UHFFFAOYSA-N 425.518 2.014 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](C)CS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 734990436 JXOGIFGVKQTEFZ-QGZVFWFLSA-N 432.542 2.462 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c1O 739088235 NOYPEOLXKBBKRC-HZPDHXFCSA-N 427.501 2.265 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](O)c3c(F)cccc3F)CC2)cc1 740909953 MDITUPMVCSGUBM-FQEVSTJZSA-N 434.487 2.128 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)[C@H](O)Cc3ccccc3)CC2)cc1 747394801 UJUNPYCUOPLGNH-HYBUGGRVSA-N 440.588 2.499 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN3C(=O)CC(C)(C)C)CC2)cc1 748230483 QSKMNEIUZLSRMV-OAQYLSRUSA-N 430.593 2.361 10 20 IECD Nc1c(C(=O)OCCCn2cnc3c(N)ncnc32)ccc2c1C(=O)c1ccccc1C2=O 748855051 UYNRBQUDMOTMTI-UHFFFAOYSA-N 442.435 2.013 10 20 IECD C[C@@H](OC(=O)c1ccc(C(N)=O)cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 748888878 FHRNGCGYUYUGOZ-GFCCVEGCSA-N 443.415 2.140 10 20 IECD COCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751237570 QCDJADNJLHEKHM-UHFFFAOYSA-N 434.558 2.399 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1F 753857694 ORMYNGWVZQJESM-UHFFFAOYSA-N 432.521 2.244 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OCC(F)(F)F)cn3)nc12 768919383 XOALEYKEDWVFKY-UHFFFAOYSA-N 440.334 2.305 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CN(C)CCO1 769974201 UCWCZAKVQTYDHM-KSSFIOAISA-N 430.471 2.060 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)cc2)CC1 771196249 GNOPFAQBQOOAFM-UHFFFAOYSA-N 448.527 2.062 10 20 IECD CS(=O)(=O)N1CCN(c2ccc(NCc3cccc(Br)c3O)cn2)CC1 772945811 IINJNZCCKJZKRK-UHFFFAOYSA-N 441.351 2.243 10 20 IECD COc1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 773987622 MURRRRABYSCPSV-MRXNPFEDSA-N 447.557 2.273 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(Br)n1 774166572 QUCFBMBCQPNNRA-UHFFFAOYSA-N 433.306 2.244 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccccc3[N+](=O)[O-])CC2)cc1 778288157 HEPAQRXTLJSJMZ-ZHACJKMWSA-N 438.484 2.167 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3c[nH]nc3-c3ccccc3)cc2)C1 782777854 NOKDZZFDDUNZBC-SFHVURJKSA-N 446.511 2.033 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 782842584 VDOXSAPFNSGROX-GFCCVEGCSA-N 432.424 2.456 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCC(C(=O)N3CCCCCC3)CC2)cc1 784557051 LBYPTFIVFHIRPS-UHFFFAOYSA-N 445.560 2.316 10 20 IECD Cn1ncc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C(F)F 784768367 WVZQKKQTNMGYFI-CYBMUJFWSA-N 441.866 2.436 10 20 IECD CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788413593 UPAJZTFHPCOYOV-UHFFFAOYSA-N 430.549 2.419 10 20 IECD Cc1cc(N2CCC(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)nc(C)n1 788932421 NIPGMDYQTDUMEB-UHFFFAOYSA-N 436.560 2.095 10 20 IECD C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799730 PTJIYEIJDIZZPZ-IERDGZPVSA-N 426.492 2.283 10 20 IECD O=C(OC[C@H]1CCCS(=O)(=O)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 792204153 UXGRYYTXDFMSHD-GFCCVEGCSA-N 445.540 2.236 10 20 IECD CCN(C)Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 793871992 VZEUUBRGJKGLPN-LJQANCHMSA-N 438.572 2.469 10 20 IECD C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686895 JMHYQMWSJFMQBM-WMZOPIPTSA-N 444.576 2.447 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3nc(C)c4ccccc4n3)CC2)cc1 804288352 VNEYQLUDLBYJJJ-UHFFFAOYSA-N 433.512 2.348 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCOC3CCCCCC3)cc2F)CC1 805007063 LXXXPNWLQRCRBA-UHFFFAOYSA-N 448.583 2.439 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C[C@@H]2O 807673623 WTOKCKPVTDCIJI-KDOFPFPSSA-N 427.501 2.023 10 20 IECD CN1CCC[C@H](CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807771963 ZOLZKJHMCIKRBZ-DLBZAZTESA-N 438.519 2.173 10 20 IECD O=C(Nc1n[nH]c2nc(O)ccc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816681321 QHRJAFYTENLDLC-UHFFFAOYSA-N 431.455 2.484 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Br)ccc1O 918333835 BJMTZQHQDDIXGA-UHFFFAOYSA-N 439.331 2.320 10 20 IECD C[C@H]1Oc2ccccc2O[C@@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919043545 XBYBCOKSECDCOX-QRQCRPRQSA-N 444.459 2.050 10 20 IECD O=C(CCOC[C@@H]1CCCO1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919699735 ZHDDSUJYWKDZPD-IBGZPJMESA-N 443.523 2.144 10 20 IECD COc1ccc(C)cc1CN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 919808267 YUUXXCDLKYLVFL-UHFFFAOYSA-N 433.530 2.039 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(S)n1-c1ccccc1 1138054018 UJVNCRCZLYFMDB-HNNXBMFYSA-N 427.482 2.476 10 20 IECD COC(C)(C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314777 VPFOFSNVUFGJHO-UHFFFAOYSA-N 435.571 2.406 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)c1ccccc1 1793967592 HHVBMNYTJDGDQK-KRXQYRFLSA-N 435.546 2.196 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1F)C1=NN(c2ccccc2)C(=O)C1 1796451942 JXLOWBHZJLCKQD-ACHSLPGTSA-N 435.459 2.265 10 20 IECD CCC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)n1cccc1 1796829320 AEWYUZBLGCYUHG-YVSFHVDLSA-N 448.614 2.328 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnoc1C1CC1 1806136930 QJOXTVRNDLTHDY-FOIQADDNSA-N 449.467 2.387 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1 1814186512 RBCDMHBDJDKJDK-VQIMIIECSA-N 444.582 2.058 10 20 IECD O=C(C[C@@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721646 NMPHTTKXEQELLK-OLZOCXBDSA-N 432.502 2.134 10 20 IECD COCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817043849 VIOSKIAHDOCTTF-VFADXPBXSA-N 430.461 2.269 10 20 IECD COc1ccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1OC 23744759 RBNGQXRCPMGFES-UHFFFAOYSA-N 435.546 2.097 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCCN3C(=O)OC(C)(C)C)nc12 730641766 MWUGYZQEOLTMAU-OAHLLOKOSA-N 448.476 2.444 10 20 IECD NS(=O)(=O)c1ccc(CCNC(=O)CN(Cc2ccccc2O)C2CCCC2)cc1 731848156 VKUGPOMRZPWMED-UHFFFAOYSA-N 431.558 2.143 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(-c4n[nH]c(C)n4)c3)CC2)cc1 737137251 AVDPMGLZBUAKLL-UHFFFAOYSA-N 434.500 2.466 10 20 IECD CN1CCCc2cc(CNC(=O)Cc3ccc(S(=O)(=O)N4CCOCC4)s3)ccc21 746811434 FJNMCIYEIWMESV-UHFFFAOYSA-N 449.598 2.010 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(Cn4ccnn4)CC3)cc2F)CC1 753612203 BGTXFRIXCJPGQW-UHFFFAOYSA-N 429.544 2.181 10 20 IECD CCNC(=O)C1(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCC1 754618646 LBAVWSUYXVETRV-UHFFFAOYSA-N 435.436 2.406 10 20 IECD C[C@H](OC(=O)c1coc(C(N)=O)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759774915 IEWXLKKOFFWZPO-NSHDSACASA-N 432.388 2.338 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)c1 762343480 VTABJFAPIJTEIO-CQSZACIVSA-N 428.470 2.330 10 20 IECD CN(C)c1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2o1 766326932 HRYPKVKFSXBPNN-UHFFFAOYSA-N 441.463 2.124 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(Cl)cn3)CC2)cc(OC)c1OC 773508150 BHTLFHNCRRKPFH-UHFFFAOYSA-N 434.880 2.048 10 20 IECD C[C@@H](NCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 775837967 WDTZFCPABVAKFT-QGZVFWFLSA-N 446.573 2.063 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(C)c3F)CC2)cc1 776038363 WXLKTGYMTILMME-UHFFFAOYSA-N 428.508 2.410 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(-c4ccccn4)c3)CC2)cc1 778287131 FQRRWZUNYFSENM-MDZDMXLPSA-N 432.484 2.119 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCO[C@@H]3C(C)C)CC2)cc1 778305567 BFNVMOVLAJKNMV-YBPTZKFLSA-N 429.561 2.467 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-n4ccnn4)c3)CC2)cc1 778388198 FAJPYMFSKFPSOR-KTKRTIGZSA-N 432.484 2.119 10 20 IECD COC(=O)c1cnc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1 779669722 IUQYOROJOSOEGD-MRXNPFEDSA-N 443.504 2.325 10 20 IECD O=C(COC(=O)[C@H]1CCCN1c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 785131487 PFOZPXWVGBYWAK-JOCHJYFZSA-N 441.503 2.491 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 785231702 GAKDNGRBQINJMQ-OAHLLOKOSA-N 446.403 2.036 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1 785872676 YFZKNCJUJAVMOG-OALUTQOASA-N 432.609 2.495 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)C(C)(C)CN(C)C)cc2F)C[C@@H](C)O1 789824876 KUEUJFVEHLRDAT-IXDOHACOSA-N 436.572 2.148 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCCO1 789832687 CGXMFCMPEQNUHH-FQEVSTJZSA-N 435.540 2.115 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nn1 793048140 CYMDVQVFQUTFGP-MRXNPFEDSA-N 447.923 2.342 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCCC1 793725554 QHBRCVJHJLFOCA-FPOVZHCZSA-N 428.577 2.480 10 20 IECD Cc1nn(Cc2ccccc2)c(N)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795395313 CCEBAMJLMDVLAZ-HXUWFJFHSA-N 446.555 2.454 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(CNC(=O)C(F)(F)F)CC1 798386597 UPSADKWWIAEOTD-UHFFFAOYSA-N 428.455 2.123 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803297960 LDXHXJGUGYHWNB-MOPGFXCFSA-N 436.556 2.268 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(C[C@@H]3CCOC3)CC2)cc1)C1CCCCC1 803676444 IVNCIDOCFFFHBP-NRFANRHFSA-N 442.604 2.252 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 804315476 MBZYWBYDZPYOTO-JPYJTQIMSA-N 440.588 2.256 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@H]3CCOC3)CC2)cc1F 804852070 YEJHYXXEPQAYDD-SFHVURJKSA-N 435.540 2.332 10 20 IECD O=C1CCc2cc(F)c(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2N1 807386905 PMNFUAHPAUXJBS-UHFFFAOYSA-N 436.237 2.433 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCN(c2ccccc2F)C1 810172563 JZBKOTSLMKQETQ-SFHVURJKSA-N 431.533 2.203 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc2nc(C)nn2c1 810400225 DJMGZPXFANOENF-UHFFFAOYSA-N 432.278 2.493 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccnc(N4CCCC4)c3)cc2)C1 918005895 PHCSHZJAMRNRMU-HXUWFJFHSA-N 436.560 2.383 10 20 IECD O=C(COC(=O)c1cccnc1N1CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 919001742 NBQXLCZTTBQPCJ-UHFFFAOYSA-N 442.491 2.131 10 20 IECD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)C1 1319695039 MQHJVKMQAPZKEP-OYRHEFFESA-N 445.627 2.200 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3c(Cl)ccc4nonc34)C2=O)cc1 1326697786 HOINTJXWNDLGKQ-IBGZPJMESA-N 429.820 2.291 10 20 IECD Cc1cc(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)c1 1787295383 LAZAOLUAFKSNCW-SNRMKQJTSA-N 425.485 2.017 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cc1O 1799768969 IFEHVRKCBGYMOL-CCWDJLKJSA-N 446.887 2.282 10 20 IECD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccc1 1801257639 YFCAIVWOCUUAIP-LJGDNWOOSA-N 433.892 2.017 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1O)CC2)c1cc(O)nc(O)c1 1816721799 POJNKHIODXLUDM-NSHDSACASA-N 426.454 2.195 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)[nH]n1 1823496138 FGQIJPNVZKVLRQ-NFAWXSAZSA-N 447.586 2.308 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C 472073892 JUANZLMDELBCTQ-DEOSSOPVSA-N 434.496 2.477 10 20 IECD COc1ncnc(OC)c1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729874467 JGPQJUQSKZAIQU-UHFFFAOYSA-N 447.403 2.065 10 20 IECD Cc1cccc(N2C(=O)N[C@H](CCC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)c1 730771965 DBGSFPIQMMYCKJ-OAQYLSRUSA-N 436.512 2.353 10 20 IECD CCc1cc(N2CCC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)ncn1 732914842 SPUOREJJNMPKMQ-LJQANCHMSA-N 442.539 2.483 10 20 IECD O=C(NCCCSc1nccs1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746020441 VODFSGBMWOGNGG-MRXNPFEDSA-N 445.570 2.291 10 20 IECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 746281011 WBVQBAASEOSYTE-IBGZPJMESA-N 444.536 2.352 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(NC(=O)[C@H]4CCCO4)cc3)ccc21 747018317 ZTDYNOFMXCFNQU-OAQYLSRUSA-N 436.512 2.441 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](Cn4ccnn4)C3)cc2F)C[C@@H](C)O1 752064666 KKDZHJFFUIOOBS-GGPKGHCWSA-N 444.555 2.059 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)CN3CCN([C@H]4CCS(=O)(=O)C4)CC3)c2C)c1 754641211 AVJQZQLYBQOSAS-NRFANRHFSA-N 429.586 2.390 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2cc(Cl)cc(OC)c2O)c1 761205558 GAESEWGERMQPBA-LLVKDONJSA-N 427.910 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(-c4ccccc4F)n3)CC2)cc1F 765851133 GQAUDQSFBDYPOE-UHFFFAOYSA-N 426.423 2.482 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](Cc4c[nH]c5ccccc45)C3=O)CC2)cc1 777629037 YOLVJZNWBFKLQN-QHCPKHFHSA-N 447.539 2.462 10 20 IECD COC(=O)CCC1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778318782 UKHHRSHMZQMIST-CMDGGOBGSA-N 443.544 2.092 10 20 IECD C[C@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 778550276 CBBJJTXJTOLUSJ-CQSZACIVSA-N 429.496 2.209 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 785298017 UACIBLDDMABFEH-CJNGLKHVSA-N 432.448 2.481 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ncc(I)cn3)cc2)CC1 786076069 ZGZDDJJTHBFHEN-UHFFFAOYSA-N 437.285 2.362 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C(F)(F)Oc3ccc(C=O)cc3)cc2)CC1 787318048 BSDWEJKWUIUVJP-UHFFFAOYSA-N 431.439 2.456 10 20 IECD COc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826739 RBJYEDMHGMADRO-XHSDSOJGSA-N 444.507 2.337 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](c4cc[nH]n4)C3)cc2F)C[C@@H](C)O1 789827217 RVCGRMJDDNFIMO-JZXOWHBKSA-N 443.523 2.185 10 20 IECD COCC[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789843407 KTEDJMRKKNVOQK-QGZVFWFLSA-N 435.540 2.068 10 20 IECD COc1cccc([C@H](C)N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c1 803662495 WTZXXBKTVXXJNS-KRWDZBQOSA-N 442.535 2.422 10 20 IECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)sc1C 807340031 CQWZZGLZAPTXAM-UHFFFAOYSA-N 441.601 2.225 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1noc(-c2ccccc2)n1 808481075 GOVSACJNSNNDPL-KRWDZBQOSA-N 449.511 2.409 10 20 IECD CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NCc1ccc(N2CCCC2)cc1 814284503 SBMPVBAOCLNTTO-UHFFFAOYSA-N 432.546 2.155 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC 917759665 SSMZAKJCFNHBKZ-UHFFFAOYSA-N 427.504 2.216 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 918295255 CBGBWKIMANZCIS-HXUWFJFHSA-N 437.496 2.448 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1 1317894551 XXWFJWHWUOYJAM-SFHVURJKSA-N 445.589 2.426 10 20 IECD Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991225 OCKPSYYJKMCUNS-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1 1828379092 FJTQTVUEXYCZCS-KBPBESRZSA-N 445.557 2.122 10 20 IECD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c[nH]1 1838031566 PLAUWNNEJWOQGK-UHFFFAOYSA-N 428.489 2.055 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCC3)C1 1844075707 PTCSGYOKBAAGQS-UHFFFAOYSA-N 430.892 2.415 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnc(O)nc2O)C3)cc1 1845398414 KSUJGBLXLLHTPR-UHFFFAOYSA-N 447.495 2.426 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 23745200 MNNPHABYVIYJRR-FQEVSTJZSA-N 431.558 2.482 10 20 IECD C[C@@H]1CN(C(=O)Cc2noc(-c3ccc(NC(=O)C4=S=CC=C4)cc3)n2)C[C@@H](C)O1 445398237 RHEVHEUZMHGWQE-ZIAGYGMSSA-N 426.498 2.131 10 20 IECD Cc1c(CNC(=O)C(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)n(C)c2ccccc12 556100586 KTUKEDUZVOIUKJ-JOCHJYFZSA-N 447.583 2.208 10 20 IECD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 729523899 XPMNQBHITDOXJV-UHFFFAOYSA-N 427.480 2.125 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](NC(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 731033312 RTPKRLIPNBHNFA-GOSISDBHSA-N 432.590 2.387 10 20 IECD CCS(=O)(=O)N(C)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 731361556 NVOVTSSDBYHAMP-QGZVFWFLSA-N 438.594 2.040 10 20 IECD COC[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 740474238 UGNONAGOHRBSDV-GOSISDBHSA-N 428.512 2.120 10 20 IECD COc1ccc(N2CCCN(C(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@H]43)CC2)cc1 742352264 TVBCKQJGWXAKPV-SVFBPWRDSA-N 432.590 2.460 10 20 IECD CN(CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1[N+](=O)[O-] 742566924 RMUWIGZJNGKIHY-QGZVFWFLSA-N 425.489 2.049 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)Cc3c(C)nn(C)c3C)CC2)cc1 745276074 LZEWHRMUIFUSNP-INIZCTEOSA-N 428.533 2.116 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H]3C[C@@H](N(C)C)CC[C@H]32)c1 746655076 ZPDFCFCIUWFBBN-YTFSRNRJSA-N 431.577 2.111 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCC(C(N)=O)CC4)cc3)ccc21 749033732 JUFQKZPXXTXDMU-UHFFFAOYSA-N 449.555 2.026 10 20 IECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1cccc(C(=O)N2CCSCC2)c1 759598426 WWLQGEKUNDSNQR-ALCCZGGFSA-N 442.493 2.482 10 20 IECD COC(=O)c1cn([C@H]2CCCN(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)C2)nn1 763034698 HWARMXQVEAQUNM-SFHVURJKSA-N 442.520 2.089 10 20 IECD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 770543842 LMXGVLUZZTXAOT-MRXNPFEDSA-N 433.521 2.337 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@@H]1CCO[C@@]3(CCOC3)C1)c2[N+](=O)[O-] 770907142 AGXDBVQCOAUIIQ-ZLOXQWCVSA-N 436.420 2.438 10 20 IECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 771215755 OEITXPCKVFWCSD-UHFFFAOYSA-N 437.949 2.357 10 20 IECD CS(=O)(=O)C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 774176126 ADNNLYNPLKFMLF-QFIPXVFZSA-N 445.585 2.480 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)[C@@H](C)C3)cc2F)C[C@@H](C)O1 780313054 UWSWFKYXRLSKPY-OKZBNKHCSA-N 436.572 2.426 10 20 IECD 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COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccccc3-c3cnn(C)c3)CC2)cc1 804316135 YUGLOPPDKQSNBV-UHFFFAOYSA-N 447.539 2.497 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3csc([C@@H](C)OC)n3)CC2)cc1 804317106 RYODHNGGTXBWRU-CQSZACIVSA-N 432.546 2.261 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)C2CC2)cc1 806215278 AYABBWHDVHGQGL-HXUWFJFHSA-N 438.503 2.304 10 20 IECD Cn1nnc(Br)c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 810630499 KEWGAAAZYLBYAQ-GFCCVEGCSA-N 428.718 2.331 10 20 IECD COc1ccc(N2CCC(NC(=O)c3c(I)cnn3C)CC2)cc1 814107921 BFMKPWUAOTVRRX-UHFFFAOYSA-N 440.285 2.432 10 20 IECD Cc1cc2cc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc2[nH]c1=O 820782087 VIYOZROWGHYZEV-UHFFFAOYSA-N 427.526 2.494 10 20 IECD CCN(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H]1CCS(=O)(=O)C1 918220499 KFFUKWZOFCLBBQ-ZOBUZTSGSA-N 427.542 2.158 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H](C)N2C(=O)CCC2=O)c(C)n1-c1ccc2c(c1)OCCO2 919259580 LMKGDDBTNAEDMC-OAHLLOKOSA-N 440.452 2.129 10 20 IECD CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920195869 DWXOLSZUVKXBAB-UHFFFAOYSA-N 438.528 2.306 10 20 IECD COc1ccccc1[C@H](CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)N1CCCC1 920980747 ZKSUYGAYQPLSJF-WQJNHMDYSA-N 430.574 2.205 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 1320641969 QYJVZMNGLQLBAP-BPUTZDHNSA-N 436.505 2.334 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4ncon4)C3)C2)cc1 1779869136 PNTMAOAJQQDDGA-QHCPKHFHSA-N 435.484 2.234 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505437 IFZYXRZKSALHRV-WJMBTVPJSA-N 430.501 2.083 10 20 IECD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1)n1cccc1 1790246099 LUIOWKKLPPPIOQ-PWDMQXDWSA-N 447.919 2.407 10 20 IECD C/C=C/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821916603 DRYFMALYYNBVMF-MBYWZOSGSA-N 433.559 2.394 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2CNc3ccccc32)C1 1842933949 KWYJADHPAVBUHC-IBGZPJMESA-N 443.507 2.192 10 20 IECD Cc1ccc(OCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843441766 CZDYSENMXWCRAD-UHFFFAOYSA-N 446.507 2.370 10 20 IECD CC[C@H](NC(N)=O)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845398437 NGZGAZLXIUQKRT-FQEVSTJZSA-N 437.544 2.358 10 20 IECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 110259779 XQKNEVFEQFLUSJ-SFHVURJKSA-N 426.517 2.363 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 732213204 ZDYPBXUXDNLANH-QWFCFKBJSA-N 446.567 2.142 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 734016559 SQFZOASOTWLIGD-SFHVURJKSA-N 449.485 2.169 10 20 IECD NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 742799833 CVBNXYFUJCPDQQ-LBPRGKRZSA-N 431.486 2.396 10 20 IECD O=C1NC(=O)C2(CCC(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)N1 742804694 APDLRIJDGHPESZ-YZGUTLMUSA-N 436.459 2.141 10 20 IECD COc1ccc(N(CC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)CC(C)C)cc1 744395723 WNYXEXLUAROUAI-CTNGQTDRSA-N 438.590 2.352 10 20 IECD Cc1cc(C(=O)CN2CC[C@H]([C@@H]3CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750251917 CGHFIKVXJXDWAG-ZWKOTPCHSA-N 431.558 2.283 10 20 IECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1F 753976810 AXEPAUFRVIPZBR-SFHVURJKSA-N 428.420 2.197 10 20 IECD CCNS(=O)(=O)c1ccc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 764356127 CUCSPXOVVVSGND-KRWDZBQOSA-N 446.573 2.382 10 20 IECD COC(=O)[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cc(OC)cc(OC)c1 764631223 XLTKHKRDZOQRNQ-HTAPYJJXSA-N 441.528 2.409 10 20 IECD O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1cccc(Br)c1O 765481392 TVTNBHBZNPSNSD-UHFFFAOYSA-N 447.333 2.303 10 20 IECD CCN1C[C@@H](C)N(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@H]1C 766254799 RXGNXYPWLYNNGS-IAGOWNOFSA-N 432.590 2.339 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccnn1-c1cccc(F)c1 770717852 ALCUMPVHLZJUAU-UHFFFAOYSA-N 441.438 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@](C)(O)c4ccccc4)n3)CC2)cc1 771084226 YBBUASWQACSLHO-DEOSSOPVSA-N 436.512 2.420 10 20 IECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1OC 774673087 XLXAOGGSLOXPLW-UHFFFAOYSA-N 429.542 2.190 10 20 IECD COc1cc2c(c(OC)c1OC)CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)CC2 785433960 QIRIJEONEZVEQR-UHFFFAOYSA-N 441.528 2.022 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3sccc3C)CC2)cc1 785529182 VXMDGMMGGVSQIV-UHFFFAOYSA-N 430.574 2.010 10 20 IECD C[C@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823004 XTTNBAONVXDRSO-FCGDIQPGSA-N 448.583 2.435 10 20 IECD C[C@H]1OCC[C@]12CN(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCO2 792542107 VJPVLIVYPXLRJY-YJYMSZOUSA-N 438.527 2.275 10 20 IECD CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 796280557 OLTCSVYSBRVZLX-UHFFFAOYSA-N 437.632 2.461 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc1 797431650 VAVFQLICYILOTA-UHFFFAOYSA-N 425.410 2.262 10 20 IECD CC(=O)N[C@](C)(C(=O)NCCCSc1nccs1)c1ccc(S(C)(=O)=O)cc1 797726295 BKFRQMSEQZIJIN-SFHVURJKSA-N 441.600 2.197 10 20 IECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 799260418 VMJBEHFMNVTOKQ-IERDGZPVSA-N 438.528 2.486 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N2CCOCC2)cc1 803310624 IHRPUOKPNWAPEA-ROUUACIJSA-N 448.527 2.159 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCN(c2ccccc2)C1=O 803665281 WQGMBCJBRWDXEX-FQEVSTJZSA-N 426.492 2.162 10 20 IECD C[C@@H](OC(=O)[C@H](O)c1cccnc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 803955509 LVHNBHXOXNUNJC-ZUOKHONESA-N 430.416 2.461 10 20 IECD CN(C)c1cccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 807770785 OOUOKYIUKDCWKP-MRXNPFEDSA-N 447.486 2.150 10 20 IECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 808835454 CCHPHYNZTXBXNM-PZJWPPBQSA-N 431.577 2.384 10 20 IECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 813653459 DAPXJWVGHRIMRA-UHFFFAOYSA-N 428.526 2.205 10 20 IECD Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 871823081 DGRYTRCHSKAROJ-UHFFFAOYSA-N 426.441 2.287 10 20 IECD CNC(=O)c1ccc(OC)c(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 916680778 OQGLHZVCAXIYJG-UHFFFAOYSA-N 430.480 2.477 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(OC)c1 918017820 JCLJRELNEAUGCH-GOSISDBHSA-N 426.517 2.405 10 20 IECD C[C@H](CN1CCCC1=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 918099700 ZPMIMLGDKMGNLA-CQSZACIVSA-N 428.455 2.352 10 20 IECD CNC(=O)c1ccc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918117195 IKSVTECQIKJCAT-HXUWFJFHSA-N 437.544 2.090 10 20 IECD COc1cc(CN[C@H](C)c2ccc(N3CCOCC3)cc2)cc(OC)c1OCC(N)=O 920868213 KLBFMEAOCMRDJC-MRXNPFEDSA-N 429.517 2.255 10 20 IECD CN1CCN(c2ccc(CNCCN(C)S(=O)(=O)c3cccs3)cc2F)CC1 1319311773 UQKNLFJBLGUQOJ-UHFFFAOYSA-N 426.583 2.049 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCc3nc(C)cs3)CC2)cc1 1337366267 WRVFBEJVNVOSDA-MDZDMXLPSA-N 428.558 2.414 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C(=O)CC(C)C)CC3)CC2)cc1 1337613899 ICHKSPZBDSHFNI-UHFFFAOYSA-N 445.608 2.107 10 20 IECD CCc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794379142 XYGYYDSXAJIZDN-HBCWATKFSA-N 445.903 2.226 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1796302401 MMUBTBJBHFSJKJ-FNLKRUPLSA-N 431.496 2.055 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1F)c1cc(O)nc(O)c1 1801526460 AXBMSTDZSMOEPX-QDMKHBRRSA-N 444.419 2.035 10 20 IECD Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1803799104 FNTYVPCDNABTKX-IERDGZPVSA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1coc(Cl)n1 1805013885 MQCRWCIKPGLODW-SJCJKPOMSA-N 443.847 2.163 10 20 IECD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cnn1C 1827427199 SAWWDBANGHQLTR-GOSISDBHSA-N 427.505 2.082 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)CCCc2ccccc2F)C1 1841336298 WEDUOTWUJGSMEY-UHFFFAOYSA-N 449.573 2.212 10 20 IECD O=C(c1n[nH]c2c1CCCC2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501107 AHWHCUOBULFWRE-UHFFFAOYSA-N 430.892 2.484 10 20 IECD COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(F)c1 1846244294 CKWPMHQDTZCWRI-GQCTYLIASA-N 427.432 2.171 10 20 IECD Cc1cc(N2CCC(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)nc(C)n1 582745347 GPEKCWWHFDHRCZ-UHFFFAOYSA-N 434.544 2.295 10 20 IECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 726098939 VFQXCGPIVWXFCR-MJGOQNOKSA-N 434.606 2.313 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1 728302617 VUEKTDCCEBCPFG-VQTJNVASSA-N 427.526 2.186 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3cccc(CS(C)(=O)=O)c3)cc2F)CC1 730193514 KMSRJMDBVGRTKS-UHFFFAOYSA-N 433.549 2.442 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCO[C@@H](C(F)(F)F)C3)cc2F)C[C@@H](C)O1 739923738 XISAGWPOAZBGGQ-HBUWYVDXSA-N 433.446 2.319 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)c3ccccc3)cc2F)C[C@@H](C)O1 740946639 YXZHACHICMFRQB-XCGNWRKASA-N 430.476 2.332 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3O)CC2)cc1OC 748354315 ZSVBKWJEEYBUIS-UHFFFAOYSA-N 434.514 2.127 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCn2cncc2C1 750853042 CRIGDKQSELNLDE-SFHVURJKSA-N 435.507 2.018 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753738374 IOMHRQSZEZIUPP-UHFFFAOYSA-N 435.521 2.236 10 20 IECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754211700 KKBCLGTWBGELNQ-UHFFFAOYSA-N 442.491 2.180 10 20 IECD COc1cc(N2CCN(C(=O)NCCCOC[C@@H]3CCCO3)CC2)cc(OC)c1OC 760103478 GZPBEOHGAMPVSP-SFHVURJKSA-N 437.537 2.130 10 20 IECD C[C@@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS(=O)(=O)C1 763897409 ZEKFSIFLXAFIMV-HUUCEWRRSA-N 440.521 2.156 10 20 IECD O=C(CN1C(=O)c2ccccc2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771057321 IDKWGHSMWWLDPD-INIZCTEOSA-N 427.888 2.422 10 20 IECD CCNS(=O)(=O)[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 771467319 SIIOIGQTFCLVBX-SFHVURJKSA-N 447.557 2.062 10 20 IECD O=C(NCc1cn2ccccc2n1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 775125718 FCPUFXJXILBDQH-OAHLLOKOSA-N 443.454 2.337 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3ccc4nc(O)[nH]c4c3)CC2)cc1 778236281 WUGDHXQLORCORK-SCOAYWHSSA-N 449.511 2.359 10 20 IECD CCN1CC[C@H](N(C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 778287451 MQCDTHDQOOKCJS-HZVYYCNASA-N 428.577 2.231 10 20 IECD CC(C)CN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1=O 779276678 TUHIGNQDQZVPAO-UHFFFAOYSA-N 437.543 2.195 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]4CN(C)CC[C@@H]43)CC2)cc1 779329966 HRZMYZISLWPFBP-REWPJTCUSA-N 429.609 2.333 10 20 IECD Cn1cc(-c2n[nH]cc2C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)cn1 780535754 HFORNJCDFVQHFG-UHFFFAOYSA-N 440.529 2.188 10 20 IECD CS(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1Br 783335501 XHYBHBKISMCTBT-UHFFFAOYSA-N 429.244 2.304 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 788757401 LNZAGPKXJJYCBY-KRWDZBQOSA-N 428.499 2.492 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)cc2F)C[C@@H](C)O1 789821527 TVWXRLLMPZNZCC-HWIQRTGZSA-N 445.535 2.129 10 20 IECD COc1cc(N2CCN(C(=O)Cc3ccccc3S(C)(=O)=O)CC2)cc(OC)c1OC 790950587 FWMUQWXZZZIONX-UHFFFAOYSA-N 448.541 2.007 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](C)N1CCCCC1 793714305 DBRPYQKYCNHLNL-AWEZNQCLSA-N 426.355 2.494 10 20 IECD C[C@@H]1CCC[C@](CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)(N(C)C)C1 793808249 AFHNUKZDTSOVAP-DVECYGJZSA-N 430.593 2.108 10 20 IECD CN(C)c1ccc([C@H](CNC2CCC3(CC2)NC(=O)NC3=O)NC(=O)OC(C)(C)C)cc1 798270321 NBQJAXUSIHFRJS-HRZDDSQGSA-N 445.564 2.429 10 20 IECD CCCN1CC[C@H](CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803447924 BRRJBIXHRFDMCB-MRXNPFEDSA-N 438.519 2.221 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3C[C@H](OC(C)C)C3(C)C)cc2F)CC1 805010028 RTAPOTSHWYROTC-SFTDATJTSA-N 448.583 2.292 10 20 IECD C[C@@H](NC(=O)C(=O)NCCCCn1cc(Br)cn1)c1ccc(N(C)C)cc1 807671222 MHUJNGDMAQEARL-CQSZACIVSA-N 436.354 2.485 10 20 IECD CN(CC1(O)CCCC1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770962 QKGXKVKFSCCTPL-HNNXBMFYSA-N 425.476 2.137 10 20 IECD CCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C[C@@H]1COc2ccccc2O1 916987009 AJAKBBXGCZWJGL-LJQANCHMSA-N 443.519 2.440 10 20 IECD COCCN1C(=O)c2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)cc2S1(=O)=O 917115396 JRLZECLYGNCXQI-UHFFFAOYSA-N 443.525 2.008 10 20 IECD COC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917194948 WGJTVQLLOWGSKJ-UHFFFAOYSA-N 447.419 2.052 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1 918429977 RGOWTDFHYCQODV-UHFFFAOYSA-N 446.573 2.346 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4cccs4)n3)cc2F)C[C@@H](C)O1 918700123 ZIJLNOKRVSFQAD-OKILXGFUSA-N 430.509 2.471 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4c(c(OC)c3)O[C@H](C)C4)nc12 918919767 QMZFGLIVFNDIFQ-LLVKDONJSA-N 427.413 2.301 10 20 IECD CNC(=O)COc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 920881406 CZKDHVNCDHZYCX-MRXNPFEDSA-N 427.501 2.148 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCn1c(=O)oc2cc(Cl)ccc21 1320385296 GMHCBJPHMHGFLJ-AWEZNQCLSA-N 448.859 2.340 10 20 IECD Cc1nc(F)ccc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779825802 CPRZYVPFIGVMRV-OAQYLSRUSA-N 449.866 2.351 10 20 IECD CC(C)N[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)C(C)C 1810544212 YTXXOGKVQLLJJV-HXUWFJFHSA-N 432.565 2.360 10 20 IECD CC(C)n1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)n1 1818293403 XMGZRFLOGDGNHQ-CQSZACIVSA-N 440.464 2.008 10 20 IECD CO[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823713903 UJYXISICNQPRFI-PSASIEDQSA-N 425.894 2.468 10 20 IECD C[C@@H](Cc1ccncc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1845763102 YJQGQHLTNZOSDY-SFHVURJKSA-N 445.523 2.257 10 20 IECD CN1C(=O)c2ccc(S(=O)(=O)Nc3ccnn3Cc3ccc(N(C)C)cc3)cc2C1=O 727363644 YCDDGGYHUFYTQV-UHFFFAOYSA-N 439.497 2.024 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1 728302615 VUEKTDCCEBCPFG-PMACEKPBSA-N 427.526 2.186 10 20 IECD CN(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 729228171 AHWLAUCSYVZHNF-KRWDZBQOSA-N 433.553 2.054 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN(CC(F)(F)F)C3)cc2F)CC1 730126484 ZCVPMAMYWVPVNN-INIZCTEOSA-N 431.478 2.403 10 20 IECD CN(CC(=O)NCC1(N2CCOCC2)CCCCC1)Cc1ccc(N2CCOCC2)cc1 741735770 LOSIIVFPSWMSNY-UHFFFAOYSA-N 444.620 2.106 10 20 IECD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 743715775 AOLQBGMFKNNIQK-QHCPKHFHSA-N 425.460 2.494 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(=O)n(-c4ccc(C)cc4)[nH]3)CC2)cc1 746174550 LANSUAQLPNBMLD-UHFFFAOYSA-N 435.528 2.035 10 20 IECD COCCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 751097133 HEGHJGOTOXRSIM-LJQANCHMSA-N 426.517 2.129 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(C)c3Br)CC2)cc1 753783568 VBMUWFGUVJDJIF-UHFFFAOYSA-N 436.354 2.133 10 20 IECD CCc1nnc(O)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1CC 754570418 WDCVKLDHVAAKFX-INIZCTEOSA-N 440.548 2.008 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(CC(F)(F)F)[C@@H](C)C2)c1 762508733 QFDYXTGDAMRRIL-HNNXBMFYSA-N 429.483 2.495 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1C 765054122 VCHJKEDWUXWJHW-UHFFFAOYSA-N 435.531 2.447 10 20 IECD CC[C@@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](O)C(F)(F)F 766244216 RSJBEKBJLQBYPC-MSOLQXFVSA-N 432.487 2.208 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl 769280214 HWUWOKMELNZDEA-QGZVFWFLSA-N 438.933 2.237 10 20 IECD C[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1)c1ccc(N(C)C)cc1 773307342 RJXXQZQLIBQSFF-MRXNPFEDSA-N 438.594 2.086 10 20 IECD CN(C)C[C@H]1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 776504836 HEDDUHQCIMBHHR-LJQANCHMSA-N 441.555 2.035 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1F 779529205 RMZBCKVLQODKBU-RTBURBONSA-N 431.489 2.187 10 20 IECD CN(CC1(O)CCOCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 780306871 SLLDTAFZNBUPSP-UHFFFAOYSA-N 431.455 2.225 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCNC4=O)C3)cc2F)C[C@@H](C)O1 782937106 CHEKTDUAPPXNFG-SOLBZPMBSA-N 433.528 2.139 10 20 IECD Cc1ccc(C(N)=O)cc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784767743 RLZIDFIKEBRMDR-QGZVFWFLSA-N 444.919 2.172 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)CC3)cc1 785443712 OCHRDKMJHKKXKZ-OALUTQOASA-N 430.549 2.369 10 20 IECD O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786081307 IUPLYIZZVHSHBT-INIZCTEOSA-N 436.503 2.116 10 20 IECD COc1ccc(-n2ccc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)n2)cc1 786254623 FVZDINMEAKIFMB-UHFFFAOYSA-N 433.512 2.479 10 20 IECD CC(C)Nc1nc(NCCO)nc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 786575118 JIFRMPRPHXAJEP-HUUCEWRRSA-N 433.532 2.461 10 20 IECD CC(C)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCCCCC1 786630392 WZWSWOSRSIZTJC-HSZRJFAPSA-N 444.620 2.498 10 20 IECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)n1 786734337 YUIQUZKXHJEMCW-UHFFFAOYSA-N 449.577 2.379 10 20 IECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788724187 JRNJDHVRQFTVCY-APWZRJJASA-N 426.521 2.295 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCO[C@H](c2ccccc2)C1 789836578 SWBYSBIIDRPIJR-QFIPXVFZSA-N 441.503 2.003 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 790226089 SWPBKDWAGBYKCW-YEODSOHDSA-N 428.460 2.084 10 20 IECD Cc1cnn(CCOC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)c1 792200930 DVYREKUDVLZDLJ-UHFFFAOYSA-N 446.441 2.463 10 20 IECD C[C@@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 793716401 CYZUUXNSRIGJQR-RXVVDRJESA-N 436.556 2.267 10 20 IECD O=C(CN1CC[C@H](c2ccccc2)S1(=O)=O)NCc1ccc(N2CCOCC2)c(F)c1 793857717 WDOLOWJYVSJUAP-OAQYLSRUSA-N 447.532 2.055 10 20 IECD CCO[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 803449116 OQWHBDVLZTUXNV-GOSISDBHSA-N 425.476 2.401 10 20 IECD O=C(/C=C\c1ccc(O)c(O)c1)NCC(=O)Nc1ccc(I)cc1 803489645 AZDSJOXTIHSJDX-WAPJZHGLSA-N 438.221 2.471 10 20 IECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)Oc2ccccc21 803660988 LPOGJJMQONWSLF-QGZVFWFLSA-N 428.508 2.254 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(NC(=O)OC(C)(C)C)CC3)ccc21 803687238 AINSSHWBWQBOHD-UHFFFAOYSA-N 430.549 2.201 10 20 IECD CN(Cc1cc(Br)cn1C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290136 QNLSVMILZXJUEM-UHFFFAOYSA-N 431.334 2.439 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 808583804 GYTWRTAHPAGSAQ-AWEZNQCLSA-N 438.962 2.317 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3COc4ccccc4[C@@H]3O)cc2F)CC1 812033535 XXHNUWSVMGHMEC-UGKGYDQZSA-N 428.508 2.261 10 20 IECD Cc1cnc(Br)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 812960689 SFEZRTVZYOFAHG-UHFFFAOYSA-N 433.306 2.244 10 20 IECD Cc1cccc(CN2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)c1 916975262 BMRRRXXYOUUMSQ-UHFFFAOYSA-N 440.563 2.405 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CN3CCCCCC3=O)cc2F)C[C@@H](C)O1 918813918 DHXWTTHHNLASFF-IAGOWNOFSA-N 449.523 2.001 10 20 IECD O=C(CCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970961 AGYLBBLRAZFHQG-UHFFFAOYSA-N 425.460 2.089 10 20 IECD CNC(=O)COc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 920881402 CZKDHVNCDHZYCX-INIZCTEOSA-N 427.501 2.148 10 20 IECD CCOc1ccc(N2CCN(C(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 1116510313 RJBFRMRQOHBTHU-UXHICEINSA-N 427.526 2.438 10 20 IECD Cc1cccc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)cc12 1778497513 ZSRHBSKVDBIYPS-QHCPKHFHSA-N 436.468 2.040 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3F)C2)C1 1780481921 UGLZMJCIUHRMEO-DRGXBFSJSA-N 442.443 2.099 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CN)[C@H]3C2)cc1 1786785296 RDUBLBGZRQZXEY-NQCBNZPSSA-N 438.572 2.282 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1ccc(C2(NC(=O)Cn3nccn3)CCC2)cc1 1792301458 WPZVVGSCSXRRGL-YCRREMRBSA-N 449.467 2.242 10 20 IECD Cc1cccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1793763343 DUAKSDFFQOQYMZ-GGPHIMKMSA-N 431.496 2.435 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994640 XHFHYNFQLRYGTB-KUHUBIRLSA-N 426.498 2.228 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998812 GCMTUCCAJVWNDO-XXEDRWDRSA-N 438.509 2.083 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1 1824896286 VOYMFYNCGVLHIU-KUYPFPNRSA-N 433.461 2.243 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cncn2)CC1 1827192038 UVOJRJFSYLSAJW-KRWDZBQOSA-N 447.923 2.276 10 20 IECD COCc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827916936 WSFUPQJRKSWUQG-KRWDZBQOSA-N 444.488 2.174 10 20 IECD O=C(/C=C/C1CCCC1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836406998 FTIMLJGUFCKYPZ-AATRIKPKSA-N 442.560 2.424 10 20 IECD C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)NC(=O)NC(C)(C)C 15643227 MELKWEHBNBKSIT-LLVKDONJSA-N 437.452 2.214 10 20 IECD CNS(=O)(=O)C1=CC(C(=O)Nc2ccc(C(=O)Nc3ccc(OC)cc3)cc2)=S=C1 482081512 XBCFNBZYKAGURK-UHFFFAOYSA-N 445.522 2.041 10 20 IECD CN(CCCNC(=S)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 726483208 SEJQAHLSZUNHBG-UHFFFAOYSA-N 446.642 2.412 10 20 IECD Cc1cc(C(=O)COC(=O)C2CCS(=O)(=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 733028627 WNYNZVIOXZMBAY-UHFFFAOYSA-N 447.509 2.416 10 20 IECD C[C@H](CNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)CN1CCN(C)CC1 745862063 GDVMTTVKUMXLPJ-MSOLQXFVSA-N 439.551 2.440 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1C 751240545 PTEZZVVRGSKFGG-UHFFFAOYSA-N 432.542 2.469 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754213361 RLBBORBJSMWOCP-UHFFFAOYSA-N 443.475 2.227 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ccc2c(c1)CCS2(=O)=O 757633695 WUUILJXCHOHZDK-UHFFFAOYSA-N 447.532 2.116 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1 758296592 BKQFQKGMOXKOSF-GOSISDBHSA-N 430.486 2.387 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccnc(OCCN(C)C)c3)CC2)cc1F 762676820 DCJJQONXNRPPKD-UHFFFAOYSA-N 431.512 2.202 10 20 IECD O=C(c1cc(S(=O)(=O)NCc2cccc(Br)c2O)c[nH]1)N1CCCC1 766206031 CLHZJIDGOWUCLS-UHFFFAOYSA-N 428.308 2.197 10 20 IECD CC(C)[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS1(=O)=O 772700738 XDDKGUMHYLMTHR-CRAIPNDOSA-N 445.532 2.433 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccc(N(C)C)cc1 773845397 IQWZHCAHQQEIDD-HNNXBMFYSA-N 430.530 2.108 10 20 IECD COc1ccccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 774725984 TZEQRMONHACCHG-HOTGVXAUSA-N 429.492 2.381 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 776054312 FGXJQDKOFVIKNN-QGZVFWFLSA-N 435.575 2.118 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)cc1 778246833 LPRCGWWLTLQGRR-HCNXQGSASA-N 442.604 2.383 10 20 IECD C[C@@H](CN1CCOCC1)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 788874289 JGGXSJZGVKWFRD-INIZCTEOSA-N 444.498 2.404 10 20 IECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H](c2ccccc2)C1 789845060 JMMBZFNYQCVPNT-QFIPXVFZSA-N 438.597 2.371 10 20 IECD C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734976 WHQKUWNOONENOP-RZFNWQHOSA-N 448.567 2.409 10 20 IECD COc1cncc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 798428973 ZYWKDJCEQAWVAQ-UHFFFAOYSA-N 431.436 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCc4ccccc4OC3)CC2)cc1 801442533 XKBKNKXTVCPDGL-GHYICZDASA-N 435.524 2.410 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)CCC(=O)N1CCN(c2ncccn2)CC1 801547828 AVJVWNZAPYOMAU-UHFFFAOYSA-N 425.533 2.440 10 20 IECD COc1ccc(N2CCN(c3nnc(-c4cnn(C)c4)n3C[C@@H]3CCOC3)CC2)cc1F 802758103 LRLYGIGDKCCPKF-INIZCTEOSA-N 441.511 2.189 10 20 IECD COc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803661544 FVQUWHSQXHLNBJ-UHFFFAOYSA-N 430.524 2.107 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)ccc21 803686241 DOJLHDZUMXIASA-QFIPXVFZSA-N 448.567 2.035 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)C2CC2)cc1 806088245 PMOVQASILKVUHN-FCHUYYIVSA-N 428.577 2.003 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 810207046 CRZYFGHCDNNVTE-GOSISDBHSA-N 431.558 2.296 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)COCc3nc4ccccc4s3)nc12 919009541 PBTIQQNEBLRSMA-UHFFFAOYSA-N 442.453 2.481 10 20 IECD CN(C)C(=O)COc1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969984 MXTYYXKXUPVDMN-UHFFFAOYSA-N 425.529 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccc4c(c3)OCO4)CC2)cc1 920252092 IGDAHRBSKSWHHL-MDZDMXLPSA-N 437.496 2.287 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(=O)(=O)c4ccccc4)CC3)cc2F)CC1 1116437191 SDDQLRNKNFNMGM-UHFFFAOYSA-N 432.565 2.084 10 20 IECD CN1CCN(c2ccc(CN3CCN(Cc4nc(N)c5ccccc5n4)CC3)cc2F)CC1 1320475896 SBIFBVSAHFIAIU-UHFFFAOYSA-N 449.578 2.421 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(Cl)c3)C[C@@H]21)c1cc(O)nc(O)c1 1787294256 FYYXKUNNWNBZIG-GOPGUHFVSA-N 449.866 2.192 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ncon4)[C@H]3C2)cc1 1789090168 CXCAASDJDCRYJR-JBACZVJFSA-N 449.511 2.384 10 20 IECD Cc1nscc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932706 UJJRLLIZPAGWNN-ACHSLPGTSA-N 437.525 2.496 10 20 IECD C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812584197 KNUNDRWOPJOEEG-DFXACFSPSA-N 444.582 2.080 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)C(=O)C1CC1 1814813061 TVFIUOQGXMXWEN-HEWZJLJBSA-N 440.456 2.211 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cscn2)CC1 1827125744 VOUQDTIYFORJCI-KRWDZBQOSA-N 430.530 2.425 10 20 IECD CC/C=C(\C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840631520 IFHVGYNLGZHNKI-UQTPNQFZSA-N 438.908 2.178 10 20 IECD Cc1ccc(COCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1C 1843249933 RUJKSIYTSDRDAK-UHFFFAOYSA-N 425.485 2.143 10 20 IECD Cc1nn(C)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1[N+](=O)[O-] 195641951 PRXAXICNRMGHMH-UHFFFAOYSA-N 427.383 2.422 10 20 IECD CC(C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)N1CCOCC1 435816121 BUDFOCXFXBCDBX-DEOSSOPVSA-N 440.588 2.407 10 20 IECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 726794089 ZAJBGZLZPYHYRA-AWEZNQCLSA-N 439.484 2.154 10 20 IECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 734075135 ZIIBWUFSYVRZQH-UHFFFAOYSA-N 449.529 2.076 10 20 IECD CCOC(=O)c1ccnc(NCCN2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-] 737399686 QQBLSJRPVJYTGR-UHFFFAOYSA-N 429.477 2.409 10 20 IECD Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n(C2CCOCC2)n1 746363053 JKHDZDFPMLBTAC-LJQANCHMSA-N 442.516 2.395 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc5ccccc5n4)CC3)nc12 746467395 BQRFBVWNNDSEHK-UHFFFAOYSA-N 432.484 2.482 10 20 IECD CN1CCN(Cc2cccc(NC(=O)C(=O)NCCCSc3nccs3)c2)CC1 749730734 UBDLYCCIAXICRD-UHFFFAOYSA-N 433.603 2.128 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CC(N)=O)C3CCCCC3)cc2F)C[C@@H](C)O1 754504568 ISVICTAGGIQUAL-FVJLSDCUSA-N 448.583 2.469 10 20 IECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 756890672 ZYWBQQHNOPUXAJ-ROUUACIJSA-N 442.560 2.228 10 20 IECD O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCCCSc1nccs1 767774625 RTHREAGFCWVMOS-UHFFFAOYSA-N 425.557 2.231 10 20 IECD Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)cc1 768443983 KKVDHRXVBFZYDY-IERDGZPVSA-N 432.542 2.317 10 20 IECD COc1cccc(C(N)=O)c1OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 768512231 PGFFBOPPDYXVHS-GASCZTMLSA-N 445.491 2.242 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(-n5cccn5)ccn4)n3)CC2)cc1 771059257 ZAKJKNGCLGFWER-UHFFFAOYSA-N 445.483 2.217 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1nc(O)c2ccccc2c1=O 777826036 FUKLZBFVZRDEER-UHFFFAOYSA-N 445.859 2.053 10 20 IECD O=S(=O)(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(CC(F)F)c1 777964660 SMCMEPCZWNTCRF-AWEZNQCLSA-N 434.896 2.450 10 20 IECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[C@H](C)CO1 779335158 CYPIWBQMXRSUAV-IAGOWNOFSA-N 428.512 2.261 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@H]1CCC=CO1 780330060 QHTPRQMRDAQYDJ-GOSISDBHSA-N 426.496 2.434 10 20 IECD CNS(=O)(=O)c1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 784642833 BKTFLKOPCWAYMV-UHFFFAOYSA-N 443.481 2.061 10 20 IECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295635 XWWYDLDBTOYNJT-NSHDSACASA-N 440.905 2.231 10 20 IECD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 787330218 VAMRYFXMUGYNAQ-SYNHAJSKSA-N 438.528 2.037 10 20 IECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(-c4cnn(C)c4)nn3)cc2F)CC1 788784786 CMGNLFSVNXBLRA-UHFFFAOYSA-N 438.511 2.480 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCc3ccncc3)cc2F)C[C@@H](C)O1 789819079 LHODDZGEFCKKON-CALCHBBNSA-N 428.508 2.152 10 20 IECD CN(Cc1ccc2c(c1)OCCO2)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856874 YFMWHNZRFCUYGT-UHFFFAOYSA-N 441.553 2.286 10 20 IECD CC1CCN(c2ccc(CNC(=O)[C@@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2)CC1 793466123 LAVWYNUMOLOIHK-QHCPKHFHSA-N 442.560 2.155 10 20 IECD C[C@H](CN(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 793716402 CYZUUXNSRIGJQR-WIYYLYMNSA-N 436.556 2.267 10 20 IECD C[C@@H](Sc1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(N)=O 800854011 IIAUHWRZNYAYNB-WBVHZDCISA-N 440.569 2.284 10 20 IECD CC(C)N(CCS(C)(=O)=O)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803679660 UXUMHGKLCFJQFI-UHFFFAOYSA-N 437.606 2.353 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](CNC(=O)c4ccccc4)C3)ccc21 803686498 LWENKHPEVNSEAS-HXUWFJFHSA-N 448.567 2.354 10 20 IECD Cc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nc2ccccc12 804288218 XLOBYQNTQIWOBA-GOSISDBHSA-N 434.496 2.468 10 20 IECD CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 807023644 CDWVXGZQLPOBPS-NSHDSACASA-N 435.502 2.081 10 20 IECD Cc1cc(C(=O)NC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)c(C)o1 807096196 DUFQFPSTZWAXCV-UHFFFAOYSA-N 440.544 2.308 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1 807097975 UCVADPJWHOHMGU-UHFFFAOYSA-N 437.544 2.490 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807617319 MIFUDCIAHUDFNF-RTWAWAEBSA-N 426.513 2.274 10 20 IECD COc1cc(O)c(CNc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1OC 809679705 JPSUYOOZTGWJDR-UHFFFAOYSA-N 438.502 2.051 10 20 IECD CO[C@](C)(C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C1CC1 812659274 TUIYZLUGKGURBE-NRFANRHFSA-N 434.514 2.283 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccccc3S(=O)(=O)N(C)C)CC2)cc1 918004325 HSVUSWHFVRICEX-UHFFFAOYSA-N 446.573 2.367 10 20 IECD C[C@@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H](C)O1 918117711 HXAVQUJUTCYYSY-QWFCFKBJSA-N 445.608 2.075 10 20 IECD C[C@H]1Oc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2NC1=O 918298050 WVFWGKNPXHRWQD-RHSMWYFYSA-N 439.468 2.258 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919969056 VXBRABAPPDJRPQ-UHFFFAOYSA-N 445.585 2.432 10 20 IECD Cc1nc(C2(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CCCCC2)no1 921192981 TXKBXZBYEFAUNA-UHFFFAOYSA-N 431.512 2.419 10 20 IECD CCOC(=O)C1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1801484998 PWXZMNYYLYQRMV-BTTYYORXSA-N 436.892 2.346 10 20 IECD C[C@]1(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CC=CCC1 1834988384 LTKGQOJNSXIANZ-DEOSSOPVSA-N 442.560 2.424 10 20 IECD Nc1ccccc1/C=C/C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842960810 MYYRGUFTLBGZBZ-VTTRTIMMSA-N 435.480 2.316 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@@]4(CCCC[C@H]4C)C3=O)CC2)cc1 110359446 IKWNMBFZOWXNAO-WAIKUNEKSA-N 428.533 2.281 10 20 IECD COc1ccc(OC)c(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 726483763 ZYQBXJOZUOBVAE-UHFFFAOYSA-N 435.571 2.425 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(C)nn4C)n2)o1 727244930 NJWOJUKFLXFCGQ-UHFFFAOYSA-N 446.514 2.430 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cc(F)ccc3Cl)cc2)C1 728143359 PUSDAJSANCXVDV-AWEZNQCLSA-N 432.883 2.436 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)cc1 731126591 VNNOXDKTOLMSOJ-UHFFFAOYSA-N 443.305 2.351 10 20 IECD O=C(NCCCSc1nccs1)c1cccc(CN2CCS(=O)(=O)CC2)c1 733974423 RKPGWXSWXZMJQA-UHFFFAOYSA-N 425.601 2.286 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccccc1N1CCOC1=O 737131391 OCPMRIKABYIMHP-UHFFFAOYSA-N 440.525 2.451 10 20 IECD Cc1c(NC(=O)C(=O)N(C)Cc2ccccc2O)cccc1S(=O)(=O)NC(C)(C)C 740489840 AUIMSRXPVGQPBY-UHFFFAOYSA-N 433.530 2.375 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H]3C[C@H](N(C)C)CC[C@H]32)c1 746655069 ZPDFCFCIUWFBBN-DNVJHFABSA-N 431.577 2.111 10 20 IECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC1CCCC1 746725272 DVGILJSLYLZTNF-UHFFFAOYSA-N 428.455 2.400 10 20 IECD COCCN(CC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)C(=O)OC(C)(C)C 753739458 SIKOIJDOOJJWAG-UHFFFAOYSA-N 425.501 2.366 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(=O)Nc4cc(F)ccc43)CC2)cc1 754064514 RQIHXBLUQWFUCZ-IBGZPJMESA-N 428.508 2.166 10 20 IECD CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 760090234 FFWNKNYXHWPMLU-UHFFFAOYSA-N 433.505 2.225 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCC[C@H]1N1CCOCC1 763658698 KNLWKDRVMUONJX-XZOQPEGZSA-N 430.593 2.338 10 20 IECD O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NCc1ccc(N2CCSCC2)cc1 765472024 OENYUEVCNGXOHW-UHFFFAOYSA-N 440.529 2.252 10 20 IECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2cccc(Br)c2O)n1 765925471 GCYYEYSIJXQBKC-UHFFFAOYSA-N 436.291 2.267 10 20 IECD COc1ccc2c(c1)OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 768049698 WCUJZZKNJYXVRK-MOPGFXCFSA-N 438.528 2.200 10 20 IECD Cn1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C(F)(F)F)n1 772930186 UIGIADWTOGXEIQ-ZDUSSCGKSA-N 426.395 2.291 10 20 IECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773847690 SGGDESIYEZZIDO-HNNXBMFYSA-N 434.500 2.162 10 20 IECD O=C(NCCN1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O)c1cccc(O)c1O 776614545 FYXNTXAYRGUWNV-CXUHLZMHSA-N 428.422 2.293 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccc(Cl)cn3)CC2)cc1 778329975 ZDIKGLABMBJLQZ-VQHVLOKHSA-N 444.919 2.144 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)C[C@@H]3C)cc2F)C[C@@H](C)O1 780312813 SMOZJQSKUSEYAH-OKZBNKHCSA-N 436.572 2.426 10 20 IECD O=S(=O)(c1cccc(NCc2ccc(N3CCOCC3)c(F)c2)c1)N1CCC(O)CC1 785556457 ZUKNCIOVKZDYOA-UHFFFAOYSA-N 449.548 2.420 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 785868530 FJFUNKCONCHGOS-RTBURBONSA-N 432.609 2.494 10 20 IECD CC1CCN(CCCCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 787896564 WFAPXCKOAAMPRC-UHFFFAOYSA-N 448.583 2.031 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1nc2c(s1)CCC2 789706479 LUNWHGWFNMTJBB-UHFFFAOYSA-N 439.585 2.419 10 20 IECD CC(C)n1cc2c(n1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCC2 789800145 MAODHVTXQLSWSL-LJQANCHMSA-N 443.523 2.250 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H](N(C)C)C3)cc2F)C[C@@H](C)O1 789823704 FDYBNLHZGKLTIV-PSBWJHGTSA-N 434.556 2.045 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc2F)C[C@@H](C)O1 789824577 JIIJRYVEXCVNJJ-STOARDPYSA-N 433.524 2.129 10 20 IECD CCN(Cc1ccccc1C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793723420 WSNCCARFZIVJQT-NRFANRHFSA-N 436.556 2.362 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H]1CCc2ccccc21 793733715 NWKLWFSMVMTMQB-SIKLNZKXSA-N 434.540 2.150 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1F 803661599 HHCDMUZPPDRZME-HOTGVXAUSA-N 436.528 2.460 10 20 IECD CCN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1)CC(F)(F)F 803687269 APOPKMKSGYUOBB-KRWDZBQOSA-N 440.510 2.418 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 803874044 HNAPSFKQATUJMH-INIZCTEOSA-N 435.521 2.048 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 804707909 INHLMUVTDQYLEK-GOSISDBHSA-N 432.565 2.474 10 20 IECD O=C(COC(=O)COc1cc(F)cc(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 811360024 FVBHRPFRESIOPX-UHFFFAOYSA-N 438.402 2.179 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H](C)O)cc1 813685080 BTGXKVWEBXKDRD-BDJLRTHQSA-N 447.340 2.352 10 20 IECD COCCn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 920036244 PJZVOCSKFYMRRV-UHFFFAOYSA-N 441.553 2.453 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 920923382 POYNLKZDDVVKOY-CQSZACIVSA-N 440.475 2.363 10 20 IECD C[C@@H](Sc1cccs1)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1778809260 LFCBFLHARQCZQO-ZUOKHONESA-N 449.554 2.179 10 20 IECD CC(C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803238572 ORPIMZGYMWYPJY-CCKFTAQKSA-N 447.919 2.483 10 20 IECD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)C1(O)CCC1 1823733580 XHXMMACGCIYNJD-YJBOKZPZSA-N 431.533 2.277 10 20 IECD O=C(CCc1ncc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428688 BWVTUQRSYZSZLP-QGZVFWFLSA-N 427.505 2.082 10 20 IECD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@H]2C1 1828809126 DGOUQHYBBIDDDB-XCLNPWKQSA-N 442.560 2.066 10 20 IECD CN1CCCc2cc(CNC(=O)NCC3CCN(S(=O)(=O)C(F)(F)F)CC3)ccc21 303492257 WGSMNHQUHXRAFM-UHFFFAOYSA-N 448.511 2.430 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCN(CC(=O)NC4CCCCC4)CC3)ccc21 728747374 JIULCIFNDCICHP-UHFFFAOYSA-N 427.593 2.345 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCC(=O)N(C)Cc3ccccc3)cc2F)CC1 730119117 HCHFDWXSBCJOTM-UHFFFAOYSA-N 441.551 2.425 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C(F)(F)Oc3ccc(C=O)cc3)CC2)cc1 730866814 NNSKDSPPEWIFNH-UHFFFAOYSA-N 448.422 2.371 10 20 IECD CC(=O)NC1(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCCC1 731254303 LZYDGICGJKIGEJ-UHFFFAOYSA-N 434.448 2.393 10 20 IECD CC(=O)Nc1cccc(F)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 734195641 XBSUHUSUWUBGHY-UHFFFAOYSA-N 447.438 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)CSCCn3cnc4ccccc4c3=O)CC2)cc1 735318322 KSSCALSWTTZWKD-UHFFFAOYSA-N 438.553 2.487 10 20 IECD C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 736374628 CHEWHMKPSNUPCA-KBPBESRZSA-N 449.495 2.259 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C[C@H]4CCOC4)CC3)cc2F)CC1 736392541 RFKDONUPMXKSQH-HXUWFJFHSA-N 447.599 2.268 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3O)CC2)cc1 748353653 CETSIDVQPANGAH-UHFFFAOYSA-N 446.525 2.286 10 20 IECD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751229053 SENYYJUIOZWRIL-UHFFFAOYSA-N 427.429 2.313 10 20 IECD CC(=O)NC[C@@H]1CCn2ncc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2C1 752836004 OZMHDQPDCDLXNJ-GOSISDBHSA-N 427.574 2.065 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3C[C@H](O)c3ccco3)CC2)cc1 754063000 YRIAUKHLSGSUBC-FUDKSRODSA-N 429.561 2.359 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4cc(N(C)C)ccc43)CC2)cc1 754080701 HEQMKEXQXQRRBC-OAQYLSRUSA-N 426.561 2.143 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])cc3C(C)=O)CC2)cc1 758234377 YKHNVXQINWYFSI-IBGZPJMESA-N 429.473 2.368 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N(c1ccc(F)cc1)[C@H]1C=CS(=O)(=O)C1 759596090 MCPJIKGOEWBNFY-FBFPYJBRSA-N 447.440 2.137 10 20 IECD O=C(COC(=O)c1csc(NC2CC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 768655747 UFUSBTCGIGHUNO-UHFFFAOYSA-N 434.493 2.166 10 20 IECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1F 776044183 ZPMPJSRSOWNESA-JXFKEZNVSA-N 427.542 2.207 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc(-c4ccccc4)n[nH]3)CC2)cc1 778255861 HDVUBRURFLZWKY-VAWYXSNFSA-N 446.511 2.002 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](C)[C@H](n4ccnc4)C3)CC2)cc1 778327319 WOIRZWCXHWXEEP-RLYSMMSMSA-N 437.544 2.206 10 20 IECD CC(C)(C)OC(=O)NCCCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 781952601 XBDWPHQNTAONFZ-UHFFFAOYSA-N 439.578 2.233 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1 782420580 JYXPJUKVLNJNAC-UHFFFAOYSA-N 445.483 2.489 10 20 IECD COCCCOc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cn1 786257634 RORMBTCNZXRENR-UHFFFAOYSA-N 426.517 2.095 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccnc1N1CCOCC1 787282727 DKBMOERDXVMLCW-UHFFFAOYSA-N 426.517 2.069 10 20 IECD CCn1ccnc1[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788333302 RJKDPZAXEQZTCQ-HXUWFJFHSA-N 425.533 2.110 10 20 IECD Cn1ncc2c1CCC[C@H]2NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 789595653 LHHGEQOEFQIQEX-KBXCAEBGSA-N 447.486 2.300 10 20 IECD CC(C)Oc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nn1 793048137 CYMDVQVFQUTFGP-INIZCTEOSA-N 447.923 2.342 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](Oc3ccccc3)C(C)(C)O)CC2)cc1 795764571 PLVXFFJKKRLTER-JOCHJYFZSA-N 442.512 2.106 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccc(N2CCOCC2)cc1 803303886 VTONDHHQWMGJRH-QQURRQIPSA-N 440.588 2.033 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 803450067 CIUABNUDLNGTSC-OTWHNJEPSA-N 449.498 2.447 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1F 803663625 VFAXEMHTCBULNE-MRXNPFEDSA-N 432.883 2.083 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(C[C@H]3CCOC3)CC2)cc1)C1CCCCC1 803676445 IVNCIDOCFFFHBP-OAQYLSRUSA-N 442.604 2.252 10 20 IECD C[C@@H](Oc1ccc(C=O)cc1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 803965554 GIIXGRKIXLFVAL-MRXNPFEDSA-N 444.459 2.102 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1c(C)noc1C 805007357 JFIJHUNAFUAYBR-IBGZPJMESA-N 445.539 2.456 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807291779 NHTDLRDOFKULKD-UYAOXDASSA-N 426.561 2.222 10 20 IECD COC(=O)[C@H](C)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 914436978 ASQUQSVUMTVMTJ-PPLKPFPSSA-N 443.344 2.328 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(Cn2cccnc2=O)c1 918265918 LCBXFYRSHRSDQA-UHFFFAOYSA-N 431.496 2.147 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCCN3C(=O)c3ccco3)cc2)C1 918659672 REVLMFJDEUSKBV-ICSRJNTNSA-N 438.528 2.292 10 20 IECD CC(C)OCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919789980 CHBVNYLKBOEAPE-UHFFFAOYSA-N 446.592 2.376 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2 1785505991 WXPIMLBOQLKCDD-HVPBSWBLSA-N 448.491 2.319 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@H]3CCOC3)CCC2)cc1 1792315810 DFQUTMSJNIKELT-ZDUSSCGKSA-N 433.555 2.017 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1CCC(CO)CC1 1815687657 FQHWOPQQSUEEJN-MQBCKMQZSA-N 443.504 2.321 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc(F)ccc2Cl)C1 1845373518 PUVIIIKFCRIFGN-UHFFFAOYSA-N 441.937 2.156 10 20 IECD CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C(C)(C)C 1845500661 YEETWSBZGUYCQI-QGZVFWFLSA-N 437.924 2.119 10 20 IECD O=C(CN1CCN(c2cnccn2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 27628315 AAFKXMQQCIMMQW-UHFFFAOYSA-N 427.464 2.013 10 20 IECD CCC(=O)NCc1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)ccc1OC 532777397 SHDHJAGAWIPJCL-UHFFFAOYSA-N 433.530 2.375 10 20 IECD NS(=O)(=O)c1ccc(CN2C(=O)/C(=C\c3cccc4c3OCO4)SC2=S)cc1 726626432 CGMBXLZBYZDZQT-OVCLIPMQSA-N 434.520 2.464 10 20 IECD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c(O)c1O 727003573 AYSJERHAFXJMBJ-CQSZACIVSA-N 425.441 2.388 10 20 IECD CNS(=O)(=O)[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 733311167 NCGQCLIPRZCCHG-SFHVURJKSA-N 447.557 2.062 10 20 IECD Cc1cc(C(=O)NS(=O)(=O)c2cccc(C(=O)N(C)C)c2)c(C)n1-c1ccccn1 734973135 BTWNYRHOVKNLDM-UHFFFAOYSA-N 426.498 2.310 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1 745813988 HPNSLKDMRPFZDI-HXUWFJFHSA-N 440.610 2.161 10 20 IECD C[C@@H](O)C[C@@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748374094 HQJSGGWYYBOMFK-CHWSQXEVSA-N 437.474 2.238 10 20 IECD CCOC[C@H](C(=O)OC)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 754352148 PJJIYSOQEPAECN-MRXNPFEDSA-N 440.408 2.020 10 20 IECD CCN(CC)c1ccc(C=c2sc(=CC(=O)C3CC3)n(Cc3nccc(C)n3)c2=O)cc1 755413487 VEDSVAGAZNYSGR-UHFFFAOYSA-N 448.592 2.491 10 20 IECD CC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756244591 QAMIUTCPEKMEIJ-HXUWFJFHSA-N 434.448 2.345 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2C1=O 761026692 WMCCGJZKIBSJCD-IBGZPJMESA-N 437.496 2.167 10 20 IECD O=C(Cc1ccc(O)cc1)NCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765445647 ONPJMHJAHNJHCP-UHFFFAOYSA-N 433.455 2.438 10 20 IECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(=O)n(C)c1 766493315 ITJQVXQBCPAYCO-AWEZNQCLSA-N 434.443 2.019 10 20 IECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)c3cc(C(=O)OC)cs3)CC2)c1 768213902 VVVAYMFETREIMW-UHFFFAOYSA-N 440.543 2.146 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4ccccc4[C@H]3CO)CC2)cc1 773511375 VMKHYQDKHILKEW-ZXEGGCGDSA-N 435.524 2.018 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3n[nH]c4ccc(OC)cc34)CC2)cc1 778406559 GAXNMBWNUHLTFS-KTKRTIGZSA-N 435.484 2.424 10 20 IECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 781440667 KSHPQGYJXDWXSD-GJZGRUSLSA-N 443.475 2.481 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 781482624 JQUSPMVEXXVUEL-UHFFFAOYSA-N 447.438 2.484 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(OC)cc3OC)CC2)cc1 786666885 QVAZBKASLXGBGO-UHFFFAOYSA-N 427.501 2.068 10 20 IECD C[C@H]1c2cccn2CCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822327 ABBYHFLCNQLCLS-ZACQAIPSSA-N 428.508 2.460 10 20 IECD CCN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793718418 JMGABCSUDNKMSJ-SFHVURJKSA-N 442.585 2.157 10 20 IECD CC(C)=CCCNC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793826108 DGKFHFIHIHLGAT-UHFFFAOYSA-N 440.523 2.031 10 20 IECD Cc1cc(C(=O)CN(C)[C@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 794805529 XSOCCTCZQYANKN-SFHVURJKSA-N 447.557 2.014 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccc(C)cc3)[C@H](C)S(C)(=O)=O)nc12 797997752 QJROIKWCJZLHCY-LIRRHRJNSA-N 446.529 2.184 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2ccccc2F)C1)c1ccc(N2CCOCC2)cc1 803304663 GODXDKLDZMEIQJ-VGSWGCGISA-N 441.503 2.440 10 20 IECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 804083105 JCXAAKXGEMPKJP-HXUWFJFHSA-N 434.540 2.330 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](CN(C)S(C)(=O)=O)C2)cc1F 805094789 QKBGMAQDXVMZNH-QGZVFWFLSA-N 428.574 2.485 10 20 IECD COc1ccc(CNC(=O)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c(O)c1 806027978 AZXUUVPFDNQMGX-SFHVURJKSA-N 429.473 2.018 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc2nccnc2c1Br 807023600 BDUKOKHRSCURQY-JTQLQIEISA-N 445.273 2.489 10 20 IECD Cc1ccc(NC(=O)C2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)nc1 807291782 NTUYKIXKHBVXTP-UHFFFAOYSA-N 447.539 2.260 10 20 IECD CCCS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 808284000 GGETXCLLSUPEAB-UHFFFAOYSA-N 438.571 2.185 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CN1C(=O)NC(CC)(CC)C1=O 819525307 AHTQSHPMLOJAPG-UHFFFAOYSA-N 446.548 2.486 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nc(-c4ccccc4)no3)CC2)cc1 914523950 TZDLLUBANZBWHO-WJOKGBTCSA-N 440.525 2.343 10 20 IECD CCn1c(N2CCOCC2)nn(CN2CCCN(c3ccc(OC)cc3)CC2)c1=S 917487964 YLXGHIUXHRYKSX-UHFFFAOYSA-N 432.594 2.449 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(N2CCCS2(=O)=O)c1 919968845 MBFBPJMXVHVXLF-UHFFFAOYSA-N 443.569 2.365 10 20 IECD CC(=O)N1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)Oc2ccccc21 919969537 PIQZCNPESZOHRX-JOCHJYFZSA-N 427.476 2.217 10 20 IECD Cc1cc(C(=O)COC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c(C)n1-c1ccccc1 920603884 BYELDWDXKDKQLO-UHFFFAOYSA-N 448.479 2.023 10 20 IECD CCCNC(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920927641 ZUQJMTFYAYTOHS-QGZVFWFLSA-N 438.528 2.479 10 20 IECD Cc1nn(CCO)c(C)c1CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1116017705 XKDWUVVSQICDSS-UHFFFAOYSA-N 439.539 2.038 10 20 IECD CCOc1ccc(N2CCN(CC(=O)N(C3CCCC3)[C@H]3CCS(=O)(=O)C3)CC2)cc1 1319454740 SHANGZCVNWVKLI-NRFANRHFSA-N 449.617 2.166 10 20 IECD Cc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790112379 LHOPZCONBYUDGL-QRTARXTBSA-N 445.903 2.362 10 20 IECD Cn1cncc1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314133 WCRSZRGDHXBSIY-UHFFFAOYSA-N 443.554 2.028 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H]2CCOC2)C3)cc1 1799622451 BCTXLZFYUDTCPR-QXUYBEEESA-N 437.540 2.334 10 20 IECD O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804588252 SNQRKCLDWHVYSE-ZHRRBRCNSA-N 436.468 2.433 10 20 IECD O=C(COc1ccccc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806467192 AABGEGSMHPFTHZ-UZUQRXQVSA-N 448.479 2.286 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(F)nc1 1819692479 XBJBYKKXDGPPMI-CQSZACIVSA-N 426.408 2.370 10 20 IECD Nc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cs1 1826964097 JPBMIUMPTYWWNA-HNNXBMFYSA-N 431.518 2.079 10 20 IECD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250325 KIISPKYMPLAPRJ-UHFFFAOYSA-N 433.505 2.068 10 20 IECD O=C(c1noc2c1CCCC2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441628 MGKQFNSZYVMZAN-UHFFFAOYSA-N 447.495 2.163 10 20 IECD C[C@@H](Cc1ccccn1)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442193 FVFVQZKULCUQSL-SFHVURJKSA-N 445.523 2.257 10 20 IECD Cc1ccccc1NCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039062 PGVPPJNZZOGMLB-CSKARUKUSA-N 437.496 2.441 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)CCN(C)C3CCN(C)CC3)cc2F)CC1 303249024 AEXWTESNJRGPCY-UHFFFAOYSA-N 448.631 2.135 10 20 IECD Cc1c(CNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)n(C)c2ccccc12 527466069 PORJBXGIURURAJ-UHFFFAOYSA-N 429.480 2.398 10 20 IECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1ccc(N2CCSCC2)cc1 729285551 HWPCTJXZYYWWNY-UHFFFAOYSA-N 436.541 2.360 10 20 IECD C[S@@](=O)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 735045525 HSWNWQSDVFNBID-ZXXUSRDYSA-N 447.401 2.145 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)nc12 740301549 XTPNVWLVWZDCBC-DZGCQCFKSA-N 448.476 2.348 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cc2c(C)nn(-c3cncc4nnnn34)c2C)cc1 749770873 GOMVEJBMZIYXRW-UHFFFAOYSA-N 433.520 2.027 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)CC2)cc1F 753740967 AAPJKMMZOVSWTK-UHFFFAOYSA-N 433.505 2.119 10 20 IECD Cc1ccc(NC(=O)COc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 757702557 GAFXONZZJRSVQY-UHFFFAOYSA-N 433.530 2.099 10 20 IECD CC(C)(O)[C@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 758385595 UMWWIZIHFNEACD-HXUWFJFHSA-N 442.539 2.387 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3C[S@](C)=O)CC2)cc1F 762673146 OMRNQOGMZQDFRT-PMERELPUSA-N 433.505 2.000 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](S(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 763640348 GIWLBAGPQUVLRV-INMHGKMJSA-N 427.542 2.158 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1[C@H]2CC[C@H]1CC(O)C2 769878235 IMUUHDLDGGPUHE-KBPBESRZSA-N 447.469 2.229 10 20 IECD CCOc1ccccc1C(=O)NCC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 771447209 NEHZMLSOJHNGFZ-UHFFFAOYSA-N 434.876 2.376 10 20 IECD CCOC(=O)[C@]1(C(C)C)CCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 773921736 MWYHQPBFDJOYGJ-XUZZJYLKSA-N 433.593 2.089 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)c3c(C)noc3C)CC2)cc1 778393109 AHXZUBLSWBZORD-ZBTGYSDGSA-N 426.517 2.425 10 20 IECD C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788324652 XNTCNCKILIGZDL-KNQAVFIVSA-N 436.556 2.091 10 20 IECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828788 YOFKAWNNQINOLE-RHGYRFJNSA-N 449.567 2.455 10 20 IECD Cc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 789841470 ZECYAQKWTSWBFU-HNNXBMFYSA-N 431.508 2.442 10 20 IECD COCC[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789843406 KTEDJMRKKNVOQK-KRWDZBQOSA-N 435.540 2.068 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CNC(=O)c2cccs2)n1C 800767598 GZAQVBVUIXFNLV-UHFFFAOYSA-N 426.546 2.280 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662284 AMTFYAVXRGKIHH-UHFFFAOYSA-N 428.508 2.003 10 20 IECD C[C@](O)(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 807498065 VZOOJEJRWDTPAP-YKSBVNFPSA-N 426.513 2.314 10 20 IECD CC(=O)N1CCN(C(=O)[C@H](OC(=O)c2cc(C)n(-c3ccccn3)c2C)C(C)C)CC1 914903346 KRXMKQUNIWEJNQ-OAQYLSRUSA-N 426.517 2.361 10 20 IECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 916138244 AZKMWAAOFONOTO-UHFFFAOYSA-N 442.907 2.433 10 20 IECD Cc1cc2nnc(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2c(C)n1 917231010 RPIWJQVTGLRHRM-UHFFFAOYSA-N 430.509 2.125 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 918287633 RAVPJZRCMFFPSG-GASCZTMLSA-N 443.475 2.481 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918439690 MMTFCYOXASVNKO-UHFFFAOYSA-N 440.569 2.125 10 20 IECD COc1ccc(N2C[C@@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)c(OC)c1 919766526 AONGGLCYSMOXNR-SFHVURJKSA-N 439.512 2.210 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)o1)C2)c1cc(O)nc(O)c1 1777848415 TZFOBZZMEACBFS-JLTOFOAXSA-N 435.864 2.181 10 20 IECD C[C@@H]1C[C@@]1(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1780622285 JUFVMGQFGBSNNL-ZGFKMZHHSA-N 444.528 2.377 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1coc(Cl)n1 1805013894 MQCRWCIKPGLODW-YVEFUNNKSA-N 443.847 2.163 10 20 IECD Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n1 1807991568 QCLWAXPLBZOBOW-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992403 YAFRCSZGBCOWKS-JPYJTQIMSA-N 432.480 2.450 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ncc(F)cc3F)CC2)C1 1810547607 VIBYKYIUVGWMSA-UHFFFAOYSA-N 432.427 2.325 10 20 IECD O=C1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)c(O)c(Cl)c3)[nH]n2)N1 1817088316 BUCCZLJUJNVUCM-OCCSQVGLSA-N 447.879 2.059 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1cc(O)nc(O)c1 1817843982 LWNIACWIRGSNBW-OAHLLOKOSA-N 426.408 2.370 10 20 IECD Cc1nc(N)sc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844793 MHVXLIKSJSGHHE-GFCCVEGCSA-N 443.489 2.183 10 20 IECD C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848584 QZWYARPTPGBSTD-CZUORRHYSA-N 439.476 2.055 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1Cl 1847172529 ATCSOFKIPBRSCH-PGXISHIXSA-N 429.860 2.381 10 20 IECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN1CCCN(c2ccc(OC)cc2)CC1 226810851 XKDOLOQVMJXOKZ-QHCPKHFHSA-N 437.540 2.334 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(c4nncn4C)CC3)cc2F)CC1 730132347 BZQNDSWFMLMAKH-UHFFFAOYSA-N 429.544 2.185 10 20 IECD CCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730134639 IKMVDFGJNQFKIQ-IBGZPJMESA-N 433.572 2.415 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1S(N)(=O)=O 730843056 WVHUPWNSJUZFMA-GJZGRUSLSA-N 435.521 2.325 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 734072602 JFIQAIGEXUOBJY-UHFFFAOYSA-N 429.542 2.247 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 741675240 CZKQKFMSUOLREC-KRWDZBQOSA-N 431.558 2.454 10 20 IECD CCN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745738714 XWVQBFQVVPVHJD-IBGZPJMESA-N 441.555 2.226 10 20 IECD CN1CCOc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc21 746784174 SQUFXUGHXXFSKW-SFHVURJKSA-N 425.485 2.367 10 20 IECD CC(=O)N1CC[C@@](C)(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 747086917 VOBIQZGLKUGBBE-XMMPIXPASA-N 434.448 2.202 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CS(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 748841839 YHBOMEZHDFSINI-GASCZTMLSA-N 435.521 2.158 10 20 IECD COC1CCN(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 751084886 SRDAKMJBZPLBDP-UHFFFAOYSA-N 444.498 2.452 10 20 IECD COc1ccc(N2CCN(c3nnc([C@H]4CCOC4)n3C[C@H]3CCOC3)CC2)cc1F 752835655 DCATXVCRXUWFQN-SJORKVTESA-N 431.512 2.293 10 20 IECD O=C(COC(=O)c1ccc(F)cc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 758112571 ISCUXPLVWBIPNG-UHFFFAOYSA-N 435.383 2.183 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(F)c(C)cc3F)CC2)cc1 762623119 JWWMEVSUFQFQPY-UHFFFAOYSA-N 425.501 2.382 10 20 IECD CCN(C)c1ccc([C@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 765238133 FHXKKZXLMINSMR-IBGZPJMESA-N 431.606 2.340 10 20 IECD O=C(CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)NCc1ccc(N2CCOCC2)c(F)c1 766250052 LWSKLPPVKAJHLH-SFHVURJKSA-N 442.539 2.154 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cnn(-c2ccccc2)c1 768718187 WQRWTAKOBXOATF-UHFFFAOYSA-N 437.475 2.227 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)CN1C(=O)OC(C)(C)C 772867001 XGGBPMUHJYZWDF-STQMWFEESA-N 427.523 2.234 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N(C)Cc3ccccc3)CC2)cc(OC)c1OC 774330802 UULBITQZNRBGPI-UHFFFAOYSA-N 427.501 2.020 10 20 IECD COc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 774788356 PLVGKCMOLSITSZ-UHFFFAOYSA-N 436.556 2.160 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1O 774834273 DKYQONKIIMWUPO-UHFFFAOYSA-N 427.504 2.313 10 20 IECD C[C@H]1CN(C(=O)Cn2cc(NC(=O)N[C@H](C)c3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 775656161 YAFOXANXHBUOPO-IXDOHACOSA-N 428.537 2.468 10 20 IECD CC(=O)NC1CCC(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 784541564 LHSRVXDRGALHRM-FBIZOPLVSA-N 448.583 2.435 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(CN2CCOCC2)c1 787292557 SRBMRNRSGDZDFA-UHFFFAOYSA-N 438.572 2.250 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](COCc2ccccc2)C1 788312542 ITDWRBCZDYAYSP-QFIPXVFZSA-N 437.540 2.205 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCO[C@H](c2ccccc2F)C1 789812623 NUFDXRUORWXXKT-NRFANRHFSA-N 445.466 2.018 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 789822354 WCYUXZOXBVDCAZ-IAGOWNOFSA-N 448.583 2.435 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCc2c1cnn2C 789844307 FNUXGQYJRPVNDJ-IBGZPJMESA-N 427.574 2.126 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1cccc(F)c1 789862531 VBNFOOOHMKCJOL-NRFANRHFSA-N 444.576 2.414 10 20 IECD CN(Cc1cccc(Cl)c1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793721976 SYBXGISKARVTIZ-SFHVURJKSA-N 442.947 2.317 10 20 IECD 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CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](NC(=O)c3cccs3)C(C)C)nc12 919031704 TYFZNUHOOPCABB-MRXNPFEDSA-N 446.485 2.171 10 20 IECD C[C@@H](NC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C)c1ccc(N2CCOCC2)cc1 920887849 JCNZZKKLVPZHSH-CQSZACIVSA-N 449.511 2.239 10 20 IECD CCN(CC(=O)NN1C(=O)N[C@@](CC)(c2ccccc2)C1=O)c1ccc(OC)c(OC)c1 921062520 ZVSXICVAACKKBB-QHCPKHFHSA-N 440.500 2.419 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 921202866 IHUHZKSYAMTYCG-IMSXRSKXSA-N 446.636 2.457 10 20 IECD COc1ccc(N2CCN(C(=O)NCCN3C(=O)COc4ccccc43)CC2)cc1F 1320731616 ROJSKQFQUJDEHH-UHFFFAOYSA-N 428.464 2.092 10 20 IECD Cc1cccnc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836959843 SFDMUXKBJFYIAR-UHFFFAOYSA-N 440.500 2.122 10 20 IECD O=C(c1nc2ccccc2o1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442213 FCVLUDWTKVKOTG-UHFFFAOYSA-N 443.463 2.438 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H](C)N1CCOCC1 729594530 PHXOXDQHHVFHKD-HZPDHXFCSA-N 444.498 2.450 10 20 IECD 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2.481 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3cccc(OC)c3OC)CC2)cc1 742939905 LKZCFYGQJOMSJJ-UHFFFAOYSA-N 442.560 2.376 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4c3CCCC4)CC2)cc1 743432827 TZDPZNJUFKBUKA-UHFFFAOYSA-N 436.556 2.451 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1Cl 751212785 KOJVEUNQRVULCO-UHFFFAOYSA-N 430.935 2.384 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C(=O)C(C)(C)C)CC3(C)C)CC2)cc1 754225213 HPIUYBLRKPKCII-OAQYLSRUSA-N 446.636 2.147 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 758225230 XXBUNQKPFDHZKQ-HXUWFJFHSA-N 438.488 2.045 10 20 IECD COc1cc(N2CCN(C(=O)C[C@@H](NC(N)=O)c3ccccc3)CC2)cc(OC)c1OC 759406663 UTFBYTBJQNUKOA-GOSISDBHSA-N 442.516 2.161 10 20 IECD COc1cc(N2CCN(C(=O)C[C@@H](C)NC(=O)C3CCCC3)CC2)cc(OC)c1OC 760083169 BYUMXLXKKOIVOY-MRXNPFEDSA-N 433.549 2.446 10 20 IECD COc1cc(N2CCN(C(=O)c3c(C)nc(O)nc3SC)CC2)cc(OC)c1OC 760086265 SPAFAEJQQPQWTJ-UHFFFAOYSA-N 434.518 2.201 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnn3[C@H](C)C3CC3)cc2F)CC1 760224173 VYKNYYLKPVHLKF-MRXNPFEDSA-N 442.539 2.390 10 20 IECD Cn1ccnc1[C@@](O)(CCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)C(F)(F)F 761005953 RHPPTIQNEFBOFG-KRWDZBQOSA-N 446.813 2.384 10 20 IECD COc1ccc(N2CCN(CCNc3ncnc4ccc(S(C)(=O)=O)cc34)CC2)cc1 764801235 RWHPXNONAMNINW-UHFFFAOYSA-N 441.557 2.276 10 20 IECD O=C(Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 768463268 IEHDCPCNKOQHKQ-UHFFFAOYSA-N 448.347 2.079 10 20 IECD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)c1 769539713 UJOCFCADGZPMET-QGZVFWFLSA-N 428.485 2.125 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)NCCOC)cc3)c2)CC1 770287188 VPXMRFNXQNAKDL-UHFFFAOYSA-N 446.573 2.006 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](O)[C@@H](O)c1nc2ccccc2s1 779489536 RTBLXCMNIWAKPU-WOJBJXKFSA-N 445.516 2.107 10 20 IECD CN1CCCc2cc(CNC(=O)N3CCOC[C@@H]3c3noc(-c4cnn(C)c4)n3)ccc21 780826259 DIMHTZHXOBKIRF-LJQANCHMSA-N 437.504 2.136 10 20 IECD C[C@H](NC(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12)c1ccc(N(C)C)cc1 785603927 WWBIEEXWBZRLCG-LBPRGKRZSA-N 434.422 2.308 10 20 IECD Cc1nc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cs1 788928601 ASFROMOWWFDBPK-UHFFFAOYSA-N 427.574 2.012 10 20 IECD CCCNc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789797357 BVXBLRRTLAKYBX-UHFFFAOYSA-N 428.508 2.417 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCC[C@@H]3O)cc2F)C[C@@H](C)O1 789823006 CCVBKHYROYUHSV-HPNQWNLUSA-N 435.540 2.065 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCN3[C@@H](C)CCC[C@H]3C)cc2F)C[C@@H](C)O1 789823009 XTTNBAONVXDRSO-QGFMHUBQSA-N 448.583 2.435 10 20 IECD COCCCNC(=O)[C@H](C)N1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 792805593 KYGGKRLSBXEFAW-INIZCTEOSA-N 430.515 2.430 10 20 IECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 793908580 KADQLFSDSLLHIY-RBUKOAKNSA-N 430.593 2.327 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccoc2CC(N)=O)NC(=O)OC(C)(C)C)cc1 796728843 MRFYDUVKIIOGDV-KRWDZBQOSA-N 430.505 2.369 10 20 IECD CO[C@@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 798773667 XNYZRDODDJFBCN-JOCHJYFZSA-N 433.420 2.065 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3c[nH]c4cccc(F)c34)cc2)C1 799763486 PBJRDIZPTWGLDM-OAHLLOKOSA-N 430.505 2.487 10 20 IECD C[C@@H](NS(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1)c1ccc(N2CCOCC2)cc1 799765705 IRVRATRWDVNEJN-CYBMUJFWSA-N 448.936 2.396 10 20 IECD Cc1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 807356189 XWSOTFQWNQPDJO-UHFFFAOYSA-N 441.601 2.225 10 20 IECD C[C@H](O)C[C@@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769742 VKWWDUGGEYHHSN-ZOBUZTSGSA-N 425.476 2.135 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 808058247 LCQDKLJGBLVBSV-GOTSBHOMSA-N 436.556 2.043 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 915778263 FSLIUUVHPKUXDW-UHFFFAOYSA-N 431.496 2.198 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCCC(=O)OC)cc2)cc1 917751204 DUYJCCHYRFKMKN-UHFFFAOYSA-N 442.515 2.191 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 920482549 SGCYSSROKLMGPY-UHFFFAOYSA-N 425.488 2.084 10 20 IECD Cc1cccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1784711009 WYXJVJXAHPBMGG-YEWWUXTCSA-N 445.903 2.362 10 20 IECD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n(C)n1 1787066100 XYCNQTIHOBTBPR-UHFFFAOYSA-N 437.456 2.296 10 20 IECD O=C(CCC(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795401509 SNOFHFHWTWAGFG-QHBPRCKVSA-N 436.814 2.297 10 20 IECD Cc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798853368 DKMZVDWZVRMLGX-HHVYCJAJSA-N 438.480 2.028 10 20 IECD Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cn1 1807993521 JORPNVJQEBQKAZ-WZONZLPQSA-N 447.495 2.154 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C2CC(O)C2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811796271 HAZULPNLNMMHBQ-BECUHMJXSA-N 445.903 2.237 10 20 IECD COCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146277 AWAFVVLQVDFYDM-GOSISDBHSA-N 438.488 2.231 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccon2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146562 QFTYMAHPWLMHON-SFHVURJKSA-N 447.455 2.497 10 20 IECD CC[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827714962 KIAQUQVFMLABGH-RTWAWAEBSA-N 440.544 2.170 10 20 IECD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829073670 PPHLPKOEFJWJCD-MAUKXSAKSA-N 446.548 2.031 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3Oc4ccccc4NC3=O)CC2)cc1 9833549 LKUDCMXNNANHST-QFIPXVFZSA-N 438.528 2.113 10 20 IECD Cc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1Cc1ccco1 727177009 AOMHMYHGZAPMHT-MHWRWJLKSA-N 439.584 2.497 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 732999582 GVXRFQGBQCNMMB-ACJLOTCBSA-N 449.485 2.340 10 20 IECD CCN(Cc1ccccc1)c1ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)cc1 734843941 TUHVYZZOJALKCU-DNQXCXABSA-N 443.613 2.301 10 20 IECD CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCOCC1 742049901 HMACMLJIYPPRFL-UNMCSNQZSA-N 430.593 2.142 10 20 IECD COc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1-n1cnnn1 743888269 UYNKRRZMDWGFLW-UHFFFAOYSA-N 448.439 2.137 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)OC)c2)cc1OC 745978010 LVCBOUABVJDVDR-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CC(C)Cn1ncc2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cnc21 748226962 DAMCLPCQJROQDR-UHFFFAOYSA-N 441.557 2.252 10 20 IECD O=S(=O)(c1ccc(Cl)c(NC(=S)NCc2ncccc2F)c1)N1CCOCC1 752765735 CDSBDVJFBRWPSF-UHFFFAOYSA-N 444.941 2.382 10 20 IECD C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 755294244 BVKHBIVXPHLMQX-RDJZCZTQSA-N 433.553 2.101 10 20 IECD CCCOc1cccnc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 758936730 MMFFXPZMYUWCSZ-UHFFFAOYSA-N 431.464 2.319 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(F)cc3F)CC2)cc(OC)c1OC 759408560 DIFOMBHNNUXBEM-UHFFFAOYSA-N 435.427 2.278 10 20 IECD COc1cc(N2CCN(C(=O)NC[C@@H](c3ccco3)N(C)C)CC2)cc(OC)c1OC 760088389 ICRAGHAPCOSRKQ-KRWDZBQOSA-N 432.521 2.440 10 20 IECD CC(C)N1CCC(O)(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 761636637 FZUKANGCEBWKHE-HDICACEKSA-N 436.572 2.474 10 20 IECD CC(=O)N1CCN(c2ccc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2[N+](=O)[O-])CC1 763281657 WOHOPSXKOSXUCR-AWEZNQCLSA-N 442.472 2.036 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1 767993687 JPAQXAUIFXBKCZ-UHFFFAOYSA-N 431.500 2.395 10 20 IECD CCOC(=O)[C@@]1(C(C)C)CCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 773921729 MWYHQPBFDJOYGJ-QPPBQGQZSA-N 433.593 2.089 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccc(F)c(F)c3)CC2)cc1 778264872 HEIWPFZBQNCXMV-CMDGGOBGSA-N 445.466 2.373 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)Cc3c(C)noc3C)CC2)cc1 778286704 CRCKVJVRGIXCSZ-SCOAYWHSSA-N 426.517 2.252 10 20 IECD CC(C)n1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1N 783197446 JUZSPMAWADIJMV-HUUCEWRRSA-N 447.511 2.272 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1CN1CCOCC1 785441797 GZSVJOVMCMVCLG-UHFFFAOYSA-N 425.529 2.279 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 785563107 YYCXHULOOSUOIQ-WMZHIEFXSA-N 438.572 2.428 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)N4C)cc2)CC1 786258525 YXWOTRVZAVSWNT-MRXNPFEDSA-N 435.528 2.062 10 20 IECD Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318660 GVPMRVUVSVREAY-MRXNPFEDSA-N 427.549 2.277 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1Cl 789381385 CZXRROCEVXZSEP-OAHLLOKOSA-N 444.919 2.305 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 789818715 KJJCAULSWLJAQM-IRXDYDNUSA-N 435.540 2.379 10 20 IECD CC(C)O[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789833109 CVHMZSURKKBALS-UXHICEINSA-N 435.540 2.111 10 20 IECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848080 YPNAJIQVNKESNX-UZRRDOIRSA-N 437.631 2.052 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 793808977 CRAYYKJYIGYAFS-UUOWRZLLSA-N 430.593 2.407 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)cc1F 793809965 MJSPQVXPRUKJMP-UHFFFAOYSA-N 449.486 2.472 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1 802609613 FPZOOOHWGAKHKM-UHFFFAOYSA-N 438.488 2.452 10 20 IECD CC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803677039 DKDWWHGFBBSLHB-HXUWFJFHSA-N 428.577 2.446 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(c4ccccc4Cl)C3=O)ccc21 803686767 PITJIXLSSRSKHZ-GOSISDBHSA-N 440.931 2.260 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cnn(CC(F)(F)F)c2)cc1F 804852393 HCVJHXYQHZUGGI-UHFFFAOYSA-N 429.418 2.363 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 805135653 WMHALAOEBFQYGR-UHFFFAOYSA-N 425.315 2.086 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cc2c(cc1OC(F)F)OCO2 807288849 AGOATYIAEINASZ-UHFFFAOYSA-N 445.422 2.326 10 20 IECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807385200 FAMYJUZJILWLQG-UHFFFAOYSA-N 436.262 2.266 10 20 IECD COC(=O)C(C)(C)CS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 808283033 BOVTUIQZRRLNCB-UHFFFAOYSA-N 438.468 2.161 10 20 IECD O=C(Nc1ccccc1Cn1cncn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295806 HJCHVXTVXUEKSG-IBGZPJMESA-N 435.484 2.178 10 20 IECD C[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(N2CCOCC2)cc1 920870532 MFZFDGPDNFKNCG-SFHVURJKSA-N 445.589 2.027 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnc4c(cnn4C)c3)ccc21 1338401598 HWTOACFWNVWVPI-UHFFFAOYSA-N 441.513 2.305 10 20 IECD CC(C)(C)OC(=O)N1CCC2=S=C(C(=O)Nc3nc(-c4ccncc4)n[nH]3)C=C2C1 1603072397 DGAHIUFWVDVIJD-UHFFFAOYSA-N 426.502 2.464 10 20 IECD O=C(CC[C@@H]1CCOC1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784817547 VTHTULCUXIYIFA-SPLOXXLWSA-N 438.908 2.011 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cc(C2CC2)on1 1792707814 DMIMLHMJZCNBPH-IVWMJMPLSA-N 447.875 2.134 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(C)c1 1799784115 OVSOHOPGMXRAIW-QDMKHBRRSA-N 447.582 2.116 10 20 IECD COc1cc(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1800299548 YFLPUXCMEBMSFS-MUJYYYPQSA-N 447.582 2.116 10 20 IECD CC(C)N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)C(C)C 1815282487 YUDYVXHOEPFFSD-UGSOOPFHSA-N 447.561 2.198 10 20 IECD O=C(Cn1cncn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817609728 KVMGETLDIWPNJH-AWEZNQCLSA-N 445.867 2.072 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)CC1 1827082601 YGWSCMMCWHWYMR-QGZVFWFLSA-N 447.923 2.276 10 20 IECD COCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715791 SLMULCXVLNIKRA-NRFANRHFSA-N 440.544 2.436 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)CC1 1838031849 RCPNABDUBRWUQI-QRWLVFNGSA-N 441.887 2.030 10 20 IECD CCN1C(=O)c2ccc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)cc2S1(=O)=O 726562902 PKPFSQMWMMTWME-UHFFFAOYSA-N 443.525 2.258 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2OCc2ccccn2)SC1=S 727176632 NIKBNGLHTHJDCB-SFQUDFHCSA-N 449.579 2.411 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1 729063692 KPXLFVFIILZXRW-OAHLLOKOSA-N 441.484 2.218 10 20 IECD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NCCCSc1nccs1 733975159 XQSQHLFIQNFOHI-UHFFFAOYSA-N 430.533 2.018 10 20 IECD Cc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C(=O)N(C)C 741075470 YNQQDESYICKSIR-UHFFFAOYSA-N 444.557 2.253 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(Cl)c3OC)CC2)cc1 743432416 LSGHHPSHNZZALX-UHFFFAOYSA-N 446.935 2.234 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](C)CN3CCN(C)CC3)cc2F)C[C@H](C)O1 745646751 AFTTVWZGSNPTAV-QYZOEREBSA-N 435.588 2.122 10 20 IECD Cc1ccc2cccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)c2n1 753982829 ZRGZCBLBHZICNV-UHFFFAOYSA-N 435.483 2.414 10 20 IECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1-n1nnnc1C1CC1 754182827 HVHSUSNMZRSRSW-UHFFFAOYSA-N 449.515 2.211 10 20 IECD Cc1ncc(S(=O)(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)s1 754792198 IIETULBQVRMBEW-UHFFFAOYSA-N 448.549 2.186 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2CN2CCNC2=O)C2CC2)cc1 755210551 HCPIFDKASYHWOU-UHFFFAOYSA-N 435.528 2.408 10 20 IECD O=C(N[C@H](CO)Cc1ccc(O)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 757670807 GPAWEAZSPJZAEQ-HNNXBMFYSA-N 448.522 2.294 10 20 IECD CCCCn1c(N)c(N(CC)C(=O)CN(C)c2ccc(OC)c(Cl)c2)c(O)nc1=O 757855520 FAVBLXRDIYYISU-UHFFFAOYSA-N 437.928 2.483 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)[C@@H](C)N(c4ccccc4)C3=O)CC2)cc1 758192514 LPTYEPHYTWJAJQ-NQIIRXRSSA-N 438.528 2.035 10 20 IECD COCCc1noc(CN(C)[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 758802958 PVGTXUJLPHHOAZ-AWEZNQCLSA-N 448.479 2.493 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](NC(=O)NC4CC4)C3)cc2F)C[C@@H](C)O1 760658683 VWBGEMFNIUZEBZ-DAYGRLMNSA-N 433.528 2.185 10 20 IECD CNS(=O)(=O)Cc1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 760978789 TUUXVOPPBWHUNM-UHFFFAOYSA-N 437.905 2.059 10 20 IECD Cc1cc(=O)n(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 761861677 VKPUUPILUGVWPT-HUUCEWRRSA-N 432.452 2.134 10 20 IECD CN(C)CCOc1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccn1 762679412 MWWKWYIFGJISOP-UHFFFAOYSA-N 445.539 2.122 10 20 IECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2cccc(Br)c2O)CC1 765903167 GUBIADMMIRWVLY-UHFFFAOYSA-N 447.333 2.161 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)CC2)cc1 767305807 PTNHPNWJODYYNQ-UHFFFAOYSA-N 433.530 2.004 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COc3cccc(CC(N)=O)c3)cc2F)C[C@@H](C)O1 768516966 IXRDLLCRZFJBBV-HZPDHXFCSA-N 429.492 2.162 10 20 IECD CCc1onc(C)c1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769021911 DBABYMYFOSPNQT-UHFFFAOYSA-N 425.533 2.332 10 20 IECD CCOC(=O)N1CC[C@@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 770088423 QAKCGCCQVQKOCD-GFCCVEGCSA-N 437.408 2.331 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 773744230 QDTAVJLNGNPKNK-GOEBONIOSA-N 436.505 2.385 10 20 IECD COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)n2)cc1 779497044 DXMFEFRMDZEIQD-KRWDZBQOSA-N 449.511 2.218 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1 779648823 PPTJVQOWNUHPCB-IRXDYDNUSA-N 434.290 2.474 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 785294156 CLJGYCXVWJAJIQ-NSHDSACASA-N 439.390 2.076 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 785558816 JDHSQJULEITPPN-NRFANRHFSA-N 442.535 2.006 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](c2ccsc2)O1 788324884 ZGBZNCXCMXUPDA-JXFKEZNVSA-N 429.542 2.190 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCc4ccccc43)cc2)C1 788484787 OWYPDEMOGPPNEC-LEWJYISDSA-N 448.567 2.241 10 20 IECD C[C@@H]1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 789819088 LIDMEJOURNUIQD-BRSBDYLESA-N 435.540 2.377 10 20 IECD CC(C)n1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 803449960 APKXDZVYRTYOBY-UHFFFAOYSA-N 435.475 2.467 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3cc(F)ccc3F)cc2F)CC1 805006889 JFLSBIDEQJBVMH-UHFFFAOYSA-N 448.489 2.221 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(=O)NCCCSc2nccs2)cc1 806278451 SLEFYBGJTBBWBL-AWEZNQCLSA-N 441.600 2.029 10 20 IECD C[C@@H](NC(=O)C(=O)N(C)CCN1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 807672852 JMGJTIRHMWATGU-HXUWFJFHSA-N 437.588 2.210 10 20 IECD CC(C)C[C@@H](CO)N(C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769511 GPGPBMGLKJYRCD-RDJZCZTQSA-N 427.492 2.238 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCCc3cccs3)CC2)cc(OC)c1OC 808813382 HIGVSWBGQHIQFI-UHFFFAOYSA-N 447.557 2.172 10 20 IECD Cc1csc(N2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)n1 918117136 HOHKXDASFJCPFJ-GOSISDBHSA-N 442.589 2.185 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)CC2)cc1 918461766 KVGHDWYQWGQTAR-OAHLLOKOSA-N 438.484 2.092 10 20 IECD Cc1cc(C)n([C@H](C)CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 919314674 KUTVJCUULUFIIA-QGZVFWFLSA-N 432.496 2.286 10 20 IECD C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1=O 919971578 RGBZDFOETMASHB-OAHLLOKOSA-N 427.476 2.217 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(N2CCOCC2)cc1 920925921 MMIMSSWWPJSYJZ-MRXNPFEDSA-N 436.512 2.231 10 20 IECD CCC1(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)CCC1 1778328824 IYOBDACCTQVQTM-XMMPIXPASA-N 438.528 2.190 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2 1782007823 QGLHTOTVKKNLJA-DNVCBOLYSA-N 426.922 2.090 10 20 IECD Cc1[nH]ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1787691654 MDZAQXGZRSLTGZ-QITLCBANSA-N 433.892 2.295 10 20 IECD Cc1cc(C(=O)CN2CCC[C@H]2CN2CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 111192707 SHZABXJAYWNUAX-FQEVSTJZSA-N 444.601 2.484 10 20 IECD Cc1c(CNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)n(C)c2ccccc12 471231133 YRWVWOCECMMFSB-UHFFFAOYSA-N 427.526 2.279 10 20 IECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c1O 729859665 VNCUWWAVUBEPIJ-HNNXBMFYSA-N 449.485 2.026 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)cc1F 731408553 PZKSAIZIXRJPLZ-UHFFFAOYSA-N 427.480 2.456 10 20 IECD COCCOC1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 735078113 YTJUAGSXYFMUOH-UHFFFAOYSA-N 449.573 2.052 10 20 IECD CCCNC(=O)c1cccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 741368798 IPDYBXRSXGJVSK-UHFFFAOYSA-N 439.512 2.341 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(CC(C)(C)C)nn3C)CC2)cc1F 754216030 SDVPKDFKIKXDAM-UHFFFAOYSA-N 431.512 2.444 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(F)c1F 756164306 XNSDZIGINCAFBF-UHFFFAOYSA-N 444.431 2.206 10 20 IECD CS(=O)(=O)Cc1noc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 765246121 YCBNMYGKRPFPII-LLVKDONJSA-N 445.448 2.006 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccnn1Cc1ccccn1 765903291 IVKMLUSWCXOPHF-UHFFFAOYSA-N 430.262 2.049 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c1 772775816 OSMAEEZPWWGOJR-LUAWRHEFSA-N 448.497 2.323 10 20 IECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2F)C[C@H](C)O1 774355933 FQYWLYTXHYMPCH-KBPBESRZSA-N 431.464 2.148 10 20 IECD CSc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 776044846 MSYFFRLQRFSKOI-UHFFFAOYSA-N 447.582 2.207 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccc(Cl)cn4)CC3)CC2)cc1 779222026 SJEZGLMMHSCUFU-OAQYLSRUSA-N 445.995 2.049 10 20 IECD CCCc1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n(C)n1 784765923 CZWDGZQRSYKIEW-KRWDZBQOSA-N 433.940 2.451 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)cc1 785424541 JWSYNHNJZUQNQC-UHFFFAOYSA-N 434.540 2.452 10 20 IECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCN(c2ccccc2)CC1 788010462 LFJXYSHEAJTEIP-FQEVSTJZSA-N 437.588 2.038 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOc4ccccc4C3)cc2F)C[C@H](C)O1 789815831 ASUOLIYINILAJA-IRXDYDNUSA-N 441.503 2.477 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OC)c1OC 793912145 CNWYJLURMFVJGO-OAHLLOKOSA-N 429.517 2.315 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccc3OC)OC)CC2)cc1 794141389 QBHFLOOGBDWCOH-OUKQBFOZSA-N 439.512 2.499 10 20 IECD CN1CCN(c2ccc(CNc3ccc(C(=O)NCCN4CCOCC4)cc3)cc2)CC1 802760962 HAEOJBQLUDMFFZ-UHFFFAOYSA-N 437.588 2.113 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 803448991 KQFGAXHZCFKLPT-YOEHRIQHSA-N 425.476 2.399 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N(CCS(C)(=O)=O)C2CC2)cc1)C1CCCCC1 803677112 FZQACSMQFSXNLU-UHFFFAOYSA-N 435.590 2.107 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC([C@@H]4CCCO4)CC3)cc2F)CC1 805010148 VQCWGBNFARQPGQ-QFIPXVFZSA-N 446.567 2.001 10 20 IECD C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C(=O)NCCCSc1nccs1 806280911 YRBMRLANAUBOSW-QGZVFWFLSA-N 447.630 2.068 10 20 IECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(CN2CCOC2=O)cc1 807387209 DIAURYXHTOUGPM-UHFFFAOYSA-N 448.273 2.362 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O 808565535 LVTXXKGRRSURFJ-LJQANCHMSA-N 427.476 2.187 10 20 IECD COCC(=O)NC1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 917120175 ZSQZBDZQAJVHLC-UHFFFAOYSA-N 441.528 2.290 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)cc1 918229055 VQJUOHVRAOGXRE-UHFFFAOYSA-N 445.589 2.212 10 20 IECD C[C@H]1Sc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2NC1=O 918337935 HKNDAJHCQWOCAP-CQSZACIVSA-N 445.566 2.284 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3nnnc3SC)c2)cc1 918434985 XVNMFBZGOINFJH-UHFFFAOYSA-N 439.545 2.485 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)C3(O)CCC3)c2C)c1 918760771 UMKFXPAPHNYXRL-UHFFFAOYSA-N 443.452 2.308 10 20 IECD C[C@@H](NC(=O)N1CCCC[C@@H]1CCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 920921782 SROVIOIQGDTEAX-YLJYHZDGSA-N 438.594 2.088 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCCN3Cc3cccnc3)CC2)cc1 1318550842 NTSOFGSVWUQROE-DEOSSOPVSA-N 437.588 2.383 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1c(C)nc2c(c(C)nn2C)c1C 1321366738 NRVBCECGDVOFJC-KRWDZBQOSA-N 440.500 2.138 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc(Cl)nn1 1819685922 GTIPOCURMPEMPO-CYBMUJFWSA-N 443.851 2.279 10 20 IECD Cc1[nH]ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497283 BUKIQGJPZGXWLF-AWEZNQCLSA-N 446.558 2.212 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(O[C@@H]2CCOC2)cc1 740460974 VUDQGWBGQHCPFK-OAQYLSRUSA-N 445.541 2.411 10 20 IECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)N(Cc1ccco1)Cc1ccccc1O 743430564 KPFLJCWMXJYLAS-HNNXBMFYSA-N 446.529 2.231 10 20 IECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 743896054 ZKFRCRLRIDNDGK-SFHVURJKSA-N 433.512 2.135 10 20 IECD O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 746133267 GHRLDCRXKUCTFK-WJOKGBTCSA-N 448.516 2.248 10 20 IECD Cc1nc[nH]c1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 748405236 HDXCWMAFLHBUBS-UHFFFAOYSA-N 431.430 2.063 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 749625339 HWWLCMWIGVRRRC-IBGZPJMESA-N 441.484 2.172 10 20 IECD COC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 751373132 RROOGLNDDRBTPE-CQSZACIVSA-N 428.894 2.368 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 757769005 SGSDDJIWVZXKHG-LJQANCHMSA-N 437.548 2.140 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3Cc4ccccc4N3C(C)=O)CC2)cc(OC)c1OC 759223675 ULEFMKNSOQPDCK-FQEVSTJZSA-N 439.512 2.339 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 764260424 LVHICKCHCCQMOO-KGLIPLIRSA-N 449.529 2.294 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc4cc[nH]c34)CC2)cc1 773147672 IBNUKMYSPYEBMP-UHFFFAOYSA-N 435.528 2.444 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4ccccc4[C@@H]3CO)CC2)cc1 773511374 VMKHYQDKHILKEW-YSESTWPTSA-N 435.524 2.018 10 20 IECD COc1cc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 785587663 LFIXURNZJMTFNK-CQSZACIVSA-N 444.488 2.214 10 20 IECD Cc1nc(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 786481840 HWPFFAAKRRHPME-CQSZACIVSA-N 438.500 2.497 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCCCCC1 786627561 LUHUGEWPQUCPOA-QFIPXVFZSA-N 430.593 2.156 10 20 IECD O=C(NC1CCN(C[C@H]2CCCO2)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 787104064 FGIWEOXWRXXANQ-HXUWFJFHSA-N 441.528 2.274 10 20 IECD Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318655 GVPMRVUVSVREAY-INIZCTEOSA-N 427.549 2.277 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2ccc(F)cc2C1 789832651 BWIIOMQYYWEUMM-UHFFFAOYSA-N 429.467 2.127 10 20 IECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nc1Br 792970963 YICXXMUJCFOGQT-UHFFFAOYSA-N 433.306 2.244 10 20 IECD CCC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCCC1 793734707 VXBMEKKIYAZFBU-LJQANCHMSA-N 428.577 2.481 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)cc2Br)cc1 797432879 XBOISMAYYONWBW-UHFFFAOYSA-N 434.337 2.434 10 20 IECD CCn1c(C(=O)Nc2ccccn2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 801939373 SKGJDVOJRFEWFW-UHFFFAOYSA-N 425.468 2.420 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCC[C@@H](N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 803309523 ZFIIKGQMFNLLFE-DENIHFKCSA-N 428.577 2.177 10 20 IECD CC(C)(C)OC(=O)CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448481 AQYHAUYFGCEVSF-UHFFFAOYSA-N 441.475 2.221 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCN(c3ccccc3Cl)C2=O)cc1F 803661375 ZBUHBHWEBMQPRO-IBGZPJMESA-N 446.910 2.425 10 20 IECD Cc1cc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2)on1 805024241 GJRASCKBRQAYRF-UHFFFAOYSA-N 439.560 2.180 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccs1)N1CCN(C)CC1)c1ccc(N(C)C)cc1 807670535 GGUNYALPYLJPQI-FXAWDEMLSA-N 443.617 2.096 10 20 IECD CCc1nc(CN2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cs1 807675661 ZMSXZJRMYYYSJV-INIZCTEOSA-N 429.590 2.293 10 20 IECD C[C@H](NC(=O)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 807678260 VWGWQLRHAVDELY-KXBFYZLASA-N 441.507 2.492 10 20 IECD CC(C)[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769025 QWJAIDSFFWDSRO-QAPCUYQASA-N 425.476 2.256 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccccc2O)c(C(=O)NCC(F)(F)F)cc1F 810358522 BQEOBJUXVVQEHH-UHFFFAOYSA-N 427.354 2.387 10 20 IECD CC(C)(C)OC(=O)N1CC[C@@H]2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC[C@@H]21 816999666 CCOKWQVOJDNPIK-CJNGLKHVSA-N 439.534 2.235 10 20 IECD C[C@H](OC(=O)[C@@H]1CCN(C)C(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 912703361 HRAPPYSWINFXTA-UONOGXRCSA-N 434.448 2.201 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918444323 QOTICTZAKNWXJX-UHFFFAOYSA-N 449.529 2.028 10 20 IECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)cn1 1254027630 MAPKJFUTUSSYCH-UHFFFAOYSA-N 446.510 2.429 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1 1317886209 CIMYHONRDGUWFX-HNNXBMFYSA-N 437.949 2.123 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1n[nH]c(CC)c1Br 1324898852 UNYNNIHSRKSTFY-NSHDSACASA-N 426.267 2.050 10 20 IECD CCOC(=O)C1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCC1 1521783850 BANFOHXWGVPFGQ-GOSISDBHSA-N 430.549 2.311 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCCCC2)C1 1778815111 OTGXNFVTCLWFAG-IIBYNOLFSA-N 435.496 2.293 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1 1785092487 MUFGTDSUNHGOPD-DEOSSOPVSA-N 437.496 2.129 10 20 IECD CC1(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)COC1 1792314799 YHNNNYRZRNKTQI-UHFFFAOYSA-N 433.555 2.017 10 20 IECD CCn1nc(C(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799470532 YJUMABKPCKOEKH-MUJYYYPQSA-N 427.505 2.398 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccn3ccnc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845979 FKHFCFMLIJYSEV-MRXNPFEDSA-N 447.455 2.483 10 20 IECD COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 105781681 ADESNYZZFWMLGD-UHFFFAOYSA-N 429.429 2.118 10 20 IECD COc1cc(/C=C2/SC(N3CCCCC3)=NC2=O)ccc1OCC(=O)N1CCOCC1 210299398 GIFNPEJNWACKPO-XMHGGMMESA-N 445.541 2.389 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1 729064516 SOMDIQSOEHYUTF-AWEZNQCLSA-N 449.529 2.246 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)c(F)c3)cc2)C1 730174851 MLZMDKKTXKYINN-LJQANCHMSA-N 440.519 2.294 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(NC(C)=O)cc3)cc2F)CC1 730389568 AKMMTJPXVFBYNY-UHFFFAOYSA-N 441.507 2.181 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 731282042 FXCXKHNMHNCLEA-UHFFFAOYSA-N 434.537 2.393 10 20 IECD CC(C)CN(C(=O)CN(C)Cc1ccccc1O)c1c(O)nc(=O)n(CC(C)C)c1N 731842828 HWWXIXLIHQOKQX-UHFFFAOYSA-N 431.537 2.014 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)cc2F)C[C@@H](C)O1 734270549 UCVLMRUUSGRZRH-WSTZPKSXSA-N 447.599 2.407 10 20 IECD CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 749645736 LMTWDCVFJVDGNF-UHFFFAOYSA-N 435.502 2.198 10 20 IECD COC(=O)COc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751136033 CNDTXSUCBXPODA-SFHVURJKSA-N 435.498 2.314 10 20 IECD COC[C@@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752008618 YENPWLQOELDDFU-SFHVURJKSA-N 428.512 2.263 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc([S@@](C)=O)cc3)CC2)cc1 754163786 HSOUTMGJBLPVGH-YYNPFJLCSA-N 431.602 2.266 10 20 IECD Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1S(C)(=O)=O 758965221 JFTPADRIEPBFPW-SFHVURJKSA-N 446.525 2.250 10 20 IECD COc1cc(N2CCN(C(=O)Nc3cccc(C(N)=O)c3OC)CC2)cc(OC)c1OC 760030035 IOSCIHVMJXEEKW-UHFFFAOYSA-N 444.488 2.174 10 20 IECD O=C(c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1)N1CCOCC1 760983448 ZUCWNPNCEBWOBX-UHFFFAOYSA-N 443.887 2.482 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(F)(F)F)nc3)cc2)C1 761895299 JNODDLHJDMHLOK-CQSZACIVSA-N 449.433 2.057 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnn(CC(F)F)c3)cc2F)C[C@@H](C)O1 762414529 NMKZUFQQTBHWOR-BETUJISGSA-N 439.438 2.156 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@@H]1CCCS1(=O)=O 766349327 GERRHXNRUAAYSY-ODUNQGDFSA-N 444.625 2.423 10 20 IECD COc1ccc(N2CCC(NC(=O)c3ccccc3S(=O)(=O)CCN(C)C)CC2)cc1 767170477 KTGRCPZGRCCBMF-UHFFFAOYSA-N 445.585 2.429 10 20 IECD CCOC(=O)[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 774022725 HRAMKDWSSKZGFW-ADYSOMBNSA-N 442.584 2.160 10 20 IECD COc1ncc(/C=C/C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)cn1 775828445 YGYNOBONGXAQJL-VMPITWQZSA-N 428.514 2.262 10 20 IECD CCc1nn(C)c(CC)c1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778393980 CISORAITKKSRKD-QXMHVHEDSA-N 439.560 2.075 10 20 IECD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1ccc(O)c(O)c1 779479519 NRKQXSBBSGLVRN-WMZJFQQLSA-N 425.485 2.435 10 20 IECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)cc1 780708733 DLVVOYIMTMSSPV-UHFFFAOYSA-N 437.587 2.452 10 20 IECD Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)N(C)Cc1ccccc1O 781100199 XJTPWQUUWYHYQS-UHFFFAOYSA-N 442.541 2.433 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCC1CCN(CC(F)(F)F)CC1 788935224 CHUSFLWGXGERJH-UHFFFAOYSA-N 426.483 2.294 10 20 IECD CC(C)C[C@H](CCO)CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789828341 XMQYUYNUDIZNPU-LNLFQRSKSA-N 437.556 2.216 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1C[C@H](O)c1ccco1)c1ccc(N2CCOCC2)cc1 803310625 MKNPLKSSPMIXAN-YYWHXJBOSA-N 441.528 2.408 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1F 803661601 HHCDMUZPPDRZME-JKSUJKDBSA-N 436.528 2.460 10 20 IECD COc1cc(F)ccc1N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803665236 ZYZNXQYCUDUQLQ-UHFFFAOYSA-N 432.471 2.004 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c4c(F)cc(F)cc4c3=O)cc2)C1 806539968 ZUSGSLBAVAHKNM-AWEZNQCLSA-N 440.450 2.438 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)o1 806793252 HOBXMGYTFXCQSU-HXUWFJFHSA-N 429.517 2.393 10 20 IECD CC(C)C[C@@H](CO)N(C)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769512 GPGPBMGLKJYRCD-WBVHZDCISA-N 427.492 2.238 10 20 IECD CC(C)N1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807771637 WLTBOXXTESJYLO-QGZVFWFLSA-N 438.519 2.316 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@H]3CCCc4ccc(S(N)(=O)=O)cc43)cc2)C1 810210945 IEXXEVBBPQDLSH-AVRDEDQJSA-N 442.585 2.203 10 20 IECD COCc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc(C(=O)OC)c1 815446970 JDOVKHHMYQDISM-UHFFFAOYSA-N 425.485 2.257 10 20 IECD CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 815612449 NAZWVZGTXCBTIH-CYBMUJFWSA-N 430.457 2.107 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(C[S@@](C)=O)c3)CC2)cc1 824766368 UIBKXXADRMVTGY-SSEXGKCCSA-N 430.526 2.079 10 20 IECD COCCNS(=O)(=O)c1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 914438898 VAXHFQZEXWSZKB-UHFFFAOYSA-N 431.558 2.482 10 20 IECD COCCNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 914439291 HSMIKQZXHDUOIV-UHFFFAOYSA-N 431.558 2.482 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)Nc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 915877616 XSWPIXQXCKSTLU-QGZVFWFLSA-N 446.573 2.095 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 916645013 LFLVFEIYQCPNIK-IBGZPJMESA-N 445.585 2.210 10 20 IECD C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)S(=O)(=O)c1ccc(F)cc1 918373432 ZHRLBFKOZUDLHT-WBVHZDCISA-N 447.532 2.006 10 20 IECD COCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918436804 DYFVODMLCDSKKE-UHFFFAOYSA-N 445.491 2.067 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(C(N)=O)c3)cc2F)C[C@@H](C)O1 919063179 VOZLAOUPHFVQLF-HUUCEWRRSA-N 443.475 2.011 10 20 IECD CCc1c(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1C 919174233 GLUXOCQCYOQAOE-GASCZTMLSA-N 432.496 2.208 10 20 IECD CNC(=O)COc1cccc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920866597 GGDVNPBQKKFOEL-KRWDZBQOSA-N 426.517 2.208 10 20 IECD Cc1cc(C(=O)NCC(=O)N2CCN(C)CC2)c(C)n1-c1ccc(Br)cc1 1350881194 OFZHXPXEFOVTOV-UHFFFAOYSA-N 433.350 2.360 10 20 IECD O=C(c1ccc(F)nc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007306 PSABBQSJRZKJCP-FQEVSTJZSA-N 435.839 2.043 10 20 IECD Cc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1795654650 HPLRYRVJGGWVCM-BJWYYQGGSA-N 431.583 2.036 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@@H](c2ccccc2)C1)c1cc(O)nc(O)c1 1797752156 SOARPHJRMSHJES-SFNKJDCFSA-N 436.468 2.262 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H]1CCc2ccccc21 1804336231 LHBVARNCQQNPAM-KYHPRHEASA-N 443.594 2.215 10 20 IECD CC(C)OCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1805016666 DCOHWQRJXWHJNZ-UHFFFAOYSA-N 440.544 2.436 10 20 IECD O=C(/C=C/c1cccnc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721664 NZIGQDWVWOGHNZ-ZRFDWSJLSA-N 437.481 2.284 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3nccn23)[nH]n1)c1cc(O)nc(O)c1 1817847293 SSTOAQPSZXFHSY-HNNXBMFYSA-N 447.455 2.483 10 20 IECD CN(C)c1cncc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1842174299 ZTWMJQDKODFLBB-UHFFFAOYSA-N 430.892 2.343 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cc(Cl)ccn2)C1 1844434700 OHHHNMOCWODKGA-UHFFFAOYSA-N 437.887 2.345 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(N2CCCC2=O)cc1 30504042 FIPCXUQUOIAKDZ-UHFFFAOYSA-N 429.542 2.471 10 20 IECD CCCN(CC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)Cc1ccccc1O 110081869 QUNDMIJDCQATEI-UHFFFAOYSA-N 447.557 2.264 10 20 IECD COc1ccc(N2CCC(NC(=O)CN3C(=O)N[C@]4(CCCC[C@H]4C)C3=O)CC2)cc1 110359441 IKWNMBFZOWXNAO-MWTRTKDXSA-N 428.533 2.281 10 20 IECD O=C(NCCCNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)c(F)c1 303453687 JIKKCHWYZFCJFC-UHFFFAOYSA-N 432.471 2.421 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)NCc3ccc(F)cc3)cc2F)CC1 730235429 XRSIDVRCDZEWEL-UHFFFAOYSA-N 445.514 2.222 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC)c(F)c3)cc2F)CC1 730391931 YQXRRKUKDUUBOJ-UHFFFAOYSA-N 432.471 2.370 10 20 IECD O=C(Nc1ccc(NC(=O)C2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 731405541 GYGLOPBEMUGZSM-SFHVURJKSA-N 438.484 2.282 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCCS(=O)(=O)C1 733959145 UUGNIVPWWKDVHI-GVIGZQTCSA-N 444.625 2.423 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(O[C@H]4CCOC4)c3)CC2)cc1 754031702 WLQMRHZWZWKMCR-QFIPXVFZSA-N 440.544 2.200 10 20 IECD CNc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 756207639 WERPWONBPXZULM-BETUJISGSA-N 436.509 2.411 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](C)N3CCc4ccccc4C3)CC2)cc1 758209128 IAVXXPSPMXEEBA-OFVILXPXSA-N 438.616 2.215 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 758486869 VEEUDMPCVPJQTE-LBPRGKRZSA-N 444.456 2.359 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(OC)c1 761274746 WZSYWILSOPAERM-UHFFFAOYSA-N 444.487 2.052 10 20 IECD C[C@H](C(=O)NC(=O)Nc1ccc2c(c1)OCCO2)N1CCOc2cc(N(C)C)ccc21 762341720 FCQVJGGVTIKMDY-CQSZACIVSA-N 426.473 2.459 10 20 IECD COc1cc(Br)cc(CN2CCN(c3ncnc4c3cnn4C)CC2)c1O 768234673 MIVWWHOJBGVGMZ-UHFFFAOYSA-N 433.310 2.162 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1 768698820 ZFGMGZXENXCWCY-UHFFFAOYSA-N 437.496 2.431 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 770347571 QSIFRZYFSQYINK-UHFFFAOYSA-N 445.564 2.117 10 20 IECD CCC(=O)N1CC[C@@H](C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 773221724 ASJBHUYKVUQXLZ-CQSZACIVSA-N 434.448 2.202 10 20 IECD COC[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 778302422 QJPXAOWDFGVELT-PISNEZEASA-N 427.501 2.305 10 20 IECD O=C(Cn1cc(CCCO)c(C(F)(F)F)n1)NCc1ccc(N2CCOCC2)c(F)c1 778599893 SCELHGHGOSYHDT-UHFFFAOYSA-N 444.429 2.119 10 20 IECD COC(=O)COc1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cc1 782190382 ZTFBMFVUELUIED-LGMDPLHJSA-N 436.555 2.162 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 788318632 GEZVWFBBKCHOEQ-OFNKIYASSA-N 437.540 2.424 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1nc2ccccc2n1C1CC1 788332471 NJIPOXWWTHVSMX-UHFFFAOYSA-N 433.512 2.140 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(F)c1 790870496 COWZJJGJVUDMHP-UHFFFAOYSA-N 440.493 2.371 10 20 IECD Cc1ccn(C[C@](C)(O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(=O)c1 790896375 FXHLCELLOLOBAK-AVRDEDQJSA-N 433.936 2.048 10 20 IECD CC(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793723897 OGQDACDPMHAGLD-UXHICEINSA-N 428.577 2.289 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@]2(CCOC2)O1 794307744 DNFWVJTWJHPWKK-DJJJIMSYSA-N 438.527 2.275 10 20 IECD CN(C)[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cncn1C 798163606 YIANNWRGMLQNMH-GOSISDBHSA-N 425.455 2.195 10 20 IECD CNS(=O)(=O)c1ccccc1S(=O)(=O)N(C)Cc1ccc(N2CCCCC2)cc1 799750074 USKXYCZVDSGJLV-UHFFFAOYSA-N 437.587 2.406 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cc(F)ccc43)cc2F)CC1 802553627 FKRJGFDLCAGRDB-UHFFFAOYSA-N 428.483 2.312 10 20 IECD CN(CC1(O)CCCC1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449549 CZPMYHADNWFZHE-UHFFFAOYSA-N 425.476 2.137 10 20 IECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662668 ZKCVMZAVYWTPKJ-QGZVFWFLSA-N 428.508 2.159 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H](C)C[C@@H]3C)CC2)cc(OC)c1OC 806192041 PSHMDMVSQSHFQB-XYJFISCASA-N 433.549 2.302 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(C(=O)CCC2CCCC2)CC1 806280058 IOMLUJGLAFLPPX-UHFFFAOYSA-N 438.619 2.383 10 20 IECD CCN(C[C@@H]1CCOC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769858 JCHBKGCCEGIBLL-JKSUJKDBSA-N 425.476 2.258 10 20 IECD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1ccc(N3CCSCC3)cc1)C2=O 917386321 UHIVAISBJANPIK-OPAMFIHVSA-N 430.574 2.357 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)C[C@@H](C)O1 917710825 XSJIQAABVWYRRU-LMMKCTJWSA-N 440.519 2.499 10 20 IECD Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918466072 YIEFZKNIGPCUNB-GOSISDBHSA-N 437.544 2.018 10 20 IECD Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1S(N)(=O)=O 918702991 FXGOKXPRGSPKFN-GASCZTMLSA-N 435.521 2.325 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccc(F)cc3)CC2)cc1 1253852026 BOSHYZPQVYHFOI-UHFFFAOYSA-N 435.521 2.242 10 20 IECD COc1cc(F)cc(F)c1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 1320629696 LGMMCQMWJPGZAX-UHFFFAOYSA-N 425.457 2.443 10 20 IECD O=C(CNS(=O)(=O)c1ccccc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1327555063 FXFHWAVNOOQOBP-OAHLLOKOSA-N 439.484 2.352 10 20 IECD C[C@H]1C[C@]1(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1780622266 JUFVMGQFGBSNNL-BQWZEPDZSA-N 444.528 2.377 10 20 IECD CC[C@@H](C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792314808 YSUAPNQBDDLASJ-ACJLOTCBSA-N 449.598 2.388 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccc(F)cn1 1796932466 AXRUJVPTIORFIR-VBUUOAMHSA-N 435.459 2.265 10 20 IECD Cc1cnn([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796935370 BERJNBNKEIWHNN-XEYPJELSSA-N 448.527 2.184 10 20 IECD Cc1cc(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1799664200 WNLMPYVEDBPHFW-BJWYYQGGSA-N 431.583 2.416 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990239 GZMHFEQSJPAESI-SBUREZEXSA-N 448.479 2.286 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1 1814185819 GLAJDROEUXVASL-QFBILLFUSA-N 446.598 2.138 10 20 IECD CCN(CC)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821673931 OQZVNCKMSNYPIQ-YOEHRIQHSA-N 444.536 2.500 10 20 IECD CC(C)/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840626890 MPPMSLRWJJFEQY-YEFOHOTDSA-N 438.908 2.033 10 20 IECD CC[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)OC(C)(C)C 1845234377 HHMDOMZOYNYYJD-HNNXBMFYSA-N 448.520 2.003 10 20 IECD O=C(c1cccnc1S)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034694 MBGHKGNUJIQJSY-FNORWQNLSA-N 427.482 2.018 10 20 IECD CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)N1CCOc2cc(N(C)C)ccc21 475956307 PWEMZGTUSNWENY-INIZCTEOSA-N 432.546 2.471 10 20 IECD CCOC(=O)C1=C(CN2CCN(c3ccc(OC)cc3)CC2)NC(=O)N[C@@H]1c1ccco1 727110377 LRSVTPXYOYJBRM-OAQYLSRUSA-N 440.500 2.282 10 20 IECD CCOc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1OCC 727176421 KNCKJRBEWQOACI-PTNGSMBKSA-N 430.573 2.234 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(F)ccc3Cl)CC2)cc1 728143593 USGNPUSVLUMPBY-UHFFFAOYSA-N 434.899 2.365 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccc(OCC(=O)OC)cc3)cc2F)CC1 730192556 GSVGQPSXBLHCCA-UHFFFAOYSA-N 429.492 2.449 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)cc1[C@]1(C)NC(=O)NC1=O 732526440 RQNGXQONQSYAQJ-NRFANRHFSA-N 444.513 2.151 10 20 IECD CN(Cc1ncc[nH]1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 734865211 OXRVBNWVDHTEPU-UHFFFAOYSA-N 431.430 2.097 10 20 IECD COc1ccccc1-n1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 742279353 UMPKKLPHLXAOJF-UHFFFAOYSA-N 446.504 2.335 10 20 IECD CN(C)c1ccc(CNC(=O)NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1F 746978503 ULDFKFIHICQAJE-MRXNPFEDSA-N 430.480 2.016 10 20 IECD O=C(COC(=O)c1cc(-c2ccccn2)no1)NCc1ccc(N2CCOCC2)c(F)c1 750955468 SZAFDZBNEVADJS-UHFFFAOYSA-N 440.431 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)CCC(=O)N3CC(=O)Nc4ccccc43)CC2)cc1F 753740613 UQOASWNLXJGDDV-UHFFFAOYSA-N 440.475 2.248 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](Cc4ccccc4)C3)CC2)cc1 754234530 OTXHNTIUDXZUIM-ILBGXUMGSA-N 425.573 2.122 10 20 IECD COC(=O)[C@@H](C)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 761095685 ASQUQSVUMTVMTJ-JBBGTMGVSA-N 443.344 2.328 10 20 IECD O=C(NC[C@H](CO)Cc1ccco1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 761124013 KJVJSJWAQWCYKX-CYBMUJFWSA-N 436.511 2.429 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccccc1C[S@@](C)=O)c1ccc(N2CCOCC2)cc1 762639448 HAXSMBUMBUHIEB-BEIWTESXSA-N 429.542 2.218 10 20 IECD COc1cc(CN2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc(OC)c1OC 768463789 MKCCEHOXNZNUEM-IBGZPJMESA-N 430.501 2.162 10 20 IECD CCN(CC)C(=O)COc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 769685242 BMNSKITYUPXJJW-UHFFFAOYSA-N 435.502 2.263 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3c(OC)cccc3OC)CC2)cc1 772349925 NGRDKXOGLXFUDP-UHFFFAOYSA-N 449.573 2.203 10 20 IECD O=C(CNc1ccccc1N1CCC(O)CC1)NCc1ccc(N2CCOCC2)c(F)c1 772905368 YERFLUBSSQDMQK-UHFFFAOYSA-N 442.535 2.352 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(OC(F)F)cn3)CC2)cc1 773607553 CLVBZKWOWBVUMG-CMDGGOBGSA-N 446.454 2.213 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(N(C)C)cc1 774855337 CAVTZKYBBRTYEH-VGSWGCGISA-N 442.535 2.259 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)Cc2cccc3cccnc23)cc1C(=O)O 776505444 KEVUDWLGUHUPCU-UHFFFAOYSA-N 435.483 2.246 10 20 IECD O=C(CN1CCO[C@H](Cc2ccccc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 776607495 DLDFVIXBBPQSQR-OAQYLSRUSA-N 427.520 2.222 10 20 IECD COCCN(Cc1ccc(C)o1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778326768 RDPUIFVICHDICV-KHPPLWFESA-N 441.528 2.477 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CO)c3ccc(Br)cc3)nc12 782074465 KJHNUXRAKPTNJZ-OAHLLOKOSA-N 435.278 2.197 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 785868526 FJFUNKCONCHGOS-KDURUIRLSA-N 432.609 2.494 10 20 IECD Cc1cc(Cl)ccc1S(=O)(=O)NCCNCc1ccc(N2CCN(C)CC2)cc1 796515726 LPQWLQISSUYSOQ-UHFFFAOYSA-N 437.009 2.468 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@@H]1COC(=O)N[C@H]1CCOC1 796529325 GYMQZEZRTRDQBE-PZJWPPBQSA-N 432.565 2.081 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(Cl)c(-c4nn[nH]n4)c3)CC2)cc1 799769648 XGTCLRUJUMSEJO-UHFFFAOYSA-N 448.936 2.476 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1 806913189 RPVGDBQHOBPFGN-UHFFFAOYSA-N 436.443 2.110 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)Oc3cccc(OC)c3)CC2)cc1 807631121 FKJSXUBSLCZUNF-SFHVURJKSA-N 441.528 2.326 10 20 IECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)n2C 808810515 QCTOCIWZSQSOIY-SFHVURJKSA-N 436.512 2.411 10 20 IECD Cc1c(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cnn1C 813700680 RSMUCNNWHUVCLE-QGZVFWFLSA-N 437.566 2.339 10 20 IECD CCCCN(C(=O)CN1CCCN(c2ccc(OC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 917089699 FQRDQSYOUDUDTD-FQEVSTJZSA-N 437.606 2.023 10 20 IECD Cc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2=O)cc1 917832271 RAEKBKIHFPIWEX-VXKWHMMOSA-N 448.567 2.362 10 20 IECD Cc1ccccc1[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(N)=O 917834842 RHQBSSCAXLINOQ-WIYYLYMNSA-N 437.544 2.113 10 20 IECD O=C(COC(=O)[C@@H]1COc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 918909897 IURGRCWXTBJCII-SFHVURJKSA-N 428.460 2.073 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCC(=O)N3CC(=O)Nc4ccccc43)CC2)cc1 1253864373 UCTLMVISKIUGHD-UHFFFAOYSA-N 436.512 2.499 10 20 IECD C[C@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCN(C)CC2)c(F)c1 1327145460 IPANKAIKZPSEDA-GOSISDBHSA-N 434.581 2.424 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCSC3)C2)C1 1785478398 XYBDYNQLIRZTJU-RBZFPXEDSA-N 440.949 2.338 10 20 IECD COc1c(Cl)ccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799414768 TVSXWEWHLICCSV-CLLJXQQHSA-N 432.864 2.115 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CS(C)(=O)=O)C3)cc1 1800513203 CLOWTYTWKHUUKV-NUZGMZIFSA-N 443.569 2.391 10 20 IECD CCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844211 TVCUAUZIAQBRAH-CQSZACIVSA-N 425.449 2.052 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc(F)n1 1819734755 FPUPOMLKJFVPRW-AWEZNQCLSA-N 426.408 2.370 10 20 IECD COc1ccc(Cl)c(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1F 1843251008 MTMSCHZLHGOLKU-UHFFFAOYSA-N 449.866 2.354 10 20 IECD COc1cccc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847039240 XQFCCYNXPIWJSD-VQHVLOKHSA-N 438.480 2.271 10 20 IECD CN1CCN(c2cc(N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ncn2)CC1=O 302550532 IAUWESAFZDDFPC-OAHLLOKOSA-N 432.475 2.437 10 20 IECD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NCc2ccc(N(C)C)cc2C)CC1 734662131 USCQBVBELCJNAD-UHFFFAOYSA-N 447.580 2.378 10 20 IECD CC(C)CCNC(=O)C1CCN(C(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)CC1 738300731 XRNKTPIMQWKCCR-UHFFFAOYSA-N 444.620 2.356 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 740491870 OOBZISRQVDKLJH-QFIPXVFZSA-N 439.512 2.288 10 20 IECD CN(C)c1ccc(CNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1F 742247539 KIKOTOZPWCMRBT-FQEVSTJZSA-N 439.491 2.058 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(Cn4cncn4)c3)CC2)cc1 743306042 VTPPBQKQQYKLTM-UHFFFAOYSA-N 435.532 2.279 10 20 IECD CS(=O)(=O)Cc1ccccc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746771182 ZCBCWAWRNQTSSW-QGZVFWFLSA-N 444.557 2.255 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(CO)C[C@@H]3c3ccccc3)CC2)cc1 753078905 BRTASTIENAERHU-BHNMBBMISA-N 449.551 2.182 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3cc(OC)c(OC)c(OC)c3)CC2)cc1 758229408 GENPOMBIBHGAEA-SFHVURJKSA-N 432.517 2.283 10 20 IECD COc1cc(N2CCN(C(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc(OC)c1OC 759243514 ZQPJIKQDJFXAOA-UHFFFAOYSA-N 427.501 2.377 10 20 IECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](c4ccc(OC)c(F)c4)C3=O)CC2)cc1 761181434 AIZUAXDEIXQNEV-OAQYLSRUSA-N 442.491 2.258 10 20 IECD CCOC(=O)CNC(=O)C1CCN(C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 771976684 CDXRHFQNSORQQZ-UHFFFAOYSA-N 436.528 2.273 10 20 IECD COC(=O)[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 778320326 YAYCVJNEJGJEEC-FRHQNKJESA-N 443.544 2.138 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)cc(F)c3F)c2)CC1 780407208 IZKORCKESVAQET-UHFFFAOYSA-N 439.440 2.132 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1 784027883 OVACUCUEOQVSQK-UHFFFAOYSA-N 438.528 2.471 10 20 IECD Cc1ccc(CSCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 785415921 RMMMVUWNZRPRJU-UHFFFAOYSA-N 427.570 2.497 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3nnc(C4CCCC4)o3)nc12 786752741 GXEKJOAOXKYOCB-UHFFFAOYSA-N 429.433 2.328 10 20 IECD CN(C)c1ncccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787631190 IOEWBOLFMALPKE-INIZCTEOSA-N 447.486 2.150 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21 788281833 UQSIJRWJGHJTLX-SFHVURJKSA-N 430.549 2.201 10 20 IECD C[C@H](CN1CCOCC1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 790134898 GCSCQCIGDLHIPZ-CQSZACIVSA-N 439.559 2.047 10 20 IECD Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NS(=O)(=O)c3cccc4nonc34)cc21 799932803 WWOICZKDYHMSGV-UHFFFAOYSA-N 442.501 2.204 10 20 IECD CC(=O)c1ccc(N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c(F)c1 803663831 BTZOEKOLXQMGCQ-UHFFFAOYSA-N 444.482 2.198 10 20 IECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768930 BWNZMLKHOKGULA-TXPKVOOTSA-N 439.503 2.383 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O 808543559 XMWFEGFOIDMJCV-IBGZPJMESA-N 438.528 2.031 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 808583805 GYTWRTAHPAGSAQ-CQSZACIVSA-N 438.962 2.317 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 813590297 KBWLNSKEBCKFQS-UXLLHSPISA-N 427.542 2.015 10 20 IECD C[C@@H](OC(=O)[C@H]1CCN(C)C(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 912704735 WBEHYXSRVAUKSI-KGLIPLIRSA-N 434.448 2.201 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1C 917758332 PVRNMMZJQPEHIN-UHFFFAOYSA-N 429.476 2.474 10 20 IECD CC(C)N1C(=O)c2ccc(C(=O)Nc3cccc(N4CCOCC4)c3)cc2S1(=O)=O 918371006 AGIOAOLFDCRYAR-UHFFFAOYSA-N 429.498 2.328 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920466285 HBJKPYBALFBISS-UHFFFAOYSA-N 427.504 2.168 10 20 IECD CCn1nc(C(C)C)cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1317965787 FEEYFDIARYZTFT-UHFFFAOYSA-N 432.496 2.475 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1Cc1ccncc1 1320692014 JNDYSBUQIBQVFG-RBUKOAKNSA-N 427.501 2.138 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccccc1O 1785807333 HUNIETXWOQSMFC-ODYMNIRHSA-N 446.887 2.364 10 20 IECD O=C(COc1cccc(Cl)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601137 XSNNFGFGCCKCMY-MUJYYYPQSA-N 431.876 2.477 10 20 IECD CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc1C 1800640959 FJITZQVVUCYJIG-BCDXTJNWSA-N 438.484 2.325 10 20 IECD COc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1C 1802048627 SVZSBULNVQBFJD-BCDXTJNWSA-N 425.485 2.304 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1cnco1 1815433244 HTOUIESQMUPDSJ-KRWDZBQOSA-N 447.455 2.497 10 20 IECD CCc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)co1 1819896197 YYMHMOCGNYRXJH-CQSZACIVSA-N 426.433 2.386 10 20 IECD Cn1cc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn1 1827090572 QGOYVDDEGDKUMH-LJQANCHMSA-N 441.532 2.092 10 20 IECD O=C(c1ccc(CO)o1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428272 LXFVOSPSOKGOHO-QGZVFWFLSA-N 429.473 2.125 10 20 IECD CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n(C)n1 1829321947 YFCRDXIKYKAFPA-SFHVURJKSA-N 441.532 2.336 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ncc(F)cc2F)C1 1841737031 VAKMPLOOVYOSQJ-HWKANZROSA-N 431.395 2.007 10 20 IECD COc1ccc(C2(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)CCC2)cc1 1843250606 QMGSFLZTFFHVGI-UHFFFAOYSA-N 437.496 2.440 10 20 IECD O=C1CC(C(=O)N2CCCC23CN(C(=O)C(F)(F)c2ccco2)C3)=NN1c1ccccc1 1843442284 ISJXIQDDGUCLCH-UHFFFAOYSA-N 442.422 2.368 10 20 IECD O=C(c1c(F)cncc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039005 XAIUJMIVNIVBRO-HWKANZROSA-N 431.395 2.007 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(F)ccc3F)CC2)cc1 12068983 JJBGUUIRVCGFSR-UHFFFAOYSA-N 425.501 2.464 10 20 IECD Cc1cc(C(=O)COC(=O)CN2C(=O)CN(C)C2=O)c(C)n1-c1ccc(OC(F)F)cc1 19113009 QPKIFOSYMGYDMM-UHFFFAOYSA-N 449.410 2.315 10 20 IECD Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cs1 728597779 SMGZIAAJMSVNOQ-UHFFFAOYSA-N 449.602 2.268 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3ccccc3SCC(N)=O)cc2F)CC1 730193681 QLZFWFRWOWSNNA-UHFFFAOYSA-N 430.549 2.475 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3[C@@H](O)C(F)(F)F)cc2F)C[C@@H](C)O1 732201865 PSJSCMPORVXERD-WMTXDGDDSA-N 447.473 2.443 10 20 IECD Cc1cc(C(=O)CN2CCC[C@@H](N3CCCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 740878320 YYSWFSHQLKSFRI-HXUWFJFHSA-N 444.601 2.484 10 20 IECD CN(C)CCN(CCN(C)C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 741084171 IXVYWPZNESUETR-UHFFFAOYSA-N 427.540 2.392 10 20 IECD CN(c1ccc(CNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1)C1CCCCC1 742416069 LAJJMAJYKRXULF-UHFFFAOYSA-N 437.544 2.275 10 20 IECD Cc1cccn2cc(CCNC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)nc12 746758387 VSPGGGPXUJDPCP-IBGZPJMESA-N 434.544 2.386 10 20 IECD CCOC(=O)CN(CC(N)=O)C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 749584102 BPNYHCLOJBUDJS-UHFFFAOYSA-N 436.306 2.347 10 20 IECD CCC(=O)NCc1cc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)ccc1OC 751588551 LJUFRUBQHYFLCW-UHFFFAOYSA-N 435.531 2.379 10 20 IECD COC(=O)c1coc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 754022826 XYFWXRKLCZZMAK-OAHLLOKOSA-N 428.894 2.368 10 20 IECD CCn1cc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])n1 754814933 MAELIVHZKAOIBR-GFCCVEGCSA-N 445.448 2.360 10 20 IECD O=C1CN(C(=O)/C=C\c2cncc(F)c2)c2ccc(S(=O)(=O)N3CCCCC3)cc2N1 759763422 LPONKOFSKGJDSQ-DAXSKMNVSA-N 444.488 2.394 10 20 IECD COc1ccc(N2CCN(CCCNc3ncccc3S(=O)(=O)NC(C)C)CC2)cc1 763015533 VDSMBGQNVJHEPT-UHFFFAOYSA-N 447.605 2.401 10 20 IECD COc1ccc(O)c(CNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)c1 769543212 XBZKYJNNLDPNHF-UHFFFAOYSA-N 430.848 2.467 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc4c(c3)S(=O)(=O)N(CC)C4=O)c2)CC1 770156734 ZAAGYWGOXPGJNU-UHFFFAOYSA-N 442.541 2.245 10 20 IECD C[C@H]1CO[C@H](C)CN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 779335157 CYPIWBQMXRSUAV-DLBZAZTESA-N 428.512 2.261 10 20 IECD O=S(=O)(c1ccc(NCc2cccc(Br)c2O)nc1)N1CCOCC1 783639094 ZBAZYSNTCGZRRT-UHFFFAOYSA-N 428.308 2.183 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 785303768 KYYZGENUMDJZJW-VIFPVBQESA-N 425.344 2.293 10 20 IECD COCc1nc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)no1 785414033 UVOBFVOQNHLCJM-UHFFFAOYSA-N 425.444 2.141 10 20 IECD C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439427 OZMRIQBQWRVTOY-YJBOKZPZSA-N 448.564 2.246 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)nc3)cc2F)C[C@@H](C)O1 786614196 LUGPPOKXFVIIFX-ZIAGYGMSSA-N 434.899 2.420 10 20 IECD CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cccc21 789389337 RKKPSNVPINXEML-OAQYLSRUSA-N 438.528 2.163 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1F 789799697 PBCFJBZNZCCIAF-UHFFFAOYSA-N 446.498 2.060 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 789818714 KJJCAULSWLJAQM-IAGOWNOFSA-N 435.540 2.379 10 20 IECD CC1(C)CCC(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793722959 MAAXLVPFLHUSAH-LJQANCHMSA-N 428.577 2.337 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3ccsc3)cc2)C1 793723950 OTWNHUHDVNFRCY-PXNSSMCTSA-N 440.569 2.430 10 20 IECD COC(=O)CC1=C(C(=O)OC)[C@H](c2ccc(N(C)C)cc2C(F)(F)F)NC(=S)N1 794781657 MIAAHYDYJUXUPH-HNNXBMFYSA-N 431.436 2.280 10 20 IECD Cc1cc(C(=O)COC(=O)CCn2cnccc2=O)c(C)n1-c1ccc2c(c1)OCCO2 796317426 FYZITNIJSOTBJV-UHFFFAOYSA-N 437.452 2.238 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(NC(C)=O)cc3)CC2)cc1 803556919 UJQCDCCLJPWQHT-UHFFFAOYSA-N 438.528 2.098 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H](C)N1CCOCC1 803677053 DVRIKNKUXFSYRY-RBUKOAKNSA-N 430.593 2.297 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](CO)c2ccc(OC)cc2)cc1F 804851895 RPEBDEKAVYKFKX-NRFANRHFSA-N 431.508 2.489 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)Cc3cccc(Cl)c3)cc2)CC1 808289259 VPHSJMULWHYJQU-UHFFFAOYSA-N 428.963 2.194 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)N[C@@H]1COC(=O)C1 820069179 BREHNPLOACDHES-KQDRGBMMSA-N 441.328 2.082 10 20 IECD CCNC(=O)NC(=O)COC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 913362132 UEJBILRUQLZDMF-FMIVXFBMSA-N 441.556 2.118 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(N4CCCC4)nc3)cc2)C1 918006212 SOLJTXRUILOLJJ-HXUWFJFHSA-N 436.560 2.383 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccc(OCCO)c(OC)c3)CC2)cc1 918081892 IUAVWDQFQOJZEA-UHFFFAOYSA-N 429.517 2.497 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 918284914 UVSCSDNTSHHFHF-UHFFFAOYSA-N 429.448 2.012 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCO4)cc2F)C[C@@H](C)O1 918286646 JLZXYUNELLAWEB-ZIAGYGMSSA-N 429.448 2.423 10 20 IECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920926520 QONYXFKJOSBEDH-QGZVFWFLSA-N 438.528 2.477 10 20 IECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)CC2)cc1 1323193627 RDMLQFUVWBGIHY-UHFFFAOYSA-N 435.521 2.437 10 20 IECD CC[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753012 YZZJONLPTBLDNP-ZJSXRUAMSA-N 425.529 2.309 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cnccc1F 1796931786 LUWUVHMTNMNDPL-ACHSLPGTSA-N 435.459 2.265 10 20 IECD Cc1ccn(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1799479124 PDMYMZFIWHSXHZ-BJKLQHCMSA-N 425.485 2.416 10 20 IECD COCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814289772 BCPNULZGOXXFCT-SNVBAGLBSA-N 425.894 2.470 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccncc1F 1818394735 AJGQOIGHHDXXPB-HNNXBMFYSA-N 426.408 2.370 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3ccoc3Cl)CC2)CC1)c1cc(O)nc(O)c1 1834989021 YUXJTYOCLGKBIB-UHFFFAOYSA-N 448.907 2.238 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2cc(F)ccn2)C1 1842011783 BFAIFBPCLTTYRD-ZZXKWVIFSA-N 441.459 2.187 10 20 IECD O=C(c1nccc2occc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442106 YLYGQSHTYYTIGY-UHFFFAOYSA-N 443.463 2.438 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 303710196 PRGAIBNOEXRODL-UHFFFAOYSA-N 436.472 2.314 10 20 IECD COc1ccc(N(CC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)C(C)C)cc1F 725816270 NPAIHDNPYROFRU-UHFFFAOYSA-N 441.511 2.075 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 727884558 YKFDXZWKYKKSSS-UHFFFAOYSA-N 443.456 2.047 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N(C)Cc3cccc(C(N)=O)c3)cc2F)CC1 730132282 BESMAWCNUNNDOD-UHFFFAOYSA-N 427.524 2.408 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c[nH]n4c3nc(=O)c3ccccc34)cc2F)CC1 730235563 GGGZZEIGIKLILF-UHFFFAOYSA-N 448.502 2.387 10 20 IECD COCC[S@](=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 735191731 QPWKEUVVUKISFV-PMERELPUSA-N 431.558 2.245 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 737156751 DJUOVZKMJPLVFN-CQSZACIVSA-N 429.448 2.265 10 20 IECD COc1cc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc(OC)c1OC 741798969 PHQBTCYVPQESJS-UHFFFAOYSA-N 437.518 2.052 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(N(C)C(C)=O)cc3)cc2F)CC1 742292695 DZSRIGBYESJKJN-UHFFFAOYSA-N 448.564 2.429 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCN(CC(=O)N(C)C)CC1 745811506 AOLZEGKKTZMTAL-UHFFFAOYSA-N 441.370 2.239 10 20 IECD CN(CC1CC1)C[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 746413663 HFCGMWJCVNXRCN-RTWAWAEBSA-N 427.593 2.262 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCN1Cc1ccc(F)cc1 747364033 LIDCTYSVDZYZOT-JOCHJYFZSA-N 445.560 2.341 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cc(Cl)cnc3N)cc2F)CC1 751987747 MJONJWSCVFRMRX-UHFFFAOYSA-N 427.933 2.077 10 20 IECD C[S@@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 752877481 CVADBJZOQIQCKL-VPTFNQTCSA-N 428.558 2.125 10 20 IECD C[C@H]1C[C@@H](NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c2c(O)ccc(F)c21 756442446 QCIZWXCEHKYVSI-DOTOQJQBSA-N 434.537 2.216 10 20 IECD C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NCc1ccc(N2CCSCC2)cc1 756812298 JBESRYGPWUUULC-QHCPKHFHSA-N 425.554 2.263 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOc3ncccc3Cl)cc2)C1 760833228 KZJJLMACSVNGHH-INIZCTEOSA-N 431.924 2.315 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccccc1C[S@](C)=O)c1ccc(N2CCOCC2)cc1 762639449 HAXSMBUMBUHIEB-DFYVNMARSA-N 429.542 2.218 10 20 IECD O=S(=O)(Nc1nccs1)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765094422 GDTXRIDOKIEISI-UHFFFAOYSA-N 437.484 2.281 10 20 IECD C[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CCOCC1 771060561 WNZJCIFFYRRAKO-YOEHRIQHSA-N 444.981 2.109 10 20 IECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)C2CC2)cc1 774154403 HUUXRMCOQVIPHO-GOSISDBHSA-N 448.523 2.088 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)N2CCCc3cc(S(=O)(=O)N(C)C)ccc32)c1 775372730 HJFWOBQREOLCLS-HNNXBMFYSA-N 447.557 2.281 10 20 IECD COCCN(C(=O)/C=C\c1scnc1C)c1c(O)nc(=O)n(Cc2ccccc2)c1N 776731534 NYTXUZUKWPVQGW-HJWRWDBZSA-N 441.513 2.037 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)CC2)cc1 777230709 ANBHGLDZCZQMIN-GOSISDBHSA-N 433.597 2.152 10 20 IECD Cc1cc(C(=O)CN(C)C[C@H]2CCCC[C@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778247027 UVUSHSJTZPSBHA-DYESRHJHSA-N 433.574 2.407 10 20 IECD CCC(CC)(CC(=O)OC)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778303893 DTXHXLIJAUOPHC-QXMHVHEDSA-N 431.533 2.138 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)c2)CC1 781045271 HMGKKFFDAXWLLL-UHFFFAOYSA-N 426.429 2.287 10 20 IECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 781444402 ZGLUUBDKBDATJN-KRWDZBQOSA-N 442.468 2.334 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1CCN(C)CC1 786648497 HNYNNGPBKDMRFA-QHCPKHFHSA-N 443.636 2.024 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(CCCO)CC(C)(C)C)cc2F)C[C@@H](C)O1 789818385 JOZVDSLQIOSJPB-IAGOWNOFSA-N 437.556 2.313 10 20 IECD CCc1nc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 789840454 IPFCYSCYILXAHM-CYBMUJFWSA-N 434.537 2.299 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](C)c1cccnc1 789842196 BERQRBMSSWNLRK-MRXNPFEDSA-N 428.508 2.408 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21 789867510 HANBWIMFADHZKO-SQNIBIBYSA-N 437.656 2.352 10 20 IECD O=C(COC(=O)c1cnn2c1OCCC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 795744887 DEJLVBLZPTXCHT-UHFFFAOYSA-N 431.404 2.237 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)Nc1cnc(N2CCOCC2)c(Br)c1 799249088 KYLPOYXIPLZQEL-UHFFFAOYSA-N 437.294 2.456 10 20 IECD CC(C)(C)OC(=O)NC[C@@]1(C)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 801452037 WXEBLNMKIJHWTJ-LJQANCHMSA-N 427.523 2.141 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1)c1ccc(N2CCOCC2)cc1 803310620 MKNPLKSSPMIXAN-DZFGPLHGSA-N 441.528 2.408 10 20 IECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CCOCC1 807984858 WOYWZHISURLAAY-HSZRJFAPSA-N 442.604 2.156 10 20 IECD CNC(=O)Cc1ccc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 915344123 REXXXZGLFKDOMZ-UHFFFAOYSA-N 439.560 2.318 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(C)c3C(F)(F)F)CC2)cc1 916163896 FGZZPMKYTSBDAN-UHFFFAOYSA-N 425.455 2.390 10 20 IECD O=C(NCCCS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 918208137 AODDWSVJKRLBFD-UHFFFAOYSA-N 449.548 2.467 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC([C@H]3C(=O)Nc4ccccc43)CC2)c1 1324753867 ZBOGVULEQSLZAJ-LJQANCHMSA-N 429.498 2.352 10 20 IECD O=C(c1cncc(F)c1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004339 BSTNJGJTIYEIAD-FQEVSTJZSA-N 435.839 2.043 10 20 IECD O=C(C[C@H]1CNc2ccccc2O1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600902 PEVUNVDBVOYRMT-YVSFHVDLSA-N 438.484 2.008 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CCCCC1 1797205812 UNYRDKMDTKRNFG-BPHLJZQPSA-N 448.491 2.079 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798695647 GOTUKUGFXSPKMQ-SEDYWJOHSA-N 426.473 2.109 10 20 IECD COc1nc(C)ccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547462 YNBMHXXMMBHZJC-UHFFFAOYSA-N 440.500 2.363 10 20 IECD O=C(CCc1cccnc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722606 QQWUNXDGGGRQEE-AWEZNQCLSA-N 439.497 2.203 10 20 IECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cc(O)n1 1817845128 ALHYKKDDNLPVIL-HNNXBMFYSA-N 438.444 2.245 10 20 IECD CC[C@H](NC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877535 PWHILTYBDHFJPS-VKJZPDJHSA-N 445.560 2.434 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2OCc2ccncc2)SC1=S 727175880 CAARTPPLTJPZCV-SFQUDFHCSA-N 449.579 2.411 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(n4ccnc4)CC3)CC2)cc1 728741639 SLRPKSNTIOZFLI-UHFFFAOYSA-N 426.565 2.451 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1 729062888 GIQFNMKERPJWJC-KFWWJZLASA-N 428.489 2.225 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)Cc3c[nH]c4ccccc34)cc2)C1 729598614 HNOKTFMISZWXTD-ICSRJNTNSA-N 449.555 2.272 10 20 IECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)c1O 729859266 MJDLJCLFCCNERI-UHFFFAOYSA-N 439.921 2.166 10 20 IECD CCN1CCN(c2ccc(CNC(=O)c3c(C)oc4ncn(C)c(=O)c34)cc2F)CC1 730192566 GYGCWRLYYZYKCQ-UHFFFAOYSA-N 427.480 2.046 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1 732256426 CRNOPSPCVGOFQE-UHFFFAOYSA-N 446.573 2.261 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Oc2cnccn2)c1 736549858 KCIILHKEHAAOMA-UHFFFAOYSA-N 438.509 2.434 10 20 IECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1F 738905273 LVLOLXZIEXYWGY-UHFFFAOYSA-N 435.477 2.169 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cc(C(C)C)on3)CC2)cc1 743880231 SXDGHAXLNNHYGW-UHFFFAOYSA-N 429.521 2.074 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cc1F 743901070 YQEUDVIXYBHDMI-UHFFFAOYSA-N 427.885 2.204 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 751227298 GVRMYXLQDBOMNL-UHFFFAOYSA-N 428.507 2.113 10 20 IECD CNS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)o1 751369192 JIBLXGFTAGEDDB-UHFFFAOYSA-N 443.472 2.496 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(Br)o3)cc2)C1 759005281 WGLPQTNRCIEMSA-CYBMUJFWSA-N 442.335 2.222 10 20 IECD Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 760098402 YKSDNDKNTNZYLO-KNQAVFIVSA-N 449.555 2.079 10 20 IECD CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 762615883 DXIQQZAHTKLBFE-GOSISDBHSA-N 445.564 2.054 10 20 IECD O=C(NCc1cccc(Br)c1O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 765326367 HSTQCACGRRTAQG-AWEZNQCLSA-N 433.262 2.227 10 20 IECD COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1 766270089 POQCUZQWLAUGKA-KRWDZBQOSA-N 432.546 2.341 10 20 IECD O=c1cc(CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)nc2sccn12 768215137 QBBLRKGGKKBPBG-UHFFFAOYSA-N 443.548 2.050 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(Br)cn1)c1ccc(N2CCOCC2)cc1 772991806 WBSDEQBWZUXYNF-CYBMUJFWSA-N 433.306 2.497 10 20 IECD O=C(OCCN1CCCS1(=O)=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 773103976 IOAZEPVDGPGHMI-UHFFFAOYSA-N 433.869 2.308 10 20 IECD C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1)n1cncn1 773858917 RSFGJPZAPVKYDV-CVEARBPZSA-N 449.515 2.360 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-c2cncnc2)cc1F 775807626 TZHZRJQUVAYJDM-UHFFFAOYSA-N 440.500 2.448 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCN(CC(C)C)C3)CC2)cc1 778390361 ARKKKNVGGOYSSN-XPTLAUCJSA-N 442.604 2.384 10 20 IECD COc1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1-n1cnnn1 781612307 HPLVCMJLWIXUFV-UHFFFAOYSA-N 433.516 2.455 10 20 IECD O=C(CN1CCOC[C@@H]1[C@@H]1CCCC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 784355742 HTWZOBGNZGITGK-FXAWDEMLSA-N 432.476 2.471 10 20 IECD CC[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(=O)OC 785400399 YUJVWIAAVITZRY-INIZCTEOSA-N 438.414 2.210 10 20 IECD COCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 787989599 FVUPBFNAAPUPNL-UHFFFAOYSA-N 443.569 2.198 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3ncccc3F)CC2)cc1 788941360 XHQUYVSKXKMDSC-UHFFFAOYSA-N 427.524 2.422 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C12CCCC2 789802485 ZBQBRTUQSVUMFS-WOJBJXKFSA-N 433.524 2.133 10 20 IECD CCc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cs1 789825637 NFTQXJNRJNGWGA-ZIAGYGMSSA-N 434.537 2.391 10 20 IECD C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793723286 WLDRFIJYAKTTFJ-AGHHOFFYSA-N 449.555 2.009 10 20 IECD Cc1ccccc1C1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793735851 ZCKRXDLTEZHZKY-HXUWFJFHSA-N 448.567 2.161 10 20 IECD COc1coc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1=O 798676036 IGPRKONUUNVYAT-UHFFFAOYSA-N 433.372 2.219 10 20 IECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297532 YYWQGLLEUABQEI-ZWKOTPCHSA-N 441.528 2.293 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1cccc(N2CCOC2=O)c1 803588641 GUAKNIGQEWQLTC-CQSZACIVSA-N 428.464 2.342 10 20 IECD Cc1cc(I)cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 806960003 VBWDPMSDKDPANR-UHFFFAOYSA-N 440.237 2.308 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1C 815371163 LEFMFSMPHQDIRR-UHFFFAOYSA-N 427.501 2.446 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnn([C@H]4CCOC4)c3)ccc21 816463473 JBYGYRCOCLSWFJ-KRWDZBQOSA-N 446.529 2.181 10 20 IECD CCN1CCN(CC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C(=O)C1=O 919147625 PKQFLQNYJUPKSJ-UHFFFAOYSA-N 437.456 2.274 10 20 IECD O=C(CCc1nc(-c2ccccn2)no1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971542 PWJGHPRLMIFMEQ-UHFFFAOYSA-N 425.464 2.481 10 20 IECD C[C@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1317762390 VBAKSWKXANRYSA-ZDUSSCGKSA-N 436.464 2.495 10 20 IECD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1C 1794051521 LZSGQTDJYNGQBJ-BCDXTJNWSA-N 445.610 2.344 10 20 IECD CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1795759203 CTCXURUSGJOKCN-IYWMVGAKSA-N 430.549 2.363 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc(C)n1 1797185321 NSDKAYGZIMEUJW-BJWYYQGGSA-N 446.598 2.065 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccnc(Cl)n1 1804285752 JJXMNYFGIZVWAZ-LJWNITHASA-N 444.875 2.212 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc(F)ccc1F 1804336151 XXVQPEZUSXICMB-CLLJXQQHSA-N 439.509 2.077 10 20 IECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nc1 1807990123 DZMVIVOSCNMWEU-KKSFZXQISA-N 433.468 2.225 10 20 IECD CCOC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1823481406 MPVOLBQMNRDGJX-AWEZNQCLSA-N 445.476 2.111 10 20 IECD CC(C)N[C@@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(C)C 1843001557 AWFIBQYCDFVSDY-QRBZPYHOSA-N 431.533 2.043 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cn1 1843441277 KQDBTJRHSHTZAY-UHFFFAOYSA-N 445.523 2.319 10 20 IECD O=C(c1nccc2[nH]ccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039150 UADPLBLFJDOQPI-HWKANZROSA-N 434.452 2.210 10 20 IECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)Nc1ccc2c(c1)OCCO2 7216054 PBXPLGRYRVVKRB-UHFFFAOYSA-N 426.517 2.101 10 20 IECD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3cc([N+](=O)[O-])ccc3OC)C=C2)cc1 541331211 FITIIWXAMKRXFH-UHFFFAOYSA-N 441.465 2.264 10 20 IECD O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1cccc(S(=O)(=O)NC2CC2)c1 725821815 KVNCGLJUPZKYMW-UHFFFAOYSA-N 435.571 2.206 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1 729062634 TXLBOWFUEHNRHH-GFCCVEGCSA-N 437.452 2.223 10 20 IECD COc1ccc(N2CCCN(C(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC2)cc1 730066329 GVFSUWKBHKSTOV-UHFFFAOYSA-N 447.557 2.399 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@H](C)C2)CC1 734687555 IJUQIFDFTLKYSW-OALUTQOASA-N 429.609 2.393 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 741100275 XBHQSSQZNHMYNZ-UHFFFAOYSA-N 438.440 2.387 10 20 IECD CCN(CC(=O)N(CC)[C@@H]1CCS(=O)(=O)C1)Cc1cc(Br)ccc1O 743873667 PZHCBCCGJRTLPP-OAHLLOKOSA-N 433.368 2.012 10 20 IECD O=C(N[C@H]1CCN(C2CC2)C1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 746881717 CUBJQPOPRFHLOM-AWEZNQCLSA-N 446.485 2.068 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)cc1 747579388 MJWDNDPKTZRRSV-UHFFFAOYSA-N 440.610 2.115 10 20 IECD CCCNC(=O)[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 747979136 BYATVZKFWIXQMH-FQEVSTJZSA-N 445.608 2.155 10 20 IECD COc1ccc(S(=O)(=O)Nc2ccc(O)cc2OC(C)C)cc1[C@]1(C)NC(=O)NC1=O 761995347 MAIVTYWOQYCTQR-FQEVSTJZSA-N 449.485 2.043 10 20 IECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)c2)CN1 772473056 VXIAZVBLWYKMHW-GOSISDBHSA-N 438.553 2.098 10 20 IECD Cc1csc(N[C@H](C)C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 775905233 MPTAOTVOSNUVAR-CQSZACIVSA-N 436.509 2.087 10 20 IECD CC(=O)N1CCN(c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CC1 782104954 NRPNDLXVCOJKLH-UHFFFAOYSA-N 437.544 2.018 10 20 IECD Cc1ccn(C)c1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 784296418 NPSTUCPGOIKHNI-UHFFFAOYSA-N 429.498 2.428 10 20 IECD C[C@H](NC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1 784362853 WFEXBLPSOZUJCS-NYVOZVTQSA-N 427.545 2.142 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786122254 OWNVDHJWZBNRHW-UHFFFAOYSA-N 445.541 2.010 10 20 IECD O=C(COC(=O)[C@H]1CCCN1C1CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 786878072 ITBRPFCSKVOTGG-OAQYLSRUSA-N 433.524 2.229 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC3CCN(C4CCCC4)CC3)CC2)cc1 787192032 JBSVJRDYKRAHHM-UHFFFAOYSA-N 428.577 2.257 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H]1CCc2ccccc21 793733717 NWKLWFSMVMTMQB-UGKGYDQZSA-N 434.540 2.150 10 20 IECD C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793734973 WHQKUWNOONENOP-AAIMPIBUSA-N 448.567 2.409 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)N3CCc4ccccc43)CC2)cc1 803910776 LKBAHQGOVMGJII-LJQANCHMSA-N 436.556 2.301 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cn(C)nc3-c3ccccc3)CC2)cc1 804315484 MEQWHTVGKLEECL-UHFFFAOYSA-N 447.539 2.497 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(F)cc3)cc2F)CC1 805006617 ZFIJSFSTLCTQCZ-UHFFFAOYSA-N 430.499 2.382 10 20 IECD O=C(N[C@H]1CCN(c2ncccc2F)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807912332 IHKHAJWQPWMSNR-KRWDZBQOSA-N 438.459 2.443 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CNC(N)=O)C3)cc2Cl)C1 807953995 DWCKRMNVPFWEPZ-DOTOQJQBSA-N 449.983 2.099 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cn4ccccc4n3)CC2)cc1 916196599 NSGMNTWRFJNZJJ-UHFFFAOYSA-N 436.560 2.397 10 20 IECD CN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1ccc(Br)cc1 917307689 RTJXYOJPIHVDEL-UHFFFAOYSA-N 427.320 2.482 10 20 IECD CN(Cc1nc(O)c2ccccc2n1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918118276 XSVQGAQGJSNOGI-QGZVFWFLSA-N 448.527 2.379 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 918278069 QQJCDIXEBUUOLE-UHFFFAOYSA-N 438.406 2.201 10 20 IECD O=C(NCCCS(=O)(=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1 919791702 FVQATQKWOSVKSF-UHFFFAOYSA-N 431.558 2.328 10 20 IECD O=C(CCn1c(=O)nc(O)c2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 919969738 FMUVKJZFTAZGRR-UHFFFAOYSA-N 436.512 2.017 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)c1n[nH]cc1I 1116648365 KGJZDHOOBFMMQL-UHFFFAOYSA-N 428.299 2.498 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCSC1)C2)c1cc(O)c(O)c(Cl)c1 1799770341 OHTFGOKLTGILFX-DPYKFYPSSA-N 440.949 2.098 10 20 IECD COC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CCC1 1803415070 NTBMGGFCISKJSV-GGPHIMKMSA-N 438.528 2.377 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(F)nc1 1804285706 INCVNAIGBAATGU-AKNOBNDCSA-N 427.432 2.303 10 20 IECD Cn1cnc(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)c1 1808687669 FYQSABWZVFEOKN-GQCTYLIASA-N 440.500 2.095 10 20 IECD Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)on1 1815713023 VSZNMBLUMZDVBA-OAHLLOKOSA-N 426.433 2.061 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(O)O)[nH]n2)cc1 1821155921 LMEWSYRQPHNXQI-IBGZPJMESA-N 437.500 2.434 10 20 IECD CCS(=O)(=O)CC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1841586253 IGXABMFPUDVKEJ-UHFFFAOYSA-N 443.569 2.346 10 20 IECD C[C@H]1CCc2c(C(=O)N3CC4(CCCN4C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)n[nH]c21 1843441499 DJYBDRYUQICLNA-HNNXBMFYSA-N 446.511 2.069 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3CCN(C)CC3)C2)cc1 1843915298 ZAWAZZUBIXELPT-UHFFFAOYSA-N 449.599 2.159 10 20 IECD Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2=O)cc1 554644486 ODASODJQSRQYFG-HXUWFJFHSA-N 432.524 2.329 10 20 IECD CO[C@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 727036921 AFRJMTDZQGSQPS-VQIMIIECSA-N 438.528 2.351 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H](C)N1CCOCC1 729594380 PHXOXDQHHVFHKD-HOTGVXAUSA-N 444.498 2.450 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(NC(=O)C4CC4)nc3)CC2)cc1 731407001 QMRKFSDFSDMIIN-UHFFFAOYSA-N 437.500 2.116 10 20 IECD Cc1cc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)ccc1[N+](=O)[O-] 734737343 PLACRKBBNKECDW-UHFFFAOYSA-N 445.478 2.238 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(CC(C)C)nn3C)cc2F)CC1 737187972 JXWAZAQWBDGVFJ-UHFFFAOYSA-N 444.555 2.155 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC(N(C)CCCO)CC3)cc2F)C[C@@H](C)O1 741079191 BGRXPYATWFMJMQ-QZTJIDSGSA-N 436.572 2.428 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)CC2)cc1 742917447 WWXSJUYKTYDAGM-QGZVFWFLSA-N 428.499 2.208 10 20 IECD C[C@H](NC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O)c1ccc(N2CCOCC2)cc1 743900972 SRYFKXSGLDDGJK-KRWDZBQOSA-N 446.507 2.338 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(c2cnn(C)c2)CC1 746669496 VRVVDPBYLRDHNR-INIZCTEOSA-N 443.507 2.345 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)cc1 747100154 XPXMFJJZFNAKJB-GOSISDBHSA-N 447.580 2.315 10 20 IECD CCOC(=O)c1c[nH]nc1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 751455837 ICAQYVGBSPMLQZ-GFCCVEGCSA-N 444.460 2.135 10 20 IECD C[C@@H](O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752652452 FTJSVODVNKONTP-MJGOQNOKSA-N 442.539 2.387 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](C)N3C(=O)c4ccc(C)cc4C3=O)CC2)cc1F 753739577 TVOVYBYBOAJGML-OAHLLOKOSA-N 425.460 2.476 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(c4ccncc4)CC3)cc2F)C[C@H](C)O1 760892129 JBCMKOISGAFSBW-OALUTQOASA-N 441.551 2.273 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765902824 DXZSNXFGFZTWRU-UHFFFAOYSA-N 443.200 2.474 10 20 IECD CCc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768447056 LRNJQECXGVESEI-KKSFZXQISA-N 426.513 2.492 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1O 775011956 NNNMWYMZRGEOIB-SFHVURJKSA-N 428.489 2.296 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc2nn[nH]c12 783570863 BGFSMEJGAWJEFP-UHFFFAOYSA-N 432.463 2.144 10 20 IECD C[C@@H]1CN(C(C)(C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C[C@@H](C)O1 785864090 AFIMVUITDBCKLR-QZTJIDSGSA-N 430.593 2.248 10 20 IECD O=C(NCc1ccc(Cn2cccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788460460 FFRASMVIZXNUIM-QFIPXVFZSA-N 448.523 2.461 10 20 IECD CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 788564922 YVQVEHXWTGXECL-RTBURBONSA-N 447.580 2.388 10 20 IECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788931487 GZRRJAVYMCSMQI-MJGOQNOKSA-N 430.549 2.276 10 20 IECD COCC[C@@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 794835622 ZQVPJLYHNXKWTD-CQSZACIVSA-N 426.516 2.132 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)nc1 803664971 UYKRPCFAIPUVLB-KRWDZBQOSA-N 441.507 2.089 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCN3c4ccccc4C[C@H]3C)CC2)cc1 803975765 NKMOJVXTCUDGAZ-LJQANCHMSA-N 436.556 2.301 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CCCCN1CC 804423940 AMFUSPXBGYDICD-MRXNPFEDSA-N 426.355 2.494 10 20 IECD O=C(Nc1cccc2c1CNC2=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 807009706 PFEKNGMWSPAMII-OAHLLOKOSA-N 442.903 2.008 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1 809795254 OJONXAPZRWAVPA-VSKRKVRLSA-N 425.529 2.452 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)OC4(CCCC4)C3=O)cc2F)C[C@@H](C)O1 810022948 MGZVCOZHGCCKCJ-GASCZTMLSA-N 433.480 2.347 10 20 IECD COc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1OC 810064797 UUCQYENZCBPDJG-UHFFFAOYSA-N 447.557 2.239 10 20 IECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1-c1ccccc1 917832465 ANWQHWXCIHRKQV-LJQANCHMSA-N 445.523 2.173 10 20 IECD COc1ccc(N2CCCN(C(=O)NCc3ccnc(N4CCOCC4)c3)CC2)cc1 918005654 CKJUQHUALUNONP-UHFFFAOYSA-N 425.533 2.349 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1Cl 918294052 CEBJXZMBNZXHCW-OAHLLOKOSA-N 431.876 2.291 10 20 IECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920886230 DDSUBUUZNKBFNN-INIZCTEOSA-N 433.512 2.397 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1 1320519201 CDGGJWVEQOVLCR-LHSJRXKWSA-N 440.468 2.037 10 20 IECD Cc1noc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005133 UZOPGFBAAIZANM-FQEVSTJZSA-N 435.864 2.113 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1F 1799742793 MXWCPRJGBBRJTQ-ZSBIGDGJSA-N 439.509 2.077 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCCC1=O)c1cc(O)c(O)c(Cl)c1 1802162328 ASOYJHNAHFIOLE-QDMKHBRRSA-N 435.908 2.016 10 20 IECD O=C(CCc1cccnc1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807644198 DRTSWMQCHZMXQV-FDDCHVKYSA-N 447.495 2.235 10 20 IECD CCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807990886 KNOUEISBWUMPSD-JLTOFOAXSA-N 437.456 2.072 10 20 IECD CCc1ncsc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844838340 UARKZKXNLQLZPT-UHFFFAOYSA-N 437.525 2.315 10 20 IECD COc1ccc(N2CCCN(C(=O)C[C@](O)(c3nccn3C)C(F)(F)F)CC2)cc1 108582359 BDGOKKIOCRXACP-IBGZPJMESA-N 426.439 2.308 10 20 IECD CCOCCCN1CC[C@@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)[C@H](C)C1 516592938 TYPJBUUKDMNHFC-YLJYHZDGSA-N 428.577 2.356 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)Nc3ccn(CC(=O)N(C)C)n3)cc2F)C[C@@H](C)O1 726080675 LZHLUPJWISVTSB-GASCZTMLSA-N 432.500 2.046 10 20 IECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565855 GPCNWINFBVOVKS-WZBLMQSHSA-N 445.466 2.180 10 20 IECD COc1ccc(N2CCC(NC(=O)NCCNS(=O)(=O)Cc3ccccc3)CC2)cc1 726706005 YACDGNFXZQFCRR-UHFFFAOYSA-N 446.573 2.083 10 20 IECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 729626739 DFIJJDGDRFRKSU-TZIWHRDSSA-N 428.577 2.067 10 20 IECD C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)CN(C)Cc3ccccc3O)cc2)C[C@@H](C)O1 731843508 MAMRKJDEMHWFIK-IAGOWNOFSA-N 447.557 2.261 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(C(N)=O)c(C)c3)CC2)cc1 732433975 ZFBJSONYJXGKDW-UHFFFAOYSA-N 425.533 2.436 10 20 IECD COc1ccc(OC(F)F)c(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 733000388 HBOOPUPLAJPUHF-XYOKQWHBSA-N 438.499 2.047 10 20 IECD O=C(NCCCSc1nccs1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 733880784 OCMSSCNYPUFLHL-UHFFFAOYSA-N 445.563 2.215 10 20 IECD CS(=O)(=O)Cc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 749195103 YBWIURCSHGPJAO-UHFFFAOYSA-N 435.521 2.206 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-c4ncon4)cc3)CC2)cc1F 754212693 OPKJLFNDSVTRQU-UHFFFAOYSA-N 425.420 2.172 10 20 IECD COc1cc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)cc(OC)c1OC 760104672 OKXJRTIICNWVFO-UHFFFAOYSA-N 425.489 2.392 10 20 IECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2C1=O 761043996 YLSCDYFVGKXXDY-UHFFFAOYSA-N 438.553 2.123 10 20 IECD Cn1cc([C@@H](O)CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 762527099 MBJKSVRTUOBPGJ-QDECMSLZSA-N 436.584 2.313 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(S(N)(=O)=O)nc3)c2C)c1 762872867 IHAJQSNGCCITMV-UHFFFAOYSA-N 427.482 2.485 10 20 IECD C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 772056583 HPEQIVGBJFTHOW-LLVKDONJSA-N 448.391 2.288 10 20 IECD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)c1 773017150 UKFOZCHSDKPKIH-IBGZPJMESA-N 444.601 2.390 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cnc4c(c3)COCC4)cc2F)C[C@@H](C)O1 777238139 PSIBBODZBXFQHH-HUUCEWRRSA-N 442.491 2.162 10 20 IECD CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NCc3ccccc3O)cc2C1 777246679 ZZLBAKWKRTZISL-INIZCTEOSA-N 440.500 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCSCC(F)(F)F)CC2)cc1 778424163 YMORLUNCCNYFHB-SREVYHEPSA-N 431.480 2.312 10 20 IECD COC(=O)c1scc(C)c1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 782105979 YPMWMHLOFFEBAG-UHFFFAOYSA-N 431.514 2.277 10 20 IECD COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2cnccc2C)c(O)nc1=O 783705990 FTGONNFNNASNPP-CMDGGOBGSA-N 435.484 2.128 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2S(=O)(=O)C(F)F)cc1 784563818 LGLHGASMAURYIU-UHFFFAOYSA-N 442.440 2.310 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)c(C)c3)cc2F)CC1 785713146 QMCRTAFNMWDALC-UHFFFAOYSA-N 430.499 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@H]3c3ncon3)CC2)cc1 787262339 QECZFRZUDBSLPA-PISNEZEASA-N 439.516 2.427 10 20 IECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccsc1 787649576 BINWGVHQNJOXSG-LJQANCHMSA-N 432.615 2.337 10 20 IECD CC(C)C1CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793734351 SHOOMVVPMCXALR-IOJLRTSASA-N 428.577 2.336 10 20 IECD CON(C)C(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 795267100 YFJWJATZOBOWHG-UHFFFAOYSA-N 430.480 2.024 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1 801527329 JXENCXYIMWDNOB-UFTUAFODSA-N 437.540 2.367 10 20 IECD CCOCCCn1c(C(=O)NC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802627623 AXTMPJOPHUJZMG-UHFFFAOYSA-N 448.543 2.317 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H](OC(F)F)C1 807768845 PRQOQXBCPXCBFI-DOMZBBRYSA-N 433.402 2.213 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cccc2c1COC2=O 808933809 NSBXPOOZVCBQHG-UHFFFAOYSA-N 448.523 2.144 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 918440560 SFRYXTHHRDNTIT-UHFFFAOYSA-N 431.464 2.059 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(F)cc1F 918461393 AJSBODTXYFTPJA-UHFFFAOYSA-N 447.438 2.437 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc(N2CCCC2=O)ccc1F 920195218 MUEABOQLYRJPGT-UHFFFAOYSA-N 440.475 2.044 10 20 IECD NS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc2c1CCC2 1335430324 WRJLBSIYLNITQL-SFHVURJKSA-N 430.526 2.350 10 20 IECD CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1)c1ccccc1 1787291519 GXJKUBSTGJTDPF-LEAZDLGRSA-N 439.512 2.280 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)C3CCOCC3)cc2)CCC1 1787811008 COFKNZNTUHFSKU-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498305 PNWQOVLMHOLBKP-CQSZACIVSA-N 446.558 2.212 10 20 IECD CC(F)(F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826759499 XASBLXZLTPPIFX-ZDUSSCGKSA-N 433.546 2.122 10 20 IECD O=C(c1cn[nH]c1)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827716746 VKPCOMJCSHBPLS-NRFANRHFSA-N 448.527 2.436 10 20 IECD O=C(CCc1ccc[nH]1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837936544 VTEBJHAFHRPKRB-UHFFFAOYSA-N 442.516 2.066 10 20 IECD CCOc1ncccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1840979316 RMBAJFGIEIKUIA-UHFFFAOYSA-N 447.495 2.090 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2ccccn2)C1 1842116185 NUVJWPQIHRNUJZ-UHFFFAOYSA-N 431.496 2.011 10 20 IECD Cc1nc(C)c(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1842415935 LLGFAECUGDHGQX-FNORWQNLSA-N 429.498 2.407 10 20 IECD O=C(Nc1ccc(S(=O)(=O)N2CCC[C@@H]2CO)cc1)c1ccc(C2=S=CC=C2)o1 557462059 RRCWNYUUSWKTSV-OAHLLOKOSA-N 432.523 2.303 10 20 IECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1N1CCCC1=O 741100338 ZZBIGSBADWWHGZ-UHFFFAOYSA-N 434.496 2.453 10 20 IECD COc1cccc(CNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1O 745807777 FGFXXEQVJOBERT-IBGZPJMESA-N 426.517 2.098 10 20 IECD O=C1NCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1c1ccccc1 749011556 WCGPKYGZOREISR-OAQYLSRUSA-N 426.492 2.170 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1F 753858141 TUHBMTHIIBVPSB-GOSISDBHSA-N 427.524 2.089 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnnn3-c3cccc(C)c3)CC2)cc1 758198939 YYJQMCHVLGWJST-HXUWFJFHSA-N 440.573 2.255 10 20 IECD COc1cc(N2CCN(C(=O)C[C@@H](NC(N)=O)c3cccs3)CC2)cc(OC)c1OC 759406676 UXTCSBAIGOKOGT-OAHLLOKOSA-N 448.545 2.222 10 20 IECD COc1cc(N2CCN(CCC(=O)Nc3sccc3C(N)=O)CC2)cc(OC)c1OC 759879456 WACDOZKRCIINJN-UHFFFAOYSA-N 448.545 2.024 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(S(=O)(=O)CC)c2)cc1 760345629 WPUMNKJNIQFJBY-UHFFFAOYSA-N 432.545 2.043 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCO[C@]4(CCSC4)C3)CC2)cc1 768522397 MTJQKKWRLRLBFH-PGRDOPGGSA-N 434.606 2.171 10 20 IECD CN(C1CCCCC1)S(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768549326 MRWIBZCUOCIQCH-UHFFFAOYSA-N 436.622 2.150 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCOC4(CCOCC4)C3)CC2)cc1 769016179 KONWCYNXHJHWRJ-FQEVSTJZSA-N 446.592 2.235 10 20 IECD CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 773679226 WKVLMLVLNNDQJX-NRFANRHFSA-N 441.528 2.231 10 20 IECD C[S@](=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 774116984 LOPQTUSPCNJLGL-DFYVNMARSA-N 434.489 2.415 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3cccs3)N(C)C)CC2)cc1 774856393 MLDNANBIIWWBRQ-LJQANCHMSA-N 430.574 2.215 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCC(C)(C)N2CCOCC2)cc1)C1CCCCC1 774860087 MYDSGONRWLQVGK-UHFFFAOYSA-N 430.593 2.299 10 20 IECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 782581854 XTEDVUUUWJJXDZ-UHFFFAOYSA-N 426.473 2.381 10 20 IECD COCC[C@@H](Cc1ccco1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 784467732 WICQFWGFOXQTLP-MOPGFXCFSA-N 428.533 2.428 10 20 IECD Cc1nccn1-c1ccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cn1 787485784 PKYISVIQZOMRAS-UHFFFAOYSA-N 432.528 2.449 10 20 IECD CCc1cnc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789826240 PHVDSEZCZUGATO-GJZGRUSLSA-N 448.564 2.433 10 20 IECD CC(C)O[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 789833116 CVHMZSURKKBALS-WOJBJXKFSA-N 435.540 2.111 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCc3ccc(Cl)c(C)c3)CC2)cc1 803753196 WXFVBQHOEWQNFQ-UHFFFAOYSA-N 444.963 2.212 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3cccc(F)c3)N(C)C)CC2)cc1 804315840 NPIPRBKLNSKQGP-QFIPXVFZSA-N 442.535 2.338 10 20 IECD COc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1NC(C)=O 807386775 IQFYTPBCNIQPHL-UHFFFAOYSA-N 436.262 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCCN4c4ncccn4)n3)CC2)cc1 809464234 DIERLIFWKXWFBZ-LJQANCHMSA-N 449.515 2.101 10 20 IECD COC(=O)CN(CCN1CCN(C)CC1)Cc1ccc2c(c1)CCN2Cc1ccccc1 809660380 OAHHUTBWRHVZTC-UHFFFAOYSA-N 436.600 2.472 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4cnn(-c5ccccc5)c4C3)CC2)cc1 815309558 NWNFLNFKVGFMHG-QHCPKHFHSA-N 433.556 2.380 10 20 IECD COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 912980781 WDQHQUBSGNDOIJ-UHFFFAOYSA-N 447.922 2.479 10 20 IECD Cc1ccc(NC(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1S(N)(=O)=O 914614048 QVHXYIINADCLIT-UHFFFAOYSA-N 442.497 2.240 10 20 IECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCc1ccc(N2CCCC2)cc1 915082331 BLMWMRLZASOATJ-UHFFFAOYSA-N 425.533 2.176 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNS(=O)(=O)c2ccccc2F)cc1 916566442 YMPDLQTYDPBLEP-IBGZPJMESA-N 449.548 2.378 10 20 IECD CSCC[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 916617675 VMGUXMBOPSNCAA-OAHLLOKOSA-N 429.450 2.242 10 20 IECD COc1ccc(OC)c([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918211514 DJMKRDCQNSGYAK-HXUWFJFHSA-N 433.480 2.212 10 20 IECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284600 KUHCFOAVTSJDTH-UHFFFAOYSA-N 442.491 2.057 10 20 IECD Cc1nn(C)cc1CCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1318534084 WNFHXZJPXQJSCE-UHFFFAOYSA-N 437.523 2.233 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(Cc2ccc(C)cc2)C1 1342434994 RTROBKLPKVXOIJ-MOPGFXCFSA-N 440.496 2.045 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccccc1)C2)c1cc(O)nc(O)c1 1777847971 XJSYTLVTNOCVDN-NTKDMRAZSA-N 439.512 2.253 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245568 OLKUMLZINWZNLY-SCTFDZSOSA-N 440.949 2.240 10 20 IECD COC1(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)CCC1 1804290975 AJBGXQPDQZXNEN-BJKLQHCMSA-N 430.501 2.414 10 20 IECD O=C(c1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715806 UHHVYUNDWQKZRD-OAQYLSRUSA-N 448.527 2.436 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3F)CC2)CC1 1838627613 FMLPCHHDNFZCHT-FCBDPGHLSA-N 448.491 2.173 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cnoc2C2CC2)C1 1842583541 PQHHGBAPRUQHJN-FNORWQNLSA-N 425.441 2.199 10 20 IECD O=C(CSc1nnnn1C[C@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 16409618 PQQHFZSGDXDJTJ-CQSZACIVSA-N 449.492 2.358 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)O[C@H](C)C(=O)N3CCC(C(N)=O)CC3)ccc21 728637989 UXNORPHLLCPLGK-MRXNPFEDSA-N 429.517 2.174 10 20 IECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 736070618 ZHGQXYYWCZRDJD-CUWPLCDZSA-N 443.592 2.225 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-n4cccc4)c3)cc2)C1 737139294 NLMGQSJVNCMUST-LJQANCHMSA-N 445.523 2.434 10 20 IECD CN1CCCc2cc(CNC(=O)NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc21 746983007 LGZGRZKICWFTFN-LJQANCHMSA-N 438.528 2.193 10 20 IECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)C[C@@H](C)O1 747011737 JSZAIMGNOOYZBC-HUUCEWRRSA-N 429.496 2.155 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 754050696 QRXMENCNWVDNDI-LEWJYISDSA-N 448.608 2.119 10 20 IECD CCN(CC)c1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cn1 754214112 YSXOLIPHMJBUQU-UHFFFAOYSA-N 429.496 2.363 10 20 IECD COc1ccc(N2CCN(C(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)CC2)cc1F 754220475 RUDZHBQFQNWSCK-UHFFFAOYSA-N 439.484 2.186 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNCc3ccc(Cn4cccn4)cc3)CC2)cc1 758198510 SKMNQGFSQOJATL-XMMPIXPASA-N 435.572 2.213 10 20 IECD CC1CCN(c2ccc(CNC(=O)Nc3cccn(CCS(C)(=O)=O)c3=O)cc2)CC1 760804253 ZRKULHGXBVDNFV-UHFFFAOYSA-N 446.573 2.451 10 20 IECD COc1ccc(O)c([C@@H](C)NCC(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1 775375146 JAWGPXUOASKDKI-OAHLLOKOSA-N 433.530 2.475 10 20 IECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccc3c(c2)COC3)cc1)C1=S=CC=C1 776125837 ZJCFRIDAKYUMTP-UHFFFAOYSA-N 428.491 2.052 10 20 IECD C[C@@H]1[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C(=O)OC(C)(C)C 776718446 QXTWTLDZQMUXAE-CHWSQXEVSA-N 427.523 2.234 10 20 IECD CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778928780 BIGPQFYACRXBMK-LUJNMSEFSA-N 436.555 2.426 10 20 IECD COc1ccc(S(=O)(=O)N2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 779534361 PUBVFWNDMPLJNL-WMZJFQQLSA-N 432.498 2.043 10 20 IECD COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 779541198 CPWUGUALGKRCFJ-IBGZPJMESA-N 433.530 2.339 10 20 IECD COC(=O)c1ccc(C)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407933 RJUPFBBEFVLZNC-UHFFFAOYSA-N 431.514 2.251 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccccc1Cn1cccn1 785639613 GXICNXQXFDCHPS-UHFFFAOYSA-N 449.580 2.417 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cnn(-c4ccccc4)c3)CC2)cc1 786121624 VWQCSEYUELNLBB-UHFFFAOYSA-N 447.539 2.325 10 20 IECD CN(Cc1ccc(F)cc1F)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789835020 MXGJMRSDGSZVON-UHFFFAOYSA-N 435.446 2.340 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCOc2ccc(F)cc21 789841260 VVANRCMWKPXTEM-IBGZPJMESA-N 445.466 2.182 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(S(C)(=O)=O)CCC3)cc2F)C[C@@H](C)O1 792835929 OCFMZHJLARYWCI-GASCZTMLSA-N 427.542 2.206 10 20 IECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@H]1Cc2ccccc21 793683524 XRLPEPSPADETQC-JOCHJYFZSA-N 432.568 2.291 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c(O)c1 797388852 CGEYNOMYCKSQPN-UHFFFAOYSA-N 426.517 2.186 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)c(C)c2)cc1 797431527 QWHFAAZEOSZGBN-UHFFFAOYSA-N 434.337 2.434 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC[C@H]1C 803448618 UUEQDOHJTNREIR-RDTXWAMCSA-N 425.476 2.256 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@@H]([C@H]2CCOC2)C1 803450502 JFHLYXUESKHRDR-CVEARBPZSA-N 437.487 2.258 10 20 IECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689409 QNZZSDPVEJVKDB-MRXNPFEDSA-N 432.565 2.447 10 20 IECD CCCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 804233251 YADSSAKHOMCQHY-HNNXBMFYSA-N 427.523 2.285 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]4(CCCOC4)C3)cc2F)CC1 805009387 JOWAVXJQAYACOU-XMMPIXPASA-N 446.567 2.003 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1)[C@H](C)CS(=O)(=O)CC 805025809 UYMVUZCKFFEEKZ-GOSISDBHSA-N 437.606 2.211 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N1CCN(c2ncnc3ccsc23)CC1 806282241 IOCXIVPROKXXRP-UHFFFAOYSA-N 448.599 2.095 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)NC(=O)OC(C)(C)C 806340110 NXJXXDDUIDFQHU-IBGZPJMESA-N 430.549 2.345 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCCC3(C)C)CC2)cc(OC)c1OC 806875756 PELFDIJWNMFZAG-IBGZPJMESA-N 433.549 2.446 10 20 IECD COC[C@H](Cc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807617317 MIFUDCIAHUDFNF-LEWJYISDSA-N 426.513 2.274 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC2(CCC2)C1 807771910 YZSSTIAGAZSCEY-MRXNPFEDSA-N 437.487 2.402 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3CCCc4ccc(S(N)(=O)=O)cc43)cc2)C1 810210946 IEXXEVBBPQDLSH-GCJKJVERSA-N 442.585 2.203 10 20 IECD CN(CC(=O)NCc1cc(Cl)cc(Cl)c1O)C1=NS(=O)(=O)c2ccccc21 813685487 IJJDNZSZINAXPM-UHFFFAOYSA-N 428.297 2.396 10 20 IECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)CN(C)C 816833493 KITCUPDDPAEUBZ-CYBMUJFWSA-N 436.490 2.029 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(CC)CC(=O)Nc3cccc(OC)c3)nc12 917010803 PGKODQZOGQXPQC-UHFFFAOYSA-N 427.461 2.081 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)c1 919810233 JUDLZAQKFWHTFY-AWEZNQCLSA-N 433.534 2.101 10 20 IECD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCC(CO)CC2)cc1 919968645 MOXWZYJWXJQWGK-UHFFFAOYSA-N 440.500 2.240 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 1346108933 GNHBLJQARJMFMM-PGRDOPGGSA-N 438.572 2.414 10 20 IECD CCC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425452 QSKMXBRIBPNLKN-ZDUSSCGKSA-N 426.473 2.155 10 20 IECD COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1OC 1800623536 NWPPQZBIDJIIPO-MUJYYYPQSA-N 441.484 2.384 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H]1C[C@H]1c1ccccc1 1804336347 QDEOOYJDWUTULJ-FLXSYLCISA-N 443.594 2.289 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)c3cnc[nH]3)C2)CC1 1808273213 QIUDJFLEGVCGKA-HWKANZROSA-N 426.473 2.085 10 20 IECD CC[C@@H](NC)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708525 FFQQNTQUKHYTLA-CMPLNLGQSA-N 438.937 2.432 10 20 IECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(F)c1 1847038285 LZOXFBWEQLANQV-XBXARRHUSA-N 442.443 2.482 10 20 IECD CC(C)Cn1c(CCC(N)=O)nn(CN(C)Cc2ccc(N3CCOCC3)cc2)c1=S 16878877 DNQKERKKLYJDGS-UHFFFAOYSA-N 446.621 2.414 10 20 IECD Cc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c(C)n1-c1nccs1 727176748 OAALDSXXADODTN-UKTHLTGXSA-N 442.613 2.301 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(OC)cc3C)CC2)cc1 727230569 SFBHTRSQLDINMN-UHFFFAOYSA-N 440.544 2.279 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)OCC(F)(F)F)cc2F)CC1 730193929 WJAYCROTAMEPFD-UHFFFAOYSA-N 434.434 2.262 10 20 IECD COC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 734529735 AQEFEXRVVKUGSK-UHFFFAOYSA-N 441.528 2.447 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[S@@](=O)Cc3ccccc3)cc2)C1 735108500 UXRDSKXSMBCIQO-PLTNMMHCSA-N 442.585 2.136 10 20 IECD CC(C)(C)c1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 737130192 CIJCUGHKHYPPDJ-UHFFFAOYSA-N 425.533 2.238 10 20 IECD Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 743047468 VZNZAUCSGRSUNP-UHFFFAOYSA-N 426.545 2.365 10 20 IECD CCCN(CC(=O)NN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O)Cc1ccccc1O 750872397 LBBUHPXQOFQXBX-HSZRJFAPSA-N 440.500 2.111 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)o1 751391069 GKENKMIRFSWURF-ZDUSSCGKSA-N 443.472 2.496 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNC(C)(C)C(=O)NCC3CCCCC3)CC2)cc1 754080994 IUVVECMURCFSDB-QFIPXVFZSA-N 446.636 2.243 10 20 IECD CCOC(=O)Cn1cccc(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1=O 754466356 RZEUGGHDFYBEIU-UHFFFAOYSA-N 428.489 2.164 10 20 IECD O=C(COC(=O)[C@H]1CCc2n[nH]cc2C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 757818381 OMMZVZZVVBPVMJ-ZDUSSCGKSA-N 429.432 2.472 10 20 IECD COc1cc(N2CCN(C(=O)c3cnn(-c4ccc(F)cc4)n3)CC2)cc(OC)c1OC 759221139 NEIQTXDNOADGSM-UHFFFAOYSA-N 441.463 2.395 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3nc4ccccc4s3)CC2)c1 760809112 TVWJIOXYMYCEHJ-UHFFFAOYSA-N 432.527 2.336 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(F)(F)F)nc3)cc2)C1 761895296 JNODDLHJDMHLOK-AWEZNQCLSA-N 449.433 2.057 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC(N4CCCCC4=O)CC3)CC2)cc1 763595566 OQHWFHCSIZAWOM-UHFFFAOYSA-N 443.592 2.004 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)cc2)C1 765886911 VWKHHHDRGHRXOV-WIYYLYMNSA-N 441.576 2.121 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)cc2F)C[C@@H](C)O1 770513456 ZBVVXIOLYYSBBR-LBTNJELSSA-N 429.558 2.019 10 20 IECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(NC(=O)CCN3CCOCC3)c2)c1O 775049812 DQAWMFFPLUMWIL-UHFFFAOYSA-N 444.488 2.260 10 20 IECD Cc1cc(Br)cc(CN2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)c1O 775652325 XZUGGJWRYWYGDN-UHFFFAOYSA-N 438.366 2.399 10 20 IECD CNC(=O)Nc1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778224002 OUQNBBGHTVJIIN-KHPPLWFESA-N 437.500 2.290 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N(CCO)C1CCOCC1 780306381 KRYKYPHDONKFOZ-UHFFFAOYSA-N 431.455 2.225 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1ccc(Cl)cc1 788331246 IETIJLSIABIHCK-INIZCTEOSA-N 431.920 2.377 10 20 IECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1cccc(F)c1 789799590 KBOBNMMRWRIABQ-HNNXBMFYSA-N 433.455 2.001 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(CC)CC 789800717 NWCWWINJRZDGAL-VQTJNVASSA-N 435.540 2.379 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@](CO)(c4ccccc4)C3)CC2)cc1 794734772 NYBZPFMSKNGLSW-TYBKAHOSSA-N 449.551 2.063 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](c4ccnn4C)C3)CC2)cc1 801002421 JRUGTQQDJHGNID-IBGZPJMESA-N 426.565 2.140 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1cccc(N2CCOC2=O)c1 803588639 GUAKNIGQEWQLTC-AWEZNQCLSA-N 428.464 2.342 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1)C1CCCCC1 803676606 ARPXVDXPENYDEF-YADHBBJMSA-N 428.577 2.051 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3COC4(CCCCCC4)O3)CC2)cc1 804319841 STLSDROOMOBNCY-OAQYLSRUSA-N 445.560 2.362 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(c4cccnn4)CC3)cc2)CC1 805025996 YNULNJKZKYUBLN-UHFFFAOYSA-N 436.560 2.114 10 20 IECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1F 807387506 LZBWJKWDGGVVQC-UHFFFAOYSA-N 438.253 2.251 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1 808347005 XDEYTFNYFFLZBQ-PKTZIBPZSA-N 444.620 2.375 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(O)nc(S)nc4c3)cc2)C1 918370889 CRELSRMBXKYGRY-OAHLLOKOSA-N 437.525 2.256 10 20 IECD CCN1C(=O)C(=CNC[C@@H](c2ccc(OC)cc2)N2CCCC2)C(=O)N(CC)C1=S 920979632 FLBZOFYEHKHOIU-IBGZPJMESA-N 430.574 2.301 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCCN2C(=O)NC(C)(C)C2=O)cc1 921193070 HGNLQOOGPOOCDR-LJQANCHMSA-N 430.549 2.371 10 20 IECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@@H](C)C[C@H](C)C4)C3=O)CC2)cc1 1319624332 GXKNQAILJQMQOD-ROUUACIJSA-N 442.560 2.481 10 20 IECD Cc1csc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777849160 NERZZDRBORUYKO-IIBYNOLFSA-N 431.514 2.304 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(Cl)cc1)c1cc(O)nc(O)c1 1793080162 KZQBPCSRYONMMM-MUJYYYPQSA-N 429.860 2.281 10 20 IECD CC(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)c1ccccc1 1796137044 UTNZPNNGPOCUBF-UDKICSLYSA-N 439.512 2.136 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2cccc(F)c12)c1cc(O)nc(O)c1 1801127324 KVKZGNFSNFAKNO-CLLJXQQHSA-N 425.420 2.074 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccnn23)[nH]n1)c1cc(O)nc(O)c1 1817847358 WXQHERSORWOXAY-MRXNPFEDSA-N 447.455 2.483 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3ccccc3)sc2C1 1821843871 DWQMMPIDZKELNO-GFCCVEGCSA-N 446.579 2.229 10 20 IECD C[C@@H](Cn1ccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428777 IPNBJYRAIFMECC-QFBILLFUSA-N 441.532 2.259 10 20 IECD CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1829475129 FJSNEVJIZRDHHT-LJQANCHMSA-N 441.532 2.336 10 20 IECD CCC(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1831358971 JUANLUZWEYXEHC-UGAXZCSASA-N 430.501 2.415 10 20 IECD Cc1occc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837455451 BYMHARFWZJNMPR-UHFFFAOYSA-N 429.473 2.320 10 20 IECD Cc1cc(C(=O)CN2CCC(C3OCCO3)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 110990136 UITLYBHCYWGDDE-UHFFFAOYSA-N 447.557 2.009 10 20 IECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)C1 728210709 MEMCFIYXZKELPK-LJQANCHMSA-N 445.589 2.126 10 20 IECD COC(=O)c1ccc(Br)c(S(=O)(=O)NCc2cc(OC)ccc2O)c1 751414792 GFMAERGBRDWMNP-UHFFFAOYSA-N 430.276 2.428 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752096851 JTWMGCUDHBEKKZ-SFHVURJKSA-N 426.469 2.254 10 20 IECD COc1ccc(N2CCN(CC(=O)NCC(=O)Nc3cc(C)ccc3OC)CC2)cc1F 753857935 RIHZEQCMXWIPDC-UHFFFAOYSA-N 444.507 2.028 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)co1 756793873 QIIBBBAIQUMWBI-MRXNPFEDSA-N 441.937 2.283 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 761609727 FIGDGZMLFXSDQE-GASCZTMLSA-N 449.529 2.260 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[S@@](=O)C1 762550569 ZGQFUUVYLGUYFK-GWQKEKGPSA-N 428.557 2.095 10 20 IECD Cc1cc(C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1cccc(Br)c1 763452370 NXDGNWYUQSBBDH-UHFFFAOYSA-N 442.335 2.052 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 764260428 LVHICKCHCCQMOO-ZIAGYGMSSA-N 449.529 2.294 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(c2cccc(F)c2)C(=O)C1 765229967 MDXQDYHHNTVODT-UHFFFAOYSA-N 430.455 2.360 10 20 IECD O=C(CCC(=O)N(Cc1ccco1)Cc1ccccc1O)N1CCN(c2ncccn2)CC1 768111088 XISDHDDJJSWJFF-UHFFFAOYSA-N 449.511 2.433 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)ccc1O 768503354 IAOUBCTZQMPXBP-UHFFFAOYSA-N 428.220 2.236 10 20 IECD O=C(NCCn1cc([N+](=O)[O-])cn1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 768522316 KSKJZVFAAADKPH-UHFFFAOYSA-N 442.398 2.146 10 20 IECD CCO[C@H](C)c1noc(CN2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)n1 769509355 WUGNZHYWNJASFE-QGZVFWFLSA-N 433.528 2.461 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 769635377 CUDUUCGIPZHFRJ-ZIAGYGMSSA-N 437.493 2.099 10 20 IECD C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770065800 GXBKZBVRVZIDNN-CHWSQXEVSA-N 427.523 2.282 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@H]1CCO[C@]3(CCOC3)C1)c2[N+](=O)[O-] 770907140 AGXDBVQCOAUIIQ-ZAMGYDSWSA-N 436.420 2.438 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1-c1ccccc1 772207822 CENLKMYMPJFNOV-UHFFFAOYSA-N 437.475 2.411 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 784026097 BNLCWYVJLLCZCV-UHFFFAOYSA-N 427.505 2.025 10 20 IECD Cc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCOCC2)c1 787613494 OUQUGJZBSZHJBY-JOCHJYFZSA-N 442.535 2.006 10 20 IECD Cc1ccccc1[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793730676 CFOSYMFXVUTIFG-LEWJYISDSA-N 448.567 2.329 10 20 IECD COc1ccc(CNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)c(O)c1 794376919 CXWRCLOZXFELCB-UHFFFAOYSA-N 429.292 2.049 10 20 IECD COc1ccc(N2CCN(C(=O)NCCS(=O)(=O)CCc3ccccc3)CC2)cc1F 800064482 WLHHHOCPQPDITO-UHFFFAOYSA-N 449.548 2.323 10 20 IECD Cc1ccccc1N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803298475 BCUNSUFWQDDKST-HXUWFJFHSA-N 436.556 2.358 10 20 IECD COCc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 803300184 QPBWVFBPYNTCFP-INIZCTEOSA-N 429.492 2.302 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(OCC2CC2)nc1)c1ccc(N2CCOCC2)cc1 803307021 YYIUINCELVFBDC-QGZVFWFLSA-N 438.528 2.201 10 20 IECD Cc1cc(C(=O)CN2CC[C@H](N3CCCC3)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 805768416 IWJOREDMLGKIOG-AVRDEDQJSA-N 444.601 2.483 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCCC[C@H]3COC(=O)NC3CC3)CC2)cc1 810036977 DAILJFDBDQIEEE-FQEVSTJZSA-N 430.549 2.087 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1C 810164246 BSYZYQYTKHUJIH-UHFFFAOYSA-N 445.585 2.107 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(CO)C[C@H]3c3ccccc3)CC2)cc1 812016712 NWNWOCCIUQPMMO-UKILVPOCSA-N 438.572 2.283 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ncn(C(C)(C)C)n3)cc2F)C[C@@H](C)O1 812694132 SBZXIMKFXXWRSV-HUUCEWRRSA-N 447.511 2.259 10 20 IECD COc1cccc(CNC(=O)c2ccc(C(=O)NCc3cccc(OC)c3O)nc2)c1O 813488656 BJGNGYCCPJJSSJ-UHFFFAOYSA-N 437.452 2.370 10 20 IECD Cc1cc(C(=O)N(C)CCOc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccn1 817222555 NRFJEVQJIXQULB-UHFFFAOYSA-N 428.514 2.288 10 20 IECD O=C(CCNS(=O)(=O)c1cccs1)NCc1ccc(N2CCSCC2)cc1 917385639 IGVNBTNZLYIYFG-UHFFFAOYSA-N 425.601 2.286 10 20 IECD COc1ccc(C(=O)NCCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917708306 DRKZOXGDHBXGOW-UHFFFAOYSA-N 429.492 2.497 10 20 IECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(CCNC(C)=O)cc3)CC2)cc1 917759760 YILQJEZAUVEWHX-UHFFFAOYSA-N 431.558 2.275 10 20 IECD COC(=O)C[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 919723805 JVIVCMATTRJNLB-LMMKCTJWSA-N 435.540 2.473 10 20 IECD Cc1ccc(N2CCC(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)CC2)nc1 919818504 JEFWTFDFJYUXDJ-UHFFFAOYSA-N 442.585 2.158 10 20 IECD CN(C(=O)C1CC1)c1ccccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 919848916 WCNGDIOKDRFQMJ-UHFFFAOYSA-N 441.553 2.224 10 20 IECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)nn1C 1796934486 JRFJBYWRNPNPIB-IDHPPYADSA-N 448.527 2.027 10 20 IECD Cn1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1Cl 1799029812 QABSZUWNPCWKDG-JDGWPXKUSA-N 446.891 2.156 10 20 IECD Cc1csc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)c1 1802079064 RJIPQWXCRVEAEJ-VBUUTPMESA-N 444.509 2.090 10 20 IECD CCN(CC)C[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289627 MWEQGHMNFGVUPQ-NDTRKSHOSA-N 445.560 2.433 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1cc(O)nc(O)c1 1817844270 WAESRZIPVLIZLO-LBPRGKRZSA-N 432.824 2.477 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCCC2)[nH]n1)c1cc(O)nc(O)c1 1817848453 KLFPNVMCPIWESP-INIZCTEOSA-N 428.493 2.008 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc[nH]2)CC1 1825883663 AKMNXMFROGEVCA-NRFANRHFSA-N 448.527 2.436 10 20 IECD O=C1CCc2ccc(C(=O)N3CC4(CCCN4C(=O)/C=C/c4ccc(O)c(O)c4O)C3)cc21 1847039285 BEVMGYYEBGMGLM-RMKNXTFCSA-N 448.475 2.463 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc1 24110232 FMTMNDITNHMOER-UHFFFAOYSA-N 446.573 2.009 10 20 IECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729062462 BLARZRLWJSNCBR-AWEZNQCLSA-N 449.529 2.295 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CN(Cc2ccccc2)CCO1 741278787 NHKYDRRWFXOZRX-QHCPKHFHSA-N 427.520 2.304 10 20 IECD Cn1ncc2c(O)nc(CCC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nc21 742801578 RBIMDBRTBYBMSK-ZDUSSCGKSA-N 446.458 2.388 10 20 IECD COc1ccc(OCCNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742948255 OXFMZQCFVWVQDS-UHFFFAOYSA-N 428.533 2.204 10 20 IECD O=C(NC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1)C1CC1 751064420 KLZQPBMHQARDQG-UHFFFAOYSA-N 449.554 2.385 10 20 IECD NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 751115615 GWHDKMMFJZDPKW-SFHVURJKSA-N 441.399 2.427 10 20 IECD COCCN(C)S(=O)(=O)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 757320126 QMFQDUBWGCESKX-UHFFFAOYSA-N 444.351 2.409 10 20 IECD O=C([C@H](Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCC1 764979535 FZLAPVVNRCMXEX-QFIPXVFZSA-N 427.520 2.222 10 20 IECD Cn1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(Br)c1=O 772435720 OVCMIFHSXUNPQD-UHFFFAOYSA-N 439.285 2.445 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCCN2CCCC2=O)cc1 774475213 YNBZHHHPRABDSH-UHFFFAOYSA-N 426.517 2.003 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCO[C@H]3C(C)C)CC2)cc1 778305559 BFNVMOVLAJKNMV-TVABSCNISA-N 429.561 2.467 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(CCCO)CC3)cc2F)C[C@@H](C)O1 789821489 TURYRONAOXXHKY-IAGOWNOFSA-N 435.540 2.067 10 20 IECD COc1cccc(F)c1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841402 WZORZILHBFOAAM-AWEZNQCLSA-N 447.482 2.428 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC(c4ccccc4)CC3)cc2)C1 793721725 RSEDGJOSHKNCFC-JOCHJYFZSA-N 448.567 2.411 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@@H](C(=O)OC)c2ccccc2)cc1C 795304133 JNPAWMIYSCJSPJ-QGZVFWFLSA-N 440.543 2.455 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCCCSc1nccs1 799255226 FDFDXRZKQRUHNF-MRXNPFEDSA-N 448.570 2.298 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C3CCN(S(N)(=O)=O)CC3)cc2Cl)C1 800571586 KRLNEKZMLGTBLK-AWEZNQCLSA-N 428.986 2.108 10 20 IECD CO[C@@H]1CCC[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451781 WATGBKZCZXRZKB-RDTXWAMCSA-N 425.476 2.304 10 20 IECD COC(=O)N1CCC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803678100 YADXVFHJDBLOGY-SFHVURJKSA-N 430.549 2.419 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2CN2CCOCC2)cc1F 804852181 CCPPAOCRSAONKL-IBGZPJMESA-N 434.556 2.001 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H]3[C@H]3CNC(=O)C3)cc2)CC1 805024391 DUFRZIRAWUXQGY-CTNGQTDRSA-N 426.561 2.056 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC[C@H]3N3CCOCC3)cc2)CC1 805025415 PACGTKXVRROPED-XZOQPEGZSA-N 442.604 2.299 10 20 IECD O=S(=O)(CCNS(=O)(=O)c1ccccc1)NCc1cc(Cl)cc(Cl)c1O 805134912 CBYNOJDCNBQHND-UHFFFAOYSA-N 439.342 2.097 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(N(C)C)cc1 807672875 JUHKJTHFGYHITG-INIZCTEOSA-N 425.489 2.187 10 20 IECD COC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 807835166 VWILZMCLBRCLCN-MRXNPFEDSA-N 443.500 2.497 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](C(=O)NCC3CC3)C2)c1 917468515 RPNNEQRKPCZSES-LJQANCHMSA-N 429.561 2.165 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3C(=O)COc4ccccc43)cc2F)C[C@@H](C)O1 917708657 DJKZBBNHNSRRCS-HZPDHXFCSA-N 427.476 2.481 10 20 IECD C[C@@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H](C)O1 918117707 HXAVQUJUTCYYSY-GGPKGHCWSA-N 445.608 2.075 10 20 IECD COc1ccc(OC)c([C@@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918213836 UFVDVPYZWLOMHM-NRFANRHFSA-N 447.507 2.337 10 20 IECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1F 1812481263 ORXUOJBLVQGREL-BFCCKJOKSA-N 441.459 2.276 10 20 IECD Cc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844386 ZTQDXLSABVUJOK-AWEZNQCLSA-N 426.433 2.440 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccc2nonc2c1 1818550782 ZKRKFURSXIRDIF-MRXNPFEDSA-N 449.427 2.372 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc2cccn2cn1 1818777691 MBVAAQPGGUBIKV-QGZVFWFLSA-N 447.455 2.483 10 20 IECD Cc1cccc(/C=C/C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1841043671 WHYQZWWTXAMIAD-VAWYXSNFSA-N 443.507 2.400 10 20 IECD CC(C)c1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)no1 1842543945 LXXQTZHPXJLSCA-FNORWQNLSA-N 427.457 2.445 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 470528430 AJRMXZUCGQSCTO-NRFANRHFSA-N 449.511 2.028 10 20 IECD Cc1nc2n(n1)C[C@@H](NC(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 727223871 FXVATRKNSUYEQJ-HNNXBMFYSA-N 438.454 2.256 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCS(=O)(=O)NC[C@@H]1CCCCO1 732164080 FMZPIUCSGXBGTR-INIZCTEOSA-N 425.576 2.374 10 20 IECD O=C1CC2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)CC2)CN1 752004741 KQMJQGDUBPMOTC-UHFFFAOYSA-N 440.466 2.354 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 752658098 ZTPJKSSTRLGJDM-UHFFFAOYSA-N 446.573 2.380 10 20 IECD COc1cc(N2CCN(C(=O)c3cccc(CS(C)(=O)=O)c3)CC2)cc(OC)c1OC 759221349 OUVWLHDVTJTCGE-UHFFFAOYSA-N 448.541 2.219 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C(=O)[C@@H]2C1 761091365 NZJOUPNZTRLXLN-BFIPOCKSSA-N 433.480 2.155 10 20 IECD O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCC(O)CC2)c(F)c1 770278594 PTRFHECWDIGKLO-UHFFFAOYSA-N 434.533 2.384 10 20 IECD COc1nc(O)cc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 770515474 CBNZVNFXKVPCQU-LLVKDONJSA-N 447.403 2.150 10 20 IECD C[C@@]1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCCOC1 772903889 YIGGIGIVZJRJJO-LJQANCHMSA-N 435.458 2.400 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](Cc3ccccc3)N(C)C)CC2)cc1 774917214 GFMBLHRQUYFRAX-JOCHJYFZSA-N 438.572 2.069 10 20 IECD C[C@@H]1CCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 783918124 DKZJIDNJNKFZDR-CQSZACIVSA-N 448.501 2.315 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3CCCCS3(=O)=O)cc2F)C[C@@H](C)O1 784222696 NJSXAWNLDYUONY-BFYDXBDKSA-N 427.542 2.206 10 20 IECD COc1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 785017937 ITWWRZWAOGVJSJ-UHFFFAOYSA-N 444.962 2.062 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1nnc2n1CCCCC2 786054874 PWPQYZBCDIADRA-MRXNPFEDSA-N 442.589 2.051 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CSCN3C(=O)CC(C)(C)C)cc2)CC1 786655610 GGKBSGQEYOQDJQ-HXUWFJFHSA-N 446.617 2.309 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@@H](O)c3ccc(F)cc3)CC2)cc1 787254281 UYASWLOKSPNBDR-GGAORHGYSA-N 440.519 2.296 10 20 IECD CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789848078 YPNAJIQVNKESNX-CHRHUSMYSA-N 437.631 2.052 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NC[C@@H]1CCSC1 790502093 RWFREOUXCZNALX-KRWDZBQOSA-N 430.553 2.495 10 20 IECD CCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccn1 793726133 RWKQJCLCDVXLEH-NQIIRXRSSA-N 437.544 2.057 10 20 IECD COc1ccc(CNC(=O)c2cncc(C(=O)NCc3ccc(OC)cc3O)c2)c(O)c1 796351681 FHUGFVOVHJODGH-UHFFFAOYSA-N 437.452 2.370 10 20 IECD Cc1noc([C@H]2CCCN2CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1 796692268 ARQHPYGFPPDPBY-LJQANCHMSA-N 443.529 2.453 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)s2)cc1 797432797 SWELOWGEYALRRU-UHFFFAOYSA-N 426.339 2.188 10 20 IECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 803299659 MCASJGNOAICLFQ-YSNWRPKNSA-N 429.561 2.364 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCCN2CCc3c(Cl)cccc3C2)cc1F 803661958 PGOCAHZRWPYWAK-UHFFFAOYSA-N 432.927 2.336 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCc4c(ncn4-c4ccccc4)C3)ccc21 803688913 FJHWLFVQKQLBNL-UHFFFAOYSA-N 429.524 2.456 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(COC(C)(C)C)on3)CC2)cc1 804316104 YIAAJBVRWYHGMB-UHFFFAOYSA-N 444.532 2.400 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 807674488 LSUALOGNJQNDSV-QGZVFWFLSA-N 440.519 2.444 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CC(N)=O)C3)cc2Cl)C1 807955665 ABFKEIFNXKVFGW-DOTOQJQBSA-N 434.968 2.307 10 20 IECD C[C@@H](NC(=O)CNS(=O)(=O)c1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 810207433 ISADQERUANBJDM-OAHLLOKOSA-N 437.949 2.332 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc(N4CCCNC4=O)cc3)nc12 812899206 ITLKEVDAHNQHQU-CQSZACIVSA-N 438.488 2.382 10 20 IECD Cc1cc(C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c(C)n1-c1ccc(F)cc1 820255262 HUJZNNBPOSUQKK-UHFFFAOYSA-N 427.523 2.117 10 20 IECD CCCN(C(=O)[C@@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 914903516 MWXZVKICPQHBFQ-QZTJIDSGSA-N 447.557 2.460 10 20 IECD Cc1cc(C(=O)CN2CCN(C(=O)N(C)C)CC2)c(C)n1-c1ccc2c(c1)OCCO2 915217153 HNPSQQOXLJNAEH-UHFFFAOYSA-N 426.517 2.347 10 20 IECD C[C@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccc(S(N)(=O)=O)c1 916197511 VVYYOCYBUQTMNV-MAUKXSAKSA-N 433.530 2.491 10 20 IECD CS(=O)(=O)C[C@@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 917120754 MTGCQQBQRKMLJH-OAHLLOKOSA-N 440.521 2.157 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(-n2cnnn2)cc1 917381011 RAYMOCZOXUGYHO-UHFFFAOYSA-N 432.406 2.448 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)cc1 918082167 LIJVJXKUKRDGLL-UHFFFAOYSA-N 443.592 2.178 10 20 IECD COc1ccc(-c2nnc(S)n2CC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 919767191 NTMBOOSOSFPEOJ-UHFFFAOYSA-N 439.541 2.395 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920051422 OPPCTEOVWICAIF-UHFFFAOYSA-N 449.533 2.171 10 20 IECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 920964474 IJDFOSSAZQCYER-BKOMJCAWSA-N 426.428 2.208 10 20 IECD Cc1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1797145924 TVONZCWUNWWRMT-GGPHIMKMSA-N 431.496 2.435 10 20 IECD COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1798890876 DJOIVGNEWORUPC-CCWDJLKJSA-N 446.887 2.277 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccc(O)cc3F)CC2)C1 1810555053 YESGDMRZGHOKHM-UHFFFAOYSA-N 429.448 2.496 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCSC1)CC2)c1cc(O)nc(O)c1 1816729240 YGDXBMQFWAAPCD-JQWIXIFHSA-N 434.543 2.318 10 20 IECD C[C@@H]1C[C@]1(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1820772524 IYQAVRDXXKFXCY-AGMRTUQYSA-N 435.575 2.308 10 20 IECD Cn1ncc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1Cl 1844590549 BTQIXVIEFWNXPB-UHFFFAOYSA-N 425.272 2.269 10 20 IECD CCCn1c(N)c(N(CCOC)C(=O)c2ccc(-n3c(C)ccc3C)cc2)c(=O)[nH]c1=O 57353188 CLRDPUGAJXSYKE-UHFFFAOYSA-N 439.516 2.230 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1 437020216 PLWWILKEQFJLHB-UHFFFAOYSA-N 425.457 2.125 10 20 IECD O=C(NCCNC(=O)c1cccnc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726704990 AFSGDHZPEFCKAT-UHFFFAOYSA-N 433.459 2.381 10 20 IECD COC(=O)c1ccc(OCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 731280965 KBHDIYBQPCMTPE-UHFFFAOYSA-N 445.491 2.452 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1)c1ccc(N2CCOCC2)cc1 737157629 KYNKAJIGQYPPSE-OAHLLOKOSA-N 438.463 2.059 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCOCC3CCOCC3)cc2)C1 740918872 UEISVZSOLXYMOH-HXUWFJFHSA-N 432.565 2.021 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3COc4cc(OC)ccc4C3)CC2)cc1 747421736 DBRKSOXBPSFDGB-IBGZPJMESA-N 425.529 2.193 10 20 IECD O=S(=O)(c1ccc2nc(O)nc(O)c2c1)N(Cc1ccccc1O)C[C@H]1CCCO1 751120326 GKJJESNHPDRBIY-CQSZACIVSA-N 431.470 2.117 10 20 IECD C[C@@H](OC(=O)c1coc(C(N)=O)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759774912 IEWXLKKOFFWZPO-LLVKDONJSA-N 432.388 2.338 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(C)nn(CC(F)F)c3C)CC2)cc1 760827850 WJCSMCNCPHEQKQ-UHFFFAOYSA-N 436.459 2.279 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC([C@](C)(O)C(F)(F)F)CC3)CC2)cc1 767904706 GEPALKLRDJJNLH-FPOVZHCZSA-N 445.526 2.203 10 20 IECD O=C(O)c1cc(NS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)ccc1O 771153060 VHVXEADYZKSGPN-UHFFFAOYSA-N 434.195 2.491 10 20 IECD C[C@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccc(N2CCOCC2)cc1 775258304 WSUXFIYSBSBDOF-AWEZNQCLSA-N 428.558 2.462 10 20 IECD Cc1cc(C)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(C)c1NS(C)(=O)=O 775287459 AATNFBWIENIGKA-UHFFFAOYSA-N 429.476 2.398 10 20 IECD CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)N1CCCC1 775419919 CETFUEPIZGQHIY-IXFSTUDKSA-N 448.583 2.292 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC4(CCOCC4)C3)CC2)cc1 778290318 UTOLWJHRONQEHA-FPLPWBNLSA-N 427.545 2.319 10 20 IECD CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2ccc(N3CCOCC3)c(F)c2)CC1 783504524 LYMWNUZGSJIGLK-QGZVFWFLSA-N 435.540 2.332 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)cc1 784564182 PCHPIACXSSJFFS-UHFFFAOYSA-N 440.500 2.051 10 20 IECD COC[C@@H](C)n1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 784768514 YWJZJOQVFCUQQR-RHSMWYFYSA-N 449.939 2.169 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(CC(=O)NC)cc1 785191994 IOEGNVKQIYITRH-UHFFFAOYSA-N 448.317 2.430 10 20 IECD C[C@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427893 GRUIOGJLGDPORX-HXUWFJFHSA-N 438.572 2.118 10 20 IECD COc1ccccc1CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CC1 789799723 KSKUGYJWYJEKNH-UHFFFAOYSA-N 441.503 2.478 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CCCN(c2ccccc2)C1 789799777 LNZJKPWAMJBHIU-IBGZPJMESA-N 440.519 2.064 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@@H]2CCCC[C@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796134742 FMYMSJIQTBDBGZ-OXJNMPFZSA-N 448.541 2.409 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3C[C@@H](C)O[C@@]4(CCCOC4)C3)cc2F)CC1 797451626 MDSDMAALNSUFAM-JPYJTQIMSA-N 434.556 2.447 10 20 IECD CN(Cc1ccccc1O)c1nnc(-c2ccc(-n3cnnn3)cc2)n1C[C@H]1CCOC1 812388071 WBBBUZWPXPQEAY-MRXNPFEDSA-N 432.488 2.299 10 20 IECD CN(C)C(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918038790 ZDUUQRYSVHLTPW-IBGZPJMESA-N 437.544 2.341 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2)C1 918117681 HPMJTRGZQMMDTQ-FCHUYYIVSA-N 435.572 2.462 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(N2CCCC2)nc1 918441205 YLNTUIYMDNHHKN-UHFFFAOYSA-N 441.507 2.037 10 20 IECD CC(C)Oc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918462524 BVUTYKOTKHDKHH-GOSISDBHSA-N 438.528 2.430 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1 1117144001 WUDXRAIMVIEFMJ-YOEHRIQHSA-N 427.375 2.441 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3c3cccn3C)cc2F)C[C@@H](C)O1 1321602060 HRBGTYFYEMTBTI-IEGUWTFLSA-N 444.551 2.468 10 20 IECD NC(=O)c1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787013895 YHXQQRSIPQNYLU-UHFFFAOYSA-N 447.451 2.048 10 20 IECD CC1(C)CCC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1799399127 PCJHECMONDDWCB-UPHUGPLXSA-N 431.533 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc2cn[nH]c2cn1 1804286489 ZRQIQZZLSIVXIQ-KOTZLPFRSA-N 449.467 2.040 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1)c1ccon1 1816591714 QFDJASFJPMVYLR-SFHVURJKSA-N 447.455 2.497 10 20 IECD Cc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721848 QIEYBFKCWXAIGN-GFCCVEGCSA-N 425.470 2.192 10 20 IECD CCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828200078 KSMPWBTUGHRLOS-FLUIGGAXSA-N 447.513 2.312 10 20 IECD CC(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828247239 QWACEUAUWLNEKQ-LLVKDONJSA-N 440.616 2.352 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)n2)C3)cc1 1845398451 PYZXDSJKZTZIDC-UHFFFAOYSA-N 447.495 2.426 10 20 IECD COc1ccc(N2CCCN(C(=O)c3nc(S(C)(=O)=O)n4ccccc34)CC2)cc1 109253359 YIOJWGXVVJYICQ-UHFFFAOYSA-N 428.514 2.099 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(S(C)(=O)=O)cc3)cc2F)CC1 730117561 ZPJSDLGKWDVYRH-UHFFFAOYSA-N 448.564 2.371 10 20 IECD CO[C@](C)(C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 730356535 ZRODCVMOZRKQRT-QHCPKHFHSA-N 430.476 2.384 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(Cc4ccc(Cl)nc4)CC3)CC2)cc1 734837631 OLSCESGSTYKBNJ-UHFFFAOYSA-N 443.979 2.210 10 20 IECD CCc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1S(N)(=O)=O 735750263 GWQDINOZGAIXPZ-UHFFFAOYSA-N 436.509 2.194 10 20 IECD CN1CCC(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 746146758 JIRAFMQINAWHJT-GOSISDBHSA-N 435.528 2.097 10 20 IECD CCOCCO[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 750261788 ISNMPXWINOGHGN-NSHGMRRFSA-N 437.556 2.183 10 20 IECD CCOC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 752886430 QPDQLWMQDJSDBX-MRXNPFEDSA-N 428.489 2.157 10 20 IECD COC(=O)c1ccc(CN(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 754059807 IHLDPPAAMYRVHE-JOCHJYFZSA-N 427.545 2.097 10 20 IECD CCC[C@H](C)N1C[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1=O 759222835 XRJAESGIQCPWPD-IRXDYDNUSA-N 433.549 2.398 10 20 IECD CCc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1S(C)(=O)=O 765646981 APLZRJROSCWFRJ-LJQANCHMSA-N 443.569 2.284 10 20 IECD CC(C)OC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 770707262 SHTSIDPMRKUFME-GGPKGHCWSA-N 437.556 2.181 10 20 IECD CC[C@@](C)(CCO)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 771547425 RUQITAOFXZMKCF-QFIPXVFZSA-N 430.528 2.293 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 772549899 MBLWJSMPCKVLOZ-UHFFFAOYSA-N 448.422 2.061 10 20 IECD CCC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 772921427 PNOQFCKBJNGRBD-GOSISDBHSA-N 429.542 2.460 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)nc12 778169730 NEJMCIIEPUVALT-UHFFFAOYSA-N 436.327 2.355 10 20 IECD COC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc([N+](=O)[O-])c1 781045341 ITCIRIIHYAUJSS-UHFFFAOYSA-N 426.429 2.302 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cnn(Cc2ccccc2)c1 788828643 VMFDYFIBSUIWIZ-UHFFFAOYSA-N 447.539 2.043 10 20 IECD CCc1nc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 789827592 SVVXRWTVKLUGOZ-GJZGRUSLSA-N 448.564 2.433 10 20 IECD CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793727035 VICWPQQYWMNMBB-JVFUWBCBSA-N 440.588 2.432 10 20 IECD CC[C@]1(C)CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451346 KNMOEZSCLIBIQB-OAQYLSRUSA-N 425.476 2.401 10 20 IECD CCN(CC)c1ccc(CNc2ccc(S(=O)(=O)N(C)C)cc2S(N)(=O)=O)cc1 804357399 HCJAKDOLJZIYAY-UHFFFAOYSA-N 440.591 2.043 10 20 IECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C[C@]2(CCOC2)O1 805026731 YRCZVASAPJGZIC-URXFXBBRSA-N 429.561 2.336 10 20 IECD C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 917371641 MNGHMKNEOZRTHQ-XMMPIXPASA-N 433.464 2.377 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)NCC(=O)N1CCCC1 925184422 QFUXWBHBVTZRNY-UHFFFAOYSA-N 430.530 2.172 10 20 IECD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc1 1336034542 ICFBAEGAQXZYNW-KRWDZBQOSA-N 431.558 2.266 10 20 IECD Cc1cc(F)cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777852261 LZXYKOCTIHMEQG-WZONZLPQSA-N 443.475 2.382 10 20 IECD Cc1ccc([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)cc1 1783309327 AJZHKMHOVNHONP-QMHKHESXSA-N 425.485 2.048 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242173 RGKYEBBYNBMXRV-YEWWUXTCSA-N 431.876 2.053 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc3ccccc3o1)C2)c1cc(O)nc(O)c1 1796137321 DIZDKIULNDGVNG-YPIOULGTSA-N 449.463 2.156 10 20 IECD Cn1cncc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1808543905 QCXCCABRDJKLPE-GQCTYLIASA-N 440.500 2.095 10 20 IECD CCn1nc(C)cc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543545 IJVFRXLTLHSQOE-UHFFFAOYSA-N 427.505 2.176 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc4ccccn4n3)CC2)C1 1810551362 HTUFXWDUYISJEY-UHFFFAOYSA-N 435.484 2.299 10 20 IECD CC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1812574416 QZNJTMNRAGUTJF-FAFAAHBOSA-N 445.497 2.255 10 20 IECD CC(C)n1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)n1 1821674681 YBXGVPAISOUJHK-GFCCVEGCSA-N 442.501 2.266 10 20 IECD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)N1C[C@H]2C[C@H]2C1 1827428172 KMGWOTGRHXQVHQ-XCLNPWKQSA-N 442.560 2.066 10 20 IECD CC1(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)CCC1 1828242129 HEUGKMCCMSYTLW-JTQLQIEISA-N 438.600 2.106 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 541995495 VIBYXACODFUIFK-UHFFFAOYSA-N 430.530 2.418 10 20 IECD Cc1c(CNC(=O)C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)n(C)c2ccccc12 572435695 YNWALYBLHFXHRS-QZTJIDSGSA-N 440.588 2.451 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(C(=O)Nc3cccc(F)c3)CC2)c1 725897942 CKVVNBXHFJIDLT-UHFFFAOYSA-N 435.477 2.394 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726625774 OPOPJMHHMLAOGK-UHFFFAOYSA-N 445.474 2.252 10 20 IECD NC(=O)NC[C@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 726722138 NCRKYYPZFBOIPM-CQSZACIVSA-N 425.480 2.347 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)oc(=O)n4C)CC2)cc1 728393869 RVORNDRDOACGAE-UHFFFAOYSA-N 425.489 2.084 10 20 IECD CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 730671497 AXRUEACPKHWPPM-UHFFFAOYSA-N 429.540 2.455 10 20 IECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn4nccc4c3=O)c2C)cc1F 732863712 ARMQVILIEHLOSL-UHFFFAOYSA-N 437.431 2.172 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 734407368 QFBDGTYGSHYJGN-FQEVSTJZSA-N 446.529 2.439 10 20 IECD CCCN(Cc1ccccc1O)C(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1 737057948 OGSTUZPLCZKVSH-UHFFFAOYSA-N 439.578 2.287 10 20 IECD CCN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 737137948 FLAPMHUXTOQBKV-IBGZPJMESA-N 449.555 2.026 10 20 IECD Cc1cc([C@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)o1 745691391 JWZCUPPHLIDZLN-WZONZLPQSA-N 428.533 2.305 10 20 IECD C[C@@H](O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 747390709 WIIWIQTVMNPCFL-MJGOQNOKSA-N 442.539 2.245 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(C(=O)OC)cc2OC)cc1 749013173 ZBSXRLBVLMMTII-UHFFFAOYSA-N 434.517 2.106 10 20 IECD COc1cccc(NC(=O)CN(C)C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 756336794 QAPJUDBAVAMOBY-NRFANRHFSA-N 441.528 2.479 10 20 IECD COc1cc(N2CCN(C(=O)CNC(=O)Nc3ccccc3)CC2)cc(OC)c1OC 759404504 HILNEGJGYYMANC-UHFFFAOYSA-N 428.489 2.183 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc(OC)c1OC 760117453 JGJQXXXMLUYWGP-SJORKVTESA-N 448.564 2.191 10 20 IECD CC(C)C[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 768512572 QXXLINFAVIYWQZ-MPGHIAIKSA-N 434.512 2.022 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2F)c1 769760044 SAYBFYMBXFXRKK-HNNXBMFYSA-N 439.490 2.057 10 20 IECD O=C(CN1CCC(Oc2ncccc2F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 773984013 OGJIBYJQUQUJGL-UHFFFAOYSA-N 446.498 2.356 10 20 IECD COc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)cc1 774812176 PLLHRFWTJOMUNR-JOCHJYFZSA-N 442.535 2.470 10 20 IECD CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1CCS(=O)(=O)C1 778515241 PTYNXJJCXQBHCR-INIZCTEOSA-N 440.521 2.300 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 782815811 VEEQMAVSFWJESP-MDZDMXLPSA-N 440.456 2.456 10 20 IECD Cn1nccc1COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398819 OGENWRDPIGIAPR-UHFFFAOYSA-N 432.414 2.192 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)C(=O)CC3)cc2)CC1 786656726 QPALKXSSGRWOBV-UHFFFAOYSA-N 433.512 2.154 10 20 IECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 789971194 VIAYAQSIIOANSC-SJLPKXTDSA-N 433.549 2.446 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 793055193 VULOKBBVIHUCSB-SECBINFHSA-N 438.234 2.454 10 20 IECD CC[C@H](C)[C@@H](C)N(C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CC1 803750375 LWLPIXGBSJMGGR-RBUKOAKNSA-N 430.593 2.359 10 20 IECD COCc1ccccc1CS(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 806091780 FYRFQZOBJOIEIF-UHFFFAOYSA-N 444.534 2.309 10 20 IECD COc1ccc(C(=O)OCC(=O)C(C)=O)cc1S(=O)(=O)N1CCCc2ccccc21 808482973 AUMYZDDZOOECRN-UHFFFAOYSA-N 431.466 2.152 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4[nH]nnc4-c4ccccc4)n3)CC2)cc1 809464670 KCOLBCWPHLLLPV-UHFFFAOYSA-N 445.483 2.422 10 20 IECD C[C@H](Cc1cnc2ccccc2n1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 815065597 IFRCPULOPDETOV-QGZVFWFLSA-N 438.553 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)c3c(I)cnn3C)CC2)cc1F 815773293 IZQCSYSVDPKSFK-UHFFFAOYSA-N 444.248 2.135 10 20 IECD Cc1cc(C(=O)COC(=O)C2(O)CCCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 913289493 IBTDGZPMTXUJGX-UHFFFAOYSA-N 434.514 2.163 10 20 IECD CNS(=O)(=O)Cc1ccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 916229280 YIHXBVUJPRYBKU-HXUWFJFHSA-N 447.557 2.332 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@@]1(N2CCOCC2)CCSC1 916624727 NTQHBDXOUSGGMJ-NRFANRHFSA-N 436.647 2.247 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)CC2)cc1 918462069 PZPCOXPYSNPSOG-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 919046320 YJQTWGPEEIJHCM-CYBMUJFWSA-N 436.424 2.170 10 20 IECD CCCC[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1cc(C)on1 920635117 CQIZCEQBTSIHJE-OAHLLOKOSA-N 425.463 2.414 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 1323789715 MIPQXAIKBIOHIY-GOSISDBHSA-N 444.557 2.080 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCCN3Cc3ccncc3)CC2)cc1 1327569390 LTBHKCACYPYNCK-XMMPIXPASA-N 437.588 2.383 10 20 IECD CC1(C)CC(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)C1 1784025064 HXFBNAPWOPVSMG-DEOSSOPVSA-N 438.528 2.045 10 20 IECD C[C@@]1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC=CCC1 1785510703 YVGVSVARDMKJJN-NLPUISFESA-N 442.512 2.393 10 20 IECD Cn1cc(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)C2)cn1 1808352093 NKVAYAJHJSXHJI-GQCTYLIASA-N 440.500 2.095 10 20 IECD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1 1814191068 GSKGHAIBFFMHEW-OXJNMPFZSA-N 446.598 2.138 10 20 IECD COc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816431300 SXZLPKDUFCLVCI-OAHLLOKOSA-N 438.444 2.239 10 20 IECD O=C(CCc1ccccn1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721532 MUZHRPPUOJMCIB-AWEZNQCLSA-N 439.497 2.203 10 20 IECD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c(C)n1C 1816726997 ASQAFOCXNLVVBU-ZDUSSCGKSA-N 441.513 2.444 10 20 IECD Cc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829438156 HCGYZNLKZTUXIU-KRWDZBQOSA-N 425.489 2.138 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 19608147 QSZJETSCPWJSHW-MRXNPFEDSA-N 447.509 2.416 10 20 IECD CC(=O)c1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 670072968 YTMDMJVGFZFRAW-AWEZNQCLSA-N 431.514 2.048 10 20 IECD CN(c1ccc(CNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1)C1CCCCC1 742416621 HMDPRQQTJXFRES-UHFFFAOYSA-N 435.528 2.331 10 20 IECD O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NCc1ccc(N2CCCCC2)cc1 742475786 NPZQITPXYUFOBQ-UHFFFAOYSA-N 432.524 2.365 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(S(=O)(=O)NC2CC2)cc1 747546394 PIIANNKMFORVLP-UHFFFAOYSA-N 448.520 2.425 10 20 IECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NCc1ccccc1O 748443575 RRYITRDZJROFIO-UHFFFAOYSA-N 435.502 2.134 10 20 IECD CNC(=O)CCOC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 749045694 CIFFMKDNJSNDAM-XYOKQWHBSA-N 443.344 2.330 10 20 IECD C[C@@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1cc2c(cc1O)CCCC2 756442312 OHMZARLNVWXEAQ-GOSISDBHSA-N 444.601 2.469 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1)c1ccc(N2CCOCC2)cc1 758980727 CHHJNCJOCDZDMD-HNNXBMFYSA-N 438.463 2.059 10 20 IECD COc1cc(N2CCN(C(=O)N[C@H]3CCc4nc(C)ncc4C3)CC2)cc(OC)c1OC 760096063 LOPYRQDUSPWSDW-KRWDZBQOSA-N 441.532 2.200 10 20 IECD Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1S(N)(=O)=O 761983482 SBAMELBMVHZFEX-KRWDZBQOSA-N 437.949 2.396 10 20 IECD CS(=O)(=O)c1ccc(N(Cc2ccccc2O)C[C@H]2CCCO2)c(S(C)(=O)=O)c1 762176124 IPTHJZHQMOFRTG-MRXNPFEDSA-N 439.555 2.385 10 20 IECD COc1ccc([C@@H](CCO)NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 764369651 QBUMMXRLYIZJQE-HSZRJFAPSA-N 442.560 2.249 10 20 IECD C[C@H](NC(=O)NCc1cccc(Br)c1O)c1cccc(S(N)(=O)=O)c1 764756389 BHRAQVADONXNBR-JTQLQIEISA-N 428.308 2.363 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(-c4cccc(OC)c4)[nH]n3)nc12 767606373 YPXFMJPFNQQFCP-UHFFFAOYSA-N 437.412 2.367 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3SCCS3)cc2F)C[C@@H](C)O1 768585332 ZDIULWOXKWHLDE-BETUJISGSA-N 428.551 2.405 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)cc1F 770273480 CRYGDSDFKLQFLL-UHFFFAOYSA-N 443.523 2.467 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(CC(=O)O)c2)cc1C 774614389 MGYFFWZLEKHLFT-UHFFFAOYSA-N 442.515 2.193 10 20 IECD COc1ccc([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N(C)C)cc1OC 774857532 GAAUBGUZGVTMPX-FQEVSTJZSA-N 442.560 2.147 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778301459 IQHJROZJTKDYBH-BIGNBACZSA-N 437.540 2.274 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)ccc21 778534588 HFQNCOSGZCUSIS-UHFFFAOYSA-N 438.528 2.275 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1 788310947 NNBCFSCBPABPSM-FQEVSTJZSA-N 440.519 2.064 10 20 IECD CCCN1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1=O 788555093 JSSPRUIKWTUQMZ-UHFFFAOYSA-N 437.543 2.339 10 20 IECD CCCCN(C)CC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789797697 CXXKCAUFZANWBJ-UHFFFAOYSA-N 448.583 2.249 10 20 IECD CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800122 LNABWIACFXWBGG-PXNSSMCTSA-N 435.540 2.236 10 20 IECD CC(C)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 789956535 WIVVITYIJAYNSW-GOSISDBHSA-N 443.466 2.042 10 20 IECD Cc1ccn(C[C@@](C)(O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(=O)c1 790896380 FXHLCELLOLOBAK-PGRDOPGGSA-N 433.936 2.048 10 20 IECD CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)(C)C 799091770 ZGLNAIZPFBILSN-OAHLLOKOSA-N 429.539 2.433 10 20 IECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C2CC2)O1 803449982 BFHPIRZQXRAIJO-LIRRHRJNSA-N 437.487 2.399 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(N2CCOC2=O)cc1 803583340 JQYCAEJLBHAQFX-CQSZACIVSA-N 428.464 2.342 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)Cc3ccc(F)cc3C)CC2)cc1 803750013 KEUROSZYBZIWCI-UHFFFAOYSA-N 442.535 2.040 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCOc3ccccc3OC)CC2)cc1 804316515 XZIIGNYEMFFEIJ-UHFFFAOYSA-N 441.528 2.374 10 20 IECD COc1ccc(N2CCC(NC(=O)NC[C@H](N3CCOCC3)C(F)(F)F)CC2)cc1 805847557 CEAKPEBULRJEIZ-SFHVURJKSA-N 430.471 2.226 10 20 IECD Cc1cc(N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)nc(C(C)C)n1 807099672 CBGIQRJJZIAYIP-UHFFFAOYSA-N 438.576 2.248 10 20 IECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386817 KTCBOMJZRPSQBF-VWLOTQADSA-N 425.304 2.288 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21 918307122 OJQUBAURBMLROA-FQEVSTJZSA-N 425.485 2.068 10 20 IECD CN(C)C(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 918457804 XNNBKBMIYQSVEY-UHFFFAOYSA-N 438.528 2.349 10 20 IECD Cc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1C(C)(C)C 919189639 FCRRPCROFMWRDV-UHFFFAOYSA-N 432.496 2.395 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)cc2)C1 919816657 CHKUAKWTGWJHBQ-DLBZAZTESA-N 426.483 2.279 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nc(Cc4ccccc4)no3)cc2)C1 921124102 RNLOTDCIZYHCLV-LJQANCHMSA-N 448.527 2.362 10 20 IECD COc1ccc(N2CCCN(C(=O)c3cc4c(c(S(N)(=O)=O)c3)CCC4)CC2)cc1 1318612727 WKIKVKASWHAODP-UHFFFAOYSA-N 429.542 2.184 10 20 IECD CN(C)S(=O)(=O)c1cccc(NC(=S)NCc2cc(OCC(F)F)ccn2)c1 1320698575 WGYGHTRBBWYCRN-UHFFFAOYSA-N 430.502 2.462 10 20 IECD CCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1782674627 ABERSGCPOUVEPX-DYESRHJHSA-N 440.924 2.305 10 20 IECD CC(C)/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792221284 LEQITGFSCFFFGL-FVAMDYMFSA-N 430.501 2.009 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(s1)CCC2 1795341660 SHRMDCVUADPRFI-BTTYYORXSA-N 449.623 2.349 10 20 IECD O=C(CCCn1ccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291696 VCVKYRIKKUIVQK-DTUWPTEXSA-N 440.500 2.132 10 20 IECD CC(C)[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811796767 KZSLEQGMQKDKRM-JVPBZIDWSA-N 447.919 2.483 10 20 IECD O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813522538 DQGPMQACESZJKD-VGOFRKELSA-N 436.468 2.433 10 20 IECD O=C1CC(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1814087586 AXFFAPSJNJOZHY-BFUOFWGJSA-N 443.887 2.445 10 20 IECD O=Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816722686 URGURAYDUJEHNB-SNVBAGLBSA-N 444.494 2.363 10 20 IECD CC[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1824086489 SIBCDYBJSYGWGX-IIMRFPQDSA-N 432.517 2.207 10 20 IECD CC[C@H](NC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1827043347 JXESYUUHQZWJOV-FQPQFXKESA-N 445.560 2.434 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3sccc3F)CC2)CC1)c1cc(O)nc(O)c1 1834985988 TYDDQLXRPLTOTK-UHFFFAOYSA-N 448.520 2.192 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(Cl)ccc3OC)CC2)cc1 56966103 IOCAUYXOLSKPQH-UHFFFAOYSA-N 439.965 2.458 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729067933 YBJNENWIULLKAV-CQSZACIVSA-N 449.529 2.247 10 20 IECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)c1 734014840 FSWVICQWOLPKMF-UHFFFAOYSA-N 446.525 2.321 10 20 IECD COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738882438 UHIFGJHUZNROLB-UHFFFAOYSA-N 434.474 2.160 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C3)nc12 740880063 SDIJOGJVEOXOKO-XJKSGUPXSA-N 433.509 2.347 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F 741082756 FVQCOPYCUUEWGD-UHFFFAOYSA-N 429.452 2.468 10 20 IECD CCOC(=O)CC1CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 743362818 IZBXEWCPWFEOMU-UHFFFAOYSA-N 432.565 2.192 10 20 IECD O=C(CN1CCN(C2CCOCC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 747846674 WYFUIIOYHRAUDJ-UHFFFAOYSA-N 433.508 2.197 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(N4CCCC4=O)c3)CC2)cc1F 754212617 NCESZGDADXAWFL-UHFFFAOYSA-N 440.475 2.248 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCc2nc(COC)nn2C1 757778608 WIODBXPBIXBGDT-CQSZACIVSA-N 438.326 2.439 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccn(Cc4ccccn4)n3)CC2)cc1 759031212 ISUBVAGTUJCOLC-UHFFFAOYSA-N 434.500 2.059 10 20 IECD COc1cc(N2CCN(Cc3csc(CS(C)(=O)=O)n3)CC2)cc(OC)c1OC 759887103 TYIAXHDCLGYWCL-UHFFFAOYSA-N 441.575 2.036 10 20 IECD CC[C@H](O)CCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 761573510 OPWWCGPBVUBPJK-HNNXBMFYSA-N 437.474 2.382 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]c2cccc([N+](=O)[O-])c12 762951192 AZNWPALRUVKYQN-UHFFFAOYSA-N 428.470 2.241 10 20 IECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 764255798 FXZLBAKIOFAGFH-MRXNPFEDSA-N 446.573 2.393 10 20 IECD COc1ccc(N2CCCN(C(=O)CCC(=O)Nc3ccc4nc(O)[nH]c4n3)CC2)cc1 765474595 UYAHHCBBSBWLEB-UHFFFAOYSA-N 438.488 2.130 10 20 IECD O=C(COC(=O)c1ccc2nnc(O)n2c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 767732050 NPNULEOGNWWDJI-UHFFFAOYSA-N 442.387 2.006 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC4(CCOCC4)CC3)cc2F)C[C@@H](C)O1 769229658 KLRREQWZZVWBRM-KDURUIRLSA-N 449.567 2.327 10 20 IECD CN1CC(=O)N(c2cccc(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)c2)C1=O 771918791 HFLLQNLUIRAXQD-UHFFFAOYSA-N 428.832 2.413 10 20 IECD COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773860137 ZGVFCEXRIGIKGD-ZDUSSCGKSA-N 429.473 2.372 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 775031492 ANLQSWGIOVAFAL-NRFANRHFSA-N 436.556 2.171 10 20 IECD O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)ccc1O 775289094 QMCQLKHLKUNUGN-UHFFFAOYSA-N 441.487 2.276 10 20 IECD CC[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Br)ccc1O 775523647 LDFVWWAFQQMOBG-WBVHZDCISA-N 426.355 2.129 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4CS3(=O)=O)cc2F)C[C@@H](C)O1 775683048 PXJPQVMIKLNEOM-HZPDHXFCSA-N 447.532 2.406 10 20 IECD Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 777930310 IYRWXKGXWICXDB-UHFFFAOYSA-N 443.478 2.078 10 20 IECD CCC(CC)(CC(=O)OC)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778303895 DTXHXLIJAUOPHC-VAWYXSNFSA-N 431.533 2.138 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 778326419 PEHGWFQCAODQTF-LEQVUBRHSA-N 445.560 2.383 10 20 IECD CCOC(=O)c1cc(F)cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407575 LSQIKCGJMQNBCF-UHFFFAOYSA-N 449.504 2.472 10 20 IECD Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785994796 OWKPABOAHQXISM-AWEZNQCLSA-N 425.485 2.232 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)Cc3ccc(C)cc3)CC2)cc1 786225789 CYKJWXPXRWBSFF-QFIPXVFZSA-N 440.588 2.419 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)cc1F 788297842 QWASFJLTFABQNF-UHFFFAOYSA-N 436.528 2.271 10 20 IECD CN(C)c1ccc(CNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)cc1 788546355 PORVOFDZSNXSFQ-HXUWFJFHSA-N 442.535 2.409 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2 789653123 XWMJEEIGEGKJSI-UHFFFAOYSA-N 430.373 2.379 10 20 IECD CC(C)(C)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 789843438 LFSHMHCFJXQTLX-UZLBHIALSA-N 435.540 2.113 10 20 IECD C[C@@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(N(C)C)C1 789844413 RYPMQFOSOFMAAJ-MZNJEOGPSA-N 448.583 2.030 10 20 IECD COC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[nH]1 796370694 ZTIMMRGMMXNASJ-UHFFFAOYSA-N 432.388 2.372 10 20 IECD C[C@H]1CN(Cc2cccc(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2)CCO1 803132137 WJTLDFVZSJGYNZ-RBUKOAKNSA-N 438.572 2.467 10 20 IECD COCCN(Cc1cccs1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803300027 OXFYLSPABBYBTE-QGZVFWFLSA-N 431.558 2.437 10 20 IECD Cc1ccccc1OCCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 804443736 IZJAIQZXQVSLTH-UHFFFAOYSA-N 425.529 2.375 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cc(C)ccc4C3)cc2F)CC1 805007372 JLGSFYGIJADDPE-UHFFFAOYSA-N 438.547 2.477 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1nc([C@H](C)OCC(C)C)no1 807099235 OIIGVZHAZIZXBT-INIZCTEOSA-N 431.537 2.452 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(N4CCNC4=O)c3)cc2)C1 918035930 OTPOKDGZOBFAEF-QGZVFWFLSA-N 436.516 2.240 10 20 IECD CC(=O)N1CCc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc21 920924740 DXNPWEWZEXNNEK-MRXNPFEDSA-N 436.512 2.248 10 20 IECD COc1cccc([C@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)c1 920980387 LWHHFNASRQMJOC-GQEMFKIVSA-N 430.574 2.205 10 20 IECD CC1=CC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1778110344 QUCKOKXYDSWVGG-WBJHJBSDSA-N 442.512 2.393 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC3CCC3)C[C@@H]21 1792217864 SKPVFOOELSKYNZ-AIONWGCTSA-N 444.528 2.377 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccccn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994122 RODSMMVMHJZTAG-SBUREZEXSA-N 447.495 2.235 10 20 IECD CC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811797959 XNWHCMSWQFTGTD-SKDZVZGDSA-N 433.892 2.237 10 20 IECD CN1CCCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424259 VMXDGDVZCAOZKG-MOPGFXCFSA-N 430.549 2.210 10 20 IECD O=C(CCCc1ccncc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441188 CMPPDOICZCAHMK-UHFFFAOYSA-N 445.523 2.401 10 20 IECD CCOc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1847182906 IJTXWYOXNGETDO-PMACEKPBSA-N 447.495 2.089 10 20 IECD C[C@@H](NC(=O)NCCOc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 730067440 UMPHAYCCHYASDF-QGZVFWFLSA-N 447.557 2.366 10 20 IECD NS(=O)(=O)c1cc(F)cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 731899998 ZOWBKEKYBSQVOV-UHFFFAOYSA-N 436.509 2.004 10 20 IECD O=C(COC(=O)Cn1ncn2nccc2c1=O)Nc1ccc(N=Nc2ccccc2)cc1 732865177 ZZSXRECQBZWQPD-UHFFFAOYSA-N 431.412 2.488 10 20 IECD Cc1nc(-c2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc2)n[nH]1 737159173 UPHHUAXYKHFNLK-HNNXBMFYSA-N 434.500 2.433 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-n4c(C)cnc4O)cc3)CC2)cc1 742916782 MSFBJOQNRKEMIA-UHFFFAOYSA-N 435.528 2.447 10 20 IECD CN(C)CCOc1ccccc1N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 746463820 VYAMBTRRXYTFQL-UHFFFAOYSA-N 439.604 2.131 10 20 IECD COc1ncc(C)cc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 746783757 QJIFWXYBWRJCMA-GASCZTMLSA-N 430.480 2.406 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC[C@H]3COc4ccccc4O3)cs2)cc1 751931892 VLNQSSFECGVNFY-INIZCTEOSA-N 439.493 2.429 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](Cn3cccn3)c3ccccc3)CC2)cc1 754068852 SITQCKBQCAEFHH-ZCYQVOJMSA-N 435.572 2.406 10 20 IECD CC(C)CCn1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 766360170 JSVDZRBFPCLUAI-UHFFFAOYSA-N 431.512 2.284 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(S(N)(=O)=O)s1 769292875 VJKAXJFZGKQPHF-UHFFFAOYSA-N 433.349 2.455 10 20 IECD O=C1c2ccccc2C(=O)N1C[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 769534812 YMIIFROLYZOHKA-GOSISDBHSA-N 439.487 2.159 10 20 IECD Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 770350533 NFMCWSCTMKVGHC-UWJYYQICSA-N 445.539 2.176 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773201324 VLKWAZFUOZANNE-INIZCTEOSA-N 434.562 2.238 10 20 IECD Cc1nc(Cn2nnc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2C)no1 782677083 QMGMAEYFCJOXFU-BETUJISGSA-N 443.483 2.009 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788912514 URWBIXBZZJZKBT-AZUAARDMSA-N 428.577 2.446 10 20 IECD COC1CCN(C2(CNC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CCCC2)CC1 788931825 HFIOIRILPOHMGL-UHFFFAOYSA-N 442.604 2.443 10 20 IECD CN(CCOc1ccc(Cl)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801521 UMYIFTZNQLWDHN-UHFFFAOYSA-N 449.910 2.469 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(OCC4CC4)CC3)cc2F)C[C@@H](C)O1 789819157 MDXOWKPKPGCYCU-CALCHBBNSA-N 447.551 2.473 10 20 IECD Cc1cccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789833655 IBYMXOCVRIMKAJ-JOCHJYFZSA-N 440.519 2.470 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NC[C@H]3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 793937000 AJAQJDDBHIEHIU-SJORKVTESA-N 433.549 2.304 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 795879554 DWLUZZOTCHUCJN-UHFFFAOYSA-N 436.505 2.451 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1F 803662513 CJXYTICRXXDZTA-GOSISDBHSA-N 440.519 2.177 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cc4c(cc3OC(F)F)OCO4)ccc21 803688077 UVNOGRDHWNTBPD-UHFFFAOYSA-N 447.438 2.332 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)C[C@H](C)c3ccccc3)CC2)cc1 803747145 MJDCGNINNPTJIC-FQEVSTJZSA-N 438.572 2.196 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(c4cnn(C)c4)C3)cc2)CC1 805025552 ULXKSUQQNWZXFJ-FQEVSTJZSA-N 438.576 2.058 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 807103946 YKFWJRTUTGEWOC-AEFFLSMTSA-N 432.565 2.439 10 20 IECD CCNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807953676 VXRFNIGETAFUAQ-OAHLLOKOSA-N 436.984 2.471 10 20 IECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@@H](C)C1 807953927 BOGAUTZAFIZPFA-CVEARBPZSA-N 434.968 2.272 10 20 IECD 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CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 806181570 YEDMGARGCKSUAP-SJLPKXTDSA-N 427.501 2.277 10 20 IECD C[C@@H](OC(=O)Cn1ccccc1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 916537343 KQYAAEJKMZBGSM-CQSZACIVSA-N 430.416 2.194 10 20 IECD NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CCCc2cc(OC(F)F)ccc21 919802962 MNPSHIHFGRXCIM-UHFFFAOYSA-N 437.468 2.277 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 920090341 LZCIXSIXTRCEDC-VQTJNVASSA-N 430.593 2.361 10 20 IECD CCOC(=O)C[C@@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 1255272838 MCBBSLHBFPIMPL-SFHVURJKSA-N 447.557 2.342 10 20 IECD COC1(CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1807998819 ONZASRGJYBSZNK-KKSFZXQISA-N 440.500 2.167 10 20 IECD O=C(c1c[nH]c2nccc-2c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543619 LGCASRXFNNUWEZ-UHFFFAOYSA-N 435.484 2.479 10 20 IECD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)COC1 1814559663 OJMDINBQGTUWRT-PMGBHYCQSA-N 442.472 2.269 10 20 IECD COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nc1 1827959951 IMZLELGVILLZIB-LJQANCHMSA-N 440.500 2.444 10 20 IECD CCO/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899290 BXJLLUVRSBSPHP-OQRGYWNNSA-N 439.603 2.017 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CCCSC3)CC2)CC1 1838032171 CJDIBGWGAIDGJE-HNNXBMFYSA-N 449.573 2.248 10 20 IECD O=C(c1cccc2c[nH]nc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441658 OPJMTWUJGCCTFQ-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CC(=O)Nc1cccc(OCCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 729227321 QWLNURVJSRDJHM-UHFFFAOYSA-N 430.480 2.499 10 20 IECD O=S(=O)(c1ccc(NC(=S)NNc2cc(F)c(F)cc2F)cc1)N1CCOCC1 734311155 KSPRQAWLQVUERA-UHFFFAOYSA-N 446.476 2.438 10 20 IECD CC(C)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 735190142 JGCAHQUSFMHODQ-UHFFFAOYSA-N 430.480 2.347 10 20 IECD COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 735196365 YWZVWWQQWFMCJQ-ILHIWHGASA-N 434.514 2.112 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccccc3Cn3cccn3)CC2)cc1 741347180 XLYMNWOXXRRGRW-UHFFFAOYSA-N 434.496 2.446 10 20 IECD Cc1cc(C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1-c1ccc(C(C)C)cc1 746006610 DDVLENBJHXNXJO-UHFFFAOYSA-N 432.590 2.264 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3ccc(CCS(C)(=O)=O)cc3)CC2)cc1 746658616 TVOFYQSNRQNCIX-UHFFFAOYSA-N 431.558 2.043 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(N4CCCC4)s3)CC2)cc1 758202239 HGEJVYKPVODVIK-QGZVFWFLSA-N 435.619 2.422 10 20 IECD COc1cc(N2CCN([C@@H]3CC(=O)N(c4ccc(F)cc4)C3=O)CC2)cc(OC)c1OC 758821471 SCHZEDOPAGTULG-GOSISDBHSA-N 443.475 2.306 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N3CCc4cccc(C)c43)CC2)cc(OC)c1OC 759408872 FCGJPJBXSDMVRA-UHFFFAOYSA-N 439.512 2.259 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3O[C@@H]3CCOC3)CC2)cc1F 760120056 IYGNDQBMNTXJIK-QGZVFWFLSA-N 443.475 2.289 10 20 IECD CN(C)S(=O)(=O)c1ccccc1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 760981837 XEWPODYUFRSRAF-UHFFFAOYSA-N 437.905 2.260 10 20 IECD COc1cc(Cl)cc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1O 761183868 FDANDBGEJCJRNJ-UHFFFAOYSA-N 441.893 2.469 10 20 IECD CCC[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCN1CCOC 766764560 OHRIFHDNOOSYIL-IBGZPJMESA-N 436.572 2.429 10 20 IECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 769710593 CFXXIISMUZZZEQ-SJLPKXTDSA-N 428.512 2.309 10 20 IECD CN(Cc1cn[nH]c1)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769858745 NWUJHNJUUIHNRW-UHFFFAOYSA-N 431.430 2.097 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)cc2F)C[C@@H](C)O1 770513453 ZBVVXIOLYYSBBR-HBUWYVDXSA-N 429.558 2.019 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1 771190267 KZCBBGOHTQRGRP-UHFFFAOYSA-N 448.527 2.158 10 20 IECD CCNS(=O)(=O)[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1 771465669 CFNURQBSMAOVQV-IBGZPJMESA-N 447.557 2.077 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)c2)CC1 771636811 KKSZASBVCGZLKZ-UHFFFAOYSA-N 432.546 2.037 10 20 IECD C[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)c(F)c1 773090894 HLGKNAZXDWBAOJ-GOEBONIOSA-N 428.551 2.209 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)Nc3cccc(C)c3C)CC2)cc1 779218102 AFECRZHQPZSXTR-QFIPXVFZSA-N 440.588 2.365 10 20 IECD C[C@@H](NS(=O)(=O)c1ccccc1Cn1cncn1)c1ccc(N2CCOCC2)cc1 781396627 PRJAHJULUOJFBV-QGZVFWFLSA-N 427.530 2.203 10 20 IECD COC(=O)c1cc(C)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781456566 FMMCNKWBNIGWGM-MRXNPFEDSA-N 425.485 2.434 10 20 IECD Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781961016 LVVSFPGXPMKMQF-UHFFFAOYSA-N 429.496 2.308 10 20 IECD CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 782698193 QKISOUWMRAGSRX-UHFFFAOYSA-N 425.434 2.306 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3CCN(CC4CC4)CC3)cc2F)C[C@@H](C)O1 788486798 YUZYOAKPNWKPTM-CALCHBBNSA-N 446.567 2.046 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCc4ccc(O)cc4C3)cc2F)C[C@@H](C)O1 789811787 IBLOOAKBNVPGJM-IYBDPMFKSA-N 441.503 2.346 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)C3CCN(C)CC3)cc2F)C[C@@H](C)O1 789829009 ZUZJCLVBBMGFJW-KZNAEPCWSA-N 448.583 2.244 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCN(Cc2cccs2)CC1 789862489 UBVJRKLSORPIRO-UHFFFAOYSA-N 444.626 2.262 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)c1 792340801 CMUAIGDDFSNRPS-ZDUSSCGKSA-N 425.441 2.260 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)ccc3-n3cccn3)nc12 796083265 COWCXPGJXPXFGO-UHFFFAOYSA-N 425.376 2.293 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(Br)c2)cc1 797432789 SMDVUGRLUWCECG-UHFFFAOYSA-N 434.337 2.434 10 20 IECD C[C@@H]1COCC[C@@H]1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977730 XSJORMYTWGLNBN-IEBWSBKVSA-N 442.539 2.414 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)n1ccc2ccccc2c1=O 806524836 HSPFHOOTSZXMKP-KRWDZBQOSA-N 439.537 2.114 10 20 IECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290803 AAYFWKVFUNAIEE-IEBWSBKVSA-N 442.560 2.441 10 20 IECD O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 808344212 QYENRWUGVDPPEV-IFMALSPDSA-N 441.528 2.008 10 20 IECD CN(C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1Cc2ccccc2C1 808852126 OAYHYJDNDLDOJL-UHFFFAOYSA-N 446.595 2.461 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1C 917758127 IZBQUAYVCAJWOO-UHFFFAOYSA-N 425.532 2.259 10 20 IECD Cc1nc(-c2ncccn2)sc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918337759 NMQZFBHDIUOHDG-UHFFFAOYSA-N 443.554 2.073 10 20 IECD CC(=O)c1c[nH]c(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 918910431 BMTFZJQKJOWMTD-OKILXGFUSA-N 431.464 2.443 10 20 IECD CSc1nnc(CCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1CC(C)C 919814864 FKHYKPCUFALPOU-UHFFFAOYSA-N 441.579 2.096 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)CC2)cc1 920650563 ZCAICQXHKNGBPZ-MRXNPFEDSA-N 443.466 2.161 10 20 IECD Cc1ccnc(Cn2c(=CC(=O)C3CC3)sc(=Cc3ccc(N4CCCC4)cc3)c2=O)n1 1253641535 ROTZZMTZURVNMU-UHFFFAOYSA-N 446.576 2.245 10 20 IECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 1317886217 CIMYHONRDGUWFX-OAHLLOKOSA-N 437.949 2.123 10 20 IECD COCCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1800715025 WNAJLMZRVVWEIV-QDMKHBRRSA-N 448.907 2.160 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc2c(s1)CCC2 1804331611 IMHKYQUBLJHWRB-BTTYYORXSA-N 449.623 2.349 10 20 IECD CCN(CC)C[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729162 RRXDKMZXJAPXJV-JSGCOSHPSA-N 447.561 2.153 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nonc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845801 WQXFSTMZEZAOBC-MRXNPFEDSA-N 449.427 2.372 10 20 IECD CCn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cc1C 1819907841 LCWAWHAKQTXTQV-MRXNPFEDSA-N 439.476 2.360 10 20 IECD O=C(Cc1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425867 BMFBIPBNUOYINY-KRWDZBQOSA-N 430.530 2.425 10 20 IECD CCC1(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)CCC1 1834987673 UHLSUFVQCZYSJI-UHFFFAOYSA-N 430.549 2.258 10 20 IECD O=C(CCc1ccc(F)nc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441438 XQFGELIEZILERC-UHFFFAOYSA-N 449.486 2.150 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@]2(CCc3ccccc3C2)C1=O 105121307 PHDIXCYSEBGJDP-VWLOTQADSA-N 434.540 2.392 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1C(=O)OC 472773827 OGSJSNSODALXRC-UHFFFAOYSA-N 437.452 2.315 10 20 IECD CCCC(=O)NC[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 726248668 QPGUSWGPMYYSBI-FQEVSTJZSA-N 445.608 2.155 10 20 IECD COc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1-n1nnnc1C 726701591 SSIBXBAKHGQNFP-UHFFFAOYSA-N 437.504 2.480 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(-n2cccn2)cc1 738890171 PHPVDJMEIIFEFT-UHFFFAOYSA-N 425.514 2.429 10 20 IECD COCCOCc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1F 741913559 OBFAGBGLUQSSEC-UHFFFAOYSA-N 436.505 2.476 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@@H]3CCC[C@@H]3O)CC2)c([N+](=O)[O-])c1Br 742254942 KNUPIEXLJHCSRX-MFKMUULPSA-N 445.270 2.310 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1=O 744878440 WKNBAMFIBZWBCO-HSZRJFAPSA-N 436.556 2.496 10 20 IECD Cn1cc(N2CC[C@@H](NC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2=O)cn1 745832285 XMUBTFHONPAKRY-RDTXWAMCSA-N 448.474 2.095 10 20 IECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 746132843 ANTUJZVWKOJCQD-INIZCTEOSA-N 434.472 2.119 10 20 IECD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCSCC2)cc1 748216838 KDNWQRNQHSVDEI-UHFFFAOYSA-N 443.529 2.264 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 751384189 AFPGPLLIBVBJCY-VQTJNVASSA-N 430.593 2.218 10 20 IECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)N(CC)Cc1cc(Br)ccc1O 751469547 YGMLZNJWQJSSOB-CQSZACIVSA-N 435.340 2.249 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC[C@@]2(CCOC2)C1 756925045 AMXMEDBGIPZLGJ-HSZRJFAPSA-N 440.523 2.264 10 20 IECD CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 761386627 WGCNCKAZLIYAML-JOCHJYFZSA-N 436.556 2.096 10 20 IECD COc1ccc(N2CCN(CCN[C@@H](C)CCN3C(=O)c4ccccc4C3=O)CC2)cc1 769493320 UPZLJGZVDQWGCE-IBGZPJMESA-N 436.556 2.482 10 20 IECD O=C(NCc1c(O)ccc2c1CCCC2)c1ccccc1S(=O)(=O)N1CCOCC1 769563944 OPAVYCCHOJQHLP-UHFFFAOYSA-N 430.526 2.222 10 20 IECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 779337113 XBVNYZABPFIKHZ-SJLPKXTDSA-N 447.580 2.491 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 784026699 YRNMSASUKSAIEN-UHFFFAOYSA-N 431.514 2.309 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1 785525871 YQBAYRAISWOPMN-HNNXBMFYSA-N 433.530 2.046 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@H]3CCC[C@H](C)C3)CC2)cc1 785527606 MDGWPAABMBGCCF-FPOVZHCZSA-N 430.593 2.361 10 20 IECD COc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(OC)c1 786666864 QDYCSSUTFMAYRA-LJQANCHMSA-N 428.485 2.233 10 20 IECD C[C@H]1CCCN(CCNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 787671671 PAGYDRSDEZCAKE-DLBZAZTESA-N 438.519 2.221 10 20 IECD C[C@H]1CCCC[C@@H]1OCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 787985260 AXVNZEYKUHKQDG-KKSFZXQISA-N 435.540 2.115 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccnc3OC(C)C)CC2)cc1 787991690 WQOMVSBPAOBYOJ-UHFFFAOYSA-N 426.517 2.233 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 788321461 WLZKPTPINOLUBD-OAQYLSRUSA-N 443.931 2.393 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N3CCCCC3)CCN(C)CC2)cc1 788928920 OCWWVFWVZLWNEF-UHFFFAOYSA-N 443.636 2.216 10 20 IECD Cc1ncsc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949183 GWWLEVOGSXCGAU-UHFFFAOYSA-N 442.463 2.240 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1coc(S(=O)(=O)NC)c1 791245685 DNVIGSJHHCILBD-UHFFFAOYSA-N 437.518 2.190 10 20 IECD CCOCCOC[C@H](O)CNCc1cc(Br)cc(Br)c1O 792196156 MJIZNNIOHXAIFP-GFCCVEGCSA-N 427.133 2.421 10 20 IECD CN(C)c1ccc(CNC(=O)CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 796385444 SCIILALKFXYITA-VWLOTQADSA-N 435.616 2.261 10 20 IECD COC(=O)c1ccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1OC 797672609 VAZLHYHZMUSQMH-UHFFFAOYSA-N 442.516 2.434 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 803134862 MXQXCMHWAFXUFJ-NRFANRHFSA-N 438.528 2.111 10 20 IECD O=C(N[C@@H]1CCOC1)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806513007 WYTRTKLLRRGBQY-CTNGQTDRSA-N 446.548 2.102 10 20 IECD CN(CC1CCOCC1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770943 PXTJSAMCRYZYQN-MRXNPFEDSA-N 425.476 2.258 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H]3CS[C@@H](Cc4ccccc4F)C(=O)N3)CC2)cc1 889063365 SFDHEYMIOOJKGM-SFTDATJTSA-N 443.544 2.326 10 20 IECD CS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 915269440 ZSXFRZDNIRGVIT-INIZCTEOSA-N 425.528 2.166 10 20 IECD Cc1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 915328423 GTTJFUSXOACNLS-LJQANCHMSA-N 447.561 2.052 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccccc3C(=O)N3CCN(C)CC3)CC2)cc1 915340563 RCXTZTVWVDIXQJ-UHFFFAOYSA-N 437.544 2.437 10 20 IECD Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917929318 CVFBGQGNPDLYBY-INIZCTEOSA-N 432.502 2.083 10 20 IECD C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 919971831 ZADOOBONZXQNTJ-AWEZNQCLSA-N 438.496 2.405 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 1321048273 GSXLTENCDBTJIS-PBHICJAKSA-N 446.887 2.395 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(O)cc3)C2)C1 1780744074 AQWAVEOYWGINMY-NRFANRHFSA-N 432.860 2.214 10 20 IECD CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)no1 1782007575 UPUOJGMUSIHXMQ-FQEVSTJZSA-N 435.864 2.059 10 20 IECD C/C(=C/C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1)C(=O)O 1792263596 VWFAWNCSVNFKAD-XFXZXTDPSA-N 447.538 2.012 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1S)C1=NN(c2ccccc2)C(=O)C1 1792577346 KVJDNGCPVSVPSU-ACHSLPGTSA-N 449.536 2.415 10 20 IECD CC(C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804081848 YRGVIEAXGVOVQY-MGPUTAFESA-N 428.489 2.023 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1[C@H]2C=CS[C@H]21 1804289821 WBWSPVIKKTYHNK-FJEYYCIESA-N 428.510 2.330 10 20 IECD CCc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)co1 1811009040 NTMXJHFFSPOUDV-XOBRGWDASA-N 437.456 2.072 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424419 WVZWROMERZZTFL-KRWDZBQOSA-N 447.532 2.458 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnoc1)CC2 1828198410 BWKVKFNXUAXYTL-QSLRECBCSA-N 442.453 2.187 10 20 IECD O=C(c1ncc[nH]1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877103 VAUWMKXLAILXJY-QQOXCAACSA-N 440.500 2.473 10 20 IECD CCC(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1842635232 DMBGCMPDFGVTKO-MRXNPFEDSA-N 447.532 2.147 10 20 IECD CCCn1c(CCC(=O)NCc2ccc(N(C)C)cc2)nc2cc(S(N)(=O)=O)ccc21 15832745 VVMALAADJMEKTM-UHFFFAOYSA-N 443.573 2.409 10 20 IECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CCN(CC(=O)N(C)C)CC3)c2C)cc1 28729655 DTEVJVAKYSKLJG-UHFFFAOYSA-N 426.561 2.381 10 20 IECD CN(CC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1)Cc1ccccc1O 731843589 RLBNTEXOTOOTSA-UHFFFAOYSA-N 443.978 2.072 10 20 IECD COC(=O)CN(CC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1cc(Cl)ccc1O 731844831 JYFMONGZQJZQEE-UHFFFAOYSA-N 440.905 2.063 10 20 IECD COc1ccc(N2CCN(C(=O)CNc3cccc(CS(C)(=O)=O)c3C)CC2)cc1 735077174 GJOIIIRTHIHCCS-UHFFFAOYSA-N 431.558 2.309 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)CNC(=O)c2ccncc2)NC(=O)OC(C)(C)C)cc1 743725549 UTPXWGMUICQCJG-LJQANCHMSA-N 441.532 2.260 10 20 IECD CCN(CC)CCO[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 746757117 DWIREQNVBWTPJF-FQEVSTJZSA-N 436.572 2.429 10 20 IECD CS(=O)(=O)CCOc1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 750709961 GPHJZUDMHQAZOP-UHFFFAOYSA-N 433.530 2.268 10 20 IECD CCOC(=O)Cc1nnc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 752352377 UGGNDTCCMNSRII-UHFFFAOYSA-N 437.497 2.066 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(C(=O)O)c2F)cc1OC 753774896 PSALYUHAYACUII-UHFFFAOYSA-N 446.478 2.403 10 20 IECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)C[C@H](C)O1 763279572 MLPQCCLCPVNGMA-PMPSAXMXSA-N 448.541 2.257 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(S(=O)(=O)NC)c2C)cc1 766344324 ZVOUFFZHUVXYAV-UHFFFAOYSA-N 446.573 2.346 10 20 IECD CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2)o1 768097482 DFBBQTFJBWIREI-UHFFFAOYSA-N 432.531 2.496 10 20 IECD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916482 RHMBRIGCDHZMBV-KZNAEPCWSA-N 433.936 2.301 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO 769042496 UZMVYGRNLJGEIG-UPVQGACJSA-N 438.572 2.205 10 20 IECD CCOc1ccc(CN2CCN(CCNS(=O)(=O)c3ccc(C)cc3)CC2)c(O)c1 769380446 WUBSFGKVESZMEW-UHFFFAOYSA-N 433.574 2.195 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H](c4nccn4C)C3)CC2)cc1 769770304 IQULZJCBIHJQTL-ZBTAVZRMSA-N 437.544 2.040 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1-c1ccccc1 772474593 LWQZQSGPQXVPFB-UHFFFAOYSA-N 437.475 2.411 10 20 IECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1 774751447 MSBDGTZUBQEILT-KRWDZBQOSA-N 449.598 2.229 10 20 IECD COc1ccc(O)c(CNC2CCN(S(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)c1 775855145 NRQVYHMGOBMXON-UHFFFAOYSA-N 433.530 2.302 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-c4nc[nH]n4)cc3)CC2)cc1 778270670 WGFVULONDCTUME-ZHACJKMWSA-N 432.484 2.324 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CCN(C)C)C3CCCC3)CC2)cc1 778274008 WRPZCZYTCPMOFW-OUKQBFOZSA-N 428.577 2.233 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC4(CCCCC4)C3)CC2)cc1 778293956 JOGIYOQWLPCOKG-MDZDMXLPSA-N 427.545 2.462 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1 785304830 RRSINAZWWCOBNQ-JKSUJKDBSA-N 427.501 2.177 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(N4CCOC4=O)ccc3F)cc2)CC1 786255968 OOBUZEWMLMCUBT-UHFFFAOYSA-N 440.475 2.381 10 20 IECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 789827389 SHCLSTVPSNHZCG-PZPFTHLGSA-N 435.540 2.375 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(Br)n1 792964761 CAGJGLRJESCFMP-UHFFFAOYSA-N 447.333 2.308 10 20 IECD C[C@H]1CCN(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 795250045 XTQKTAMBEAUUPZ-MAUKXSAKSA-N 426.583 2.495 10 20 IECD CC(=O)N[C@@](C)(C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(S(C)(=O)=O)cc1 797441458 HLJMGHUHHKZIJI-HSZRJFAPSA-N 443.569 2.140 10 20 IECD CC(=O)N[C@](C)(C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1 797495128 QULOMBTZTMEUHA-NYHFZMIOSA-N 431.558 2.385 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCC3CCN(C(=O)c4ccccc4)CC3)ccc21 803687095 UPCKDQNIZWFXBI-UHFFFAOYSA-N 448.567 2.354 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1ccc(OCC(F)(F)F)nc1 807098971 HJEFIXGKPCAYRA-UHFFFAOYSA-N 438.450 2.372 10 20 IECD Cc1ccn(-c2ccccc2CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 808722358 BBSQGQGBSURURH-UHFFFAOYSA-N 447.539 2.292 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)C[C@@H](C)COC3CCCC3)cc2)CC1 815036172 PFVFGYGCMWAXNZ-SFHVURJKSA-N 437.606 2.370 10 20 IECD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 815256814 BFZMTZIDRNVFNZ-HDICACEKSA-N 433.455 2.324 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(n2cnnc2O)CC1 816472442 DWADPUNMUKCQNV-UHFFFAOYSA-N 449.514 2.029 10 20 IECD Cc1noc(C)c1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 849206238 RKWYWGXAQKTDOH-UHFFFAOYSA-N 431.470 2.386 10 20 IECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC(=O)N1CCOCC1 913360660 NEAHUTHBMYTJSV-SDNWHVSQSA-N 440.568 2.132 10 20 IECD CCN(CC)c1ccc(CNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1 916502695 UOGKGHPTJIWILE-UHFFFAOYSA-N 431.558 2.484 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccccn4)no3)cc2)C1 917832663 DUWWLKUAVCJBTM-QGZVFWFLSA-N 434.500 2.082 10 20 IECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 918018035 JZCOKDZNVSYWSS-QGZVFWFLSA-N 441.488 2.305 10 20 IECD COc1cc(N2CCN(C(=O)NCCC(=O)N3CCC[C@H](C)C3)CC2)cc(OC)c1OC 1122091090 UYLDAZLPVLDZBE-KRWDZBQOSA-N 448.564 2.193 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817847559 KTTWHLLMHINHKA-CYBMUJFWSA-N 441.404 2.072 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 469076111 UOKWHGMZDJCWCK-UHFFFAOYSA-N 436.486 2.327 10 20 IECD COc1ccc(O)c(CNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c1 734015969 BRPIRYIPJGMSAA-UHFFFAOYSA-N 427.486 2.190 10 20 IECD CC(C)(C)c1cc(O)c(O)c(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)c1 738288083 CYOGCGLVUGYQLQ-UHFFFAOYSA-N 427.549 2.344 10 20 IECD COC(=O)N(C)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738915591 ZLHIRBLVUDYRCM-UHFFFAOYSA-N 446.529 2.446 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C(C)C)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 741019649 FWAGTJODMZUSQR-YYDVJCTNSA-N 447.576 2.021 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CCCN3Cc3ccccn3)CC2)cc1 741139426 RPXAQRWDVHLSCI-DEOSSOPVSA-N 437.588 2.383 10 20 IECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(Br)s2)cc1 749839244 YIWUJRRYNXIKIZ-UHFFFAOYSA-N 432.365 2.171 10 20 IECD O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 751229575 YSSAZQVUEYECDO-UHFFFAOYSA-N 427.429 2.313 10 20 IECD COc1cccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1 752574436 YSKRCUCONBEJEJ-UHFFFAOYSA-N 443.481 2.185 10 20 IECD COc1ccc(N2CCN(C(=O)c3cc(Cl)c(-n4cnnn4)cc3OC)CC2)cc1F 753739509 XLBWCLBKLQXUSD-UHFFFAOYSA-N 446.870 2.434 10 20 IECD NC(=O)CCOC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 759544027 XLEIBROIDNKYLT-YRNVUSSQSA-N 429.317 2.069 10 20 IECD O=S(=O)(NCc1ccco1)c1ccccc1NS(=O)(=O)c1cccc2nonc12 766507088 QCIHCVDSLPMHCQ-UHFFFAOYSA-N 434.455 2.095 10 20 IECD Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771052403 DERVCGAHJVZKNO-MRXNPFEDSA-N 437.949 2.396 10 20 IECD CS(=O)(=O)Nc1ccc(OCCNC(=O)NCCCSc2nccs2)cc1 774240596 LQHKULRTJABMQU-UHFFFAOYSA-N 430.577 2.375 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC(C)(C)N3CCCCC3)cc2F)C[C@H](C)O1 774889727 MQUAJQYWXNSVKS-ROUUACIJSA-N 448.583 2.436 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3cccc(N4CCOC4=O)c3)nc12 775264349 YTIVUSJHLYCQKA-ZDUSSCGKSA-N 425.445 2.419 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H](O)C1CCCCC1 783571802 HLVPSJXUPCJBCC-NRFANRHFSA-N 427.524 2.500 10 20 IECD COc1cccc(-c2nsc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)n2)c1 785297121 LSMVQDSSHDZLLS-NSHDSACASA-N 428.470 2.311 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCN3C(=O)c3ccco3)cc2)CC1 786655026 BSOGGFJYIVYVFK-NRFANRHFSA-N 438.528 2.259 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)CC1 787323883 FRWHVNMPSDBMOH-QHCPKHFHSA-N 435.572 2.279 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Oc1ccccc1F 789799107 IUESFTKJFXUMIL-KRWDZBQOSA-N 447.482 2.391 10 20 IECD CO[C@H](CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(F)(F)F 789823071 YMJRUOZXKILNNO-IIYDPXPESA-N 449.445 2.139 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nnc4n3CCCC4)cc2Cl)C1 793584850 UBDFMUNDVGBXEA-OAHLLOKOSA-N 444.967 2.437 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCc3cccc(C)c3)CC2)cc(OC)c1OC 793827019 MRAAVJZWYSSLOM-UHFFFAOYSA-N 441.528 2.028 10 20 IECD C[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OCO2 795925285 YTWLEMAGYQDRCS-OAHLLOKOSA-N 444.459 2.354 10 20 IECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1 800916054 BKQPTVOXYXANTM-CQSZACIVSA-N 442.559 2.471 10 20 IECD C[C@H](NC(=O)C(=O)NCc1cc(COC(C)(C)C)on1)c1ccc(N2CCOCC2)cc1 803300327 SAVYLKZHERKISH-INIZCTEOSA-N 444.532 2.320 10 20 IECD CCCCCNC(=O)C1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803688474 RRFOGYDSQUMPRN-UHFFFAOYSA-N 428.577 2.230 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCN(c4ccccc4F)C3=O)ccc21 803688787 BFHDRHYRRDRQEK-LJQANCHMSA-N 438.503 2.136 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(C(C)(C)O)cc1 806730633 XEBSNMQPFSFFGA-UHFFFAOYSA-N 425.529 2.025 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 807290139 QPYIIVNBMBFZKJ-NRFANRHFSA-N 446.551 2.348 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCCN(C(=O)c2ccsc2)CC1)c1ccc(N(C)C)cc1 807674933 SJSWZXWQAKBMST-MRXNPFEDSA-N 428.558 2.366 10 20 IECD CC(C)N(CCN(C)C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769553 HJDUIRXCJSMDGW-INIZCTEOSA-N 426.508 2.172 10 20 IECD CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1c(C)nn(C)c1C 807772982 YRDGUMVJUUGZMB-FQEVSTJZSA-N 427.549 2.099 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1 917279160 OIIWOTYHIRUXOM-UHFFFAOYSA-N 442.541 2.344 10 20 IECD COc1cccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1OC 918014148 LHYOAVBSWQUZKQ-LJQANCHMSA-N 440.544 2.447 10 20 IECD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 918140412 MVIAYYLYXCPUAF-GJZGRUSLSA-N 435.521 2.277 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 918287637 RAVPJZRCMFFPSG-HUUCEWRRSA-N 443.475 2.481 10 20 IECD Cc1cc(C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 920290334 IWYQOCCCRQIFOZ-MRXNPFEDSA-N 437.949 2.123 10 20 IECD Cc1cc(C(=O)CN(C)CCNS(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 1116329298 GINQTBXZPPTSLS-UHFFFAOYSA-N 429.489 2.359 10 20 IECD Cn1ccnc1C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 1319781105 HWTXDBRUHVEBLR-PMACEKPBSA-N 438.576 2.286 10 20 IECD Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc1C(F)(F)F 1796601353 WVEHKABXFDIRLR-CLLJXQQHSA-N 438.406 2.416 10 20 IECD Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1807989763 CMDBCPOSSHSOEH-IERDGZPVSA-N 433.468 2.225 10 20 IECD CN(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1844552686 ZVJNZPITAAIVCD-UHFFFAOYSA-N 430.892 2.343 10 20 IECD Cc1c(CNC(=O)C(=O)N(C)Cc2ccc(S(C)(=O)=O)cc2)n(C)c2ccccc12 571238018 UMHAXILOZLQQDO-UHFFFAOYSA-N 427.526 2.165 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Cc3cc(OC)c(OC)c(OC)c3)CC2)cc1 742917181 SHHMFJXUYPAMOT-UHFFFAOYSA-N 443.544 2.202 10 20 IECD CC(C)[C@@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743713163 WZMUTRGOYNXTOJ-IBGZPJMESA-N 437.474 2.238 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC1(O)CCOCC1 743761055 XSIDQUPYEQPGMX-KAMYIIQDSA-N 426.585 2.387 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnnn3-c3ccccc3Cl)nc12 744702692 VPAZQIXDSIKAPX-UHFFFAOYSA-N 442.819 2.203 10 20 IECD C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2N(C)C1=O 745985619 PFOAMAFXFLCPAD-KRWDZBQOSA-N 440.519 2.398 10 20 IECD CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NCc1ccccc1O 748487146 ZCEGXFDYJIQCOO-UHFFFAOYSA-N 449.529 2.076 10 20 IECD COCCN(CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC)c1ccc(OC)c(OC)c1 749352620 LIPATGSOQXCTJP-HXUWFJFHSA-N 442.512 2.283 10 20 IECD COC(=O)c1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751241273 ZGTLCHSRLDNDFG-UHFFFAOYSA-N 448.541 2.169 10 20 IECD COc1ccc(N2CCN(CC(=O)N(C)CC(=O)Nc3ccc(C)cc3)CC2)cc1F 753858554 WETZUQXABFBYSK-UHFFFAOYSA-N 428.508 2.362 10 20 IECD C[C@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)S(C)(=O)=O 754234622 CKQRJLFVCJQEFL-VSXLWIIGSA-N 432.614 2.279 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 756538701 YAAZXBOUXACPCK-UHFFFAOYSA-N 427.457 2.428 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnnn3Cc3cccs3)CC2)cc1 758200441 YUWBSIPBGGLEEI-KRWDZBQOSA-N 446.602 2.067 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 760886369 BKTJXBYQUMODHF-UHFFFAOYSA-N 434.500 2.249 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CS(=O)(=O)c4ccccc43)cc2F)CC1 763046469 IZDIRXGVYOZPCX-LJQANCHMSA-N 446.548 2.295 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCS(=O)(=O)C[C@H](C)C2)c([N+](=O)[O-])c1Br 763054032 NPMBCFCCQIOEIX-MRVPVSSYSA-N 438.256 2.145 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773857288 LTVJWBAOMRYPMR-HNNXBMFYSA-N 432.546 2.255 10 20 IECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)c1 775259153 FPQYAQCUKWNNOS-OAHLLOKOSA-N 439.495 2.236 10 20 IECD CCCN(C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@H]1CCS(=O)(=O)C1 776042908 VNESZMFDECJGOO-SFHVURJKSA-N 440.585 2.076 10 20 IECD O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)N(Cc1ccco1)Cc1ccccc1O 776072632 AIRYQNCDPDIJRV-LAUBAEHRSA-N 434.514 2.433 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785601996 PAWOBVHZQHYLKB-UHFFFAOYSA-N 434.422 2.055 10 20 IECD CC(=O)Nc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 786231472 TWEJWMIYFUHZED-FQEVSTJZSA-N 425.485 2.175 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C)nc12 786372412 SQEFYKCTCXNPSU-TZMCWYRMSA-N 448.476 2.300 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](OC)c3ccccc3)cc2F)CC1 786652910 CCUJNHJYMGZTNK-JOCHJYFZSA-N 442.535 2.088 10 20 IECD CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 786777747 XCCQMWBUZJRUQA-OAHLLOKOSA-N 432.502 2.312 10 20 IECD O=C(NCCS(=O)(=O)c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 788734117 JWADPQIQHPSRIO-UHFFFAOYSA-N 442.493 2.104 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)cc1 788941568 YVDONNNFMCOBKM-UHFFFAOYSA-N 440.519 2.273 10 20 IECD CC(C)CCOC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789798203 DCUZLMLMBOZDIF-UHFFFAOYSA-N 435.540 2.332 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3N(C)CCCC3(C)C)cc2F)C[C@@H](C)O1 789827103 RKASCJOYFLQRJH-CBGDNZLLSA-N 448.583 2.292 10 20 IECD COc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 803688284 XDOYIWTYSCQXPW-UHFFFAOYSA-N 438.572 2.284 10 20 IECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804852304 GITNRCUULIGELQ-SFHVURJKSA-N 434.556 2.443 10 20 IECD CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806327542 CCIKWZGRJXAHIG-SJORKVTESA-N 438.519 2.364 10 20 IECD CC[C@H]1CCC[C@H](NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 807166109 BQKDJYCJFOEAOS-IRXDYDNUSA-N 433.549 2.446 10 20 IECD COC[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 807769398 FOMDSCPYRHIXQV-JKSUJKDBSA-N 425.476 2.258 10 20 IECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1F 810356874 OKWHPRONIQRQPW-ZDUSSCGKSA-N 447.438 2.404 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H](CNC(=O)C(F)(F)F)C1 811864171 PQKOMLVAZOSRJR-OAHLLOKOSA-N 446.445 2.262 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC3CCC4(CC3)OCCO4)CC2)cc1 916196531 KJSXUJRKAIEENR-UHFFFAOYSA-N 432.565 2.192 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCN(C)CC3)c2C)c1 916644997 JRXBPIOLXKRLSY-UHFFFAOYSA-N 427.501 2.097 10 20 IECD CCOC(=O)C1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 916975593 SZXXKDQDPOFFFT-IAGOWNOFSA-N 435.540 2.331 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccccc3[N+](=O)[O-])cc2)C1 918118445 SHSJPKWOFZGIQS-KRWDZBQOSA-N 440.504 2.208 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](c3ccsc3)N(C)C)CC2)cc1 920254642 LYPCSYCCGWGJBI-MHNQQFQPSA-N 442.585 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(Cc4cccnc4)c3)CC2)cc1 1337365309 PCGMQVRWIZTUPT-CMDGGOBGSA-N 446.511 2.179 10 20 IECD Cc1cc(Cl)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c1 1791964686 KNBMMZGHFQYKLX-KKXDTOCCSA-N 445.903 2.362 10 20 IECD CC(C)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(C)C 1796170920 FXVXJLQPUVFYSW-JIKJNHBQSA-N 445.560 2.477 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cncc(F)c1 1805844580 FXQNZJVTPCPMQD-VLIAUNLRSA-N 437.431 2.055 10 20 IECD Cc1ncsc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991042 MXDQBOLSGVIPSX-RDTXWAMCSA-N 439.497 2.286 10 20 IECD Cc1nc(F)ccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546605 JTMXHACVVOTWNZ-UHFFFAOYSA-N 428.464 2.494 10 20 IECD CC(C)c1nc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)no1 1810546634 GRXISJUGJYRUIF-UHFFFAOYSA-N 443.504 2.087 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc(F)c1)CC2)c1cc(O)nc(O)c1 1816720401 QNNXJPYFZHHJIQ-NSHDSACASA-N 429.433 2.023 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nonc3c2)[nH]n1)c1cc(O)nc(O)c1 1817845800 WQXFSTMZEZAOBC-INIZCTEOSA-N 449.427 2.372 10 20 IECD O=C(c1ncc(Cl)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426846 KEMWKPKRSNTCNT-MRXNPFEDSA-N 445.907 2.483 10 20 IECD O=C(c1ncc[nH]1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715141 NBHYLWNAMAVAJL-HXUWFJFHSA-N 448.527 2.436 10 20 IECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)n(-c2ccccc2)n1 1843436984 FVMQJZZXCDZPMC-UHFFFAOYSA-N 433.468 2.118 10 20 IECD COc1cccc2c1C[C@H](C(=O)N1CCCC13CN(C(=O)c1cc(O)nc(O)c1)C3)CC2 1845925823 ZMWWVLWZKWRMPZ-MRXNPFEDSA-N 437.496 2.124 10 20 IECD CCOc1ccc(OCC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 39546863 MYKPTAKXOAJWCC-UHFFFAOYSA-N 428.485 2.365 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(=O)Oc4ccccc4)CC3)nc12 725811668 IBMDJXMBOAVCBZ-UHFFFAOYSA-N 439.472 2.318 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)c3ccc(NC(N)=O)cc3)CC2)cc1 729607606 RWSLRAMMFKAVRX-KRWDZBQOSA-N 440.548 2.368 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 733342300 JAYULIVCXVZSBP-GASCZTMLSA-N 429.558 2.452 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1 737184846 YITICHOZCLAHIY-LLVKDONJSA-N 431.401 2.286 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc2nc(O)nc(O)c12 740741160 QBNPLYORNNEANY-BETUJISGSA-N 441.463 2.427 10 20 IECD COC(=O)C[C@@H]1CSCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 746462427 DBESPXKSVKEQQA-OAHLLOKOSA-N 438.505 2.381 10 20 IECD CN1CCCc2cc(CNC(=O)C3CCN(S(=O)(=O)c4cccnc4)CC3)ccc21 746812707 JGGFVTXPVHNYNS-UHFFFAOYSA-N 428.558 2.181 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc(C(N)=O)cc3F)CC2)cc1 747551217 UOBGJFDESRPFDK-UHFFFAOYSA-N 429.496 2.267 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(S(N)(=O)=O)s2)cc1 751407495 WHCGDWPRIMDWRW-QGZVFWFLSA-N 437.587 2.212 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)Nc3nnc([C@@H]4CCCO4)o3)cs2)cc1 751931512 QTPDMCRUIFOXIH-AWEZNQCLSA-N 429.458 2.346 10 20 IECD Cc1cc(O)cc(=O)n1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 753100693 QIKJILSGLDQPSY-UHFFFAOYSA-N 425.407 2.034 10 20 IECD CCC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 762087127 QUDYWLZUOOZTLW-HNNXBMFYSA-N 428.455 2.352 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccnc3OCC(F)F)CC2)cc1 763488235 XAQJATFVKCPFFK-UHFFFAOYSA-N 449.502 2.356 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H](O)C(F)(F)F)CC3)cc2)C1 766880063 IVJXNPAYUMHSMH-WMZOPIPTSA-N 442.482 2.233 10 20 IECD O=S(=O)(c1ccc(F)c(Cl)c1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768443004 VPRBRIOIOJWDNT-SFHVURJKSA-N 442.896 2.117 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(C)(C)S(=O)(=O)CC3)cc2F)CC1 774844462 BTPYHQGWCNDLSW-UHFFFAOYSA-N 440.585 2.076 10 20 IECD CCCc1nc(C)c(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 777134611 OUVMWWBUSVOTMC-UHFFFAOYSA-N 445.589 2.290 10 20 IECD CC(C)(O)CN(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 779540813 SWCBYEGZUPHJKY-UHFFFAOYSA-N 442.539 2.387 10 20 IECD CC(C)C[C@@H]1C(=O)NCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 782856987 JDTZFXUSLWCQST-QGZVFWFLSA-N 435.436 2.357 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(-n2cnnn2)cc1 785192004 IVEDTHYERZPXBX-UHFFFAOYSA-N 445.277 2.118 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cc(F)ccc1N1CCN(C)CC1 785422123 IUCXQLSIZXSAQE-QGZVFWFLSA-N 441.551 2.137 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C(=O)c2ccco2)CC1 786120991 FLCMFWJGZRIGNG-UHFFFAOYSA-N 426.517 2.115 10 20 IECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 788402367 PZXXARZIDYXQDH-SFHVURJKSA-N 441.528 2.326 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccncc3)cc2F)C[C@@H](C)O1 789826232 PAGIVTYVCADGAJ-ZACQAIPSSA-N 428.508 2.198 10 20 IECD COc1cc(Br)cc(CN[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)c1O 796455449 XNSWDLSFXLMAMS-NSHDSACASA-N 435.262 2.075 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)OC3CCCCC3)cc2)C1 802012313 JWENUOGZHBSDPM-GOSISDBHSA-N 430.549 2.454 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2)cc1 802019140 ZBCRTVVQMYZNKB-DNVJHFABSA-N 437.588 2.232 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1 802610920 YNURDGWHMRADKH-UHFFFAOYSA-N 438.484 2.211 10 20 IECD COc1ccc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 803302086 GWKVVUYAVHPTGG-QGZVFWFLSA-N 441.528 2.376 10 20 IECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnc(NC(C)=O)s3)n2)o1 808527694 MCMVRBCSSHEZLN-UHFFFAOYSA-N 441.516 2.255 10 20 IECD C[C@@H](NC(=O)c1c(I)cnn1C)c1ccc(N2CCOCC2)cc1 814113324 HZXQWZNMFPURAV-GFCCVEGCSA-N 440.285 2.352 10 20 IECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 917371672 PEFYMTTYJUKMKA-RVDMUPIBSA-N 430.526 2.469 10 20 IECD O=C(CCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 917707727 YESKDGZKUGAMBZ-UHFFFAOYSA-N 425.460 2.355 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(N4CCCC4)nc3)cc2)C1 918006208 SOLJTXRUILOLJJ-FQEVSTJZSA-N 436.560 2.383 10 20 IECD CN(C)C(=O)c1ccccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918294047 CAIVYLCCBBBNSM-KRWDZBQOSA-N 425.485 2.240 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(CCc4cccs4)CC3)CC2)cc1 920087583 LISXARFVCRQJMH-UHFFFAOYSA-N 428.602 2.266 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccc(F)cc3)CC2)cc1 920254170 FZZGNKIGGPFDIT-KHPPLWFESA-N 427.476 2.234 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccc(N2CCOCC2)cc1 920925600 KLGPKCHWYAAGET-CYBMUJFWSA-N 430.892 2.091 10 20 IECD COc1cccc([C@@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)c1 920980389 LWHHFNASRQMJOC-TVNWYLLRSA-N 430.574 2.205 10 20 IECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NCc2ccc(N3CCCC3)cc2)C1 1325905190 WGIAUBHMRDQHPT-UHFFFAOYSA-N 429.542 2.221 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1sccc1F)C2)c1cc(O)nc(O)c1 1777848711 COBDWWXLCKULPC-JLTOFOAXSA-N 435.477 2.135 10 20 IECD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)cn1C 1787675352 NSQZJLGFKMDPKO-AXHNFQJDSA-N 447.919 2.305 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cncn2C)cc1 1794834543 CHJGRZNUTJKJQD-JHDGKUDLSA-N 447.539 2.345 10 20 IECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1CCCSC1 1802056425 IOHPBBILZGSTDF-MBMVNNNZSA-N 440.949 2.098 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ncc(F)cc3F)C2)CC1 1806338961 MEJFYDJPJQAACC-UHFFFAOYSA-N 432.427 2.325 10 20 IECD CC(C)N1CCC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550764 RSIVQGQJWOCGHH-SFHVURJKSA-N 430.549 2.210 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429049 ODPDQSKCWZNXLT-BEFAXECRSA-N 441.532 2.492 10 20 IECD O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429728 QOLLGLVFIUGZPO-MKXGPGLRSA-N 429.517 2.294 10 20 IECD CCCCN(C)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 23696751 YAPDKRLHDNBMFR-GZTJUZNOSA-N 435.571 2.465 10 20 IECD COc1cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)ccc1S(=O)(=O)N(C)C 542965287 SDUDATZIXPHGQM-UHFFFAOYSA-N 434.518 2.442 10 20 IECD C[C@H](OC(=O)CCCS(C)(=O)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 731257374 BZXNDZUONPAYTB-ZDUSSCGKSA-N 443.477 2.157 10 20 IECD CCOc1ccc(N(CC)CC(=O)NN2C(=O)N[C@](C)(c3cccc(OC)c3)C2=O)cc1 733794317 KHOULZIZVQLKPC-HSZRJFAPSA-N 440.500 2.419 10 20 IECD Cn1cc(S(=O)(=O)NCCN(Cc2cccs2)c2ccc3c(c2)OCCO3)cn1 744396901 VQLYLZFWNUXIGF-UHFFFAOYSA-N 434.543 2.238 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccnn1Cc1ccccn1 746365078 YSQTXGCIMLJHCF-UHFFFAOYSA-N 436.541 2.135 10 20 IECD CN(CC1CC1)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 746413664 HFCGMWJCVNXRCN-SFTDATJTSA-N 427.593 2.262 10 20 IECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N1CCN(c3ccc(OC)c(F)c3)CC1)C2=O 753738984 WLJPETWXERKKKB-UHFFFAOYSA-N 446.523 2.374 10 20 IECD CCn1cc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])n1 754804392 GHVDUTNALVNPES-AWEZNQCLSA-N 443.913 2.113 10 20 IECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cccc(Br)c2O)C1=O 757906093 ISXZINDLCIWAQF-UHFFFAOYSA-N 447.289 2.260 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(Cl)n3)cc2F)C[C@@H](C)O1 758626374 ZAGVJWSKZNZCIR-CHWSQXEVSA-N 436.871 2.356 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCC[C@@H](S(C)(=O)=O)C2)c([N+](=O)[O-])c1Br 763543728 NQKGLLFGWSSOQB-MRVPVSSYSA-N 438.256 2.288 10 20 IECD CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 765257630 ZJVCYCNABIHSLB-APWZRJJASA-N 430.574 2.147 10 20 IECD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 765596631 UXUCBQCWHAXGEO-FQEVSTJZSA-N 433.549 2.147 10 20 IECD NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769733405 VUDGCDHAKHQXRT-INIZCTEOSA-N 445.522 2.081 10 20 IECD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773995778 VVWARIIQYWEBOS-OAHLLOKOSA-N 432.546 2.209 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(O)nc(CC(C)C)c3)CC2)cc1 777143032 VQXVDCZHRXWYLL-UHFFFAOYSA-N 427.501 2.500 10 20 IECD CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NCc3ccccc3O)cc2C1 777246680 ZZLBAKWKRTZISL-MRXNPFEDSA-N 440.500 2.424 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN3CCCc4ccccc43)CC2)cc1 778232558 JVQFFBPIIXDIKF-OUKQBFOZSA-N 448.567 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@H]3CCCc4c3cnn4C)CC2)cc1 778393141 YWKDRZNGWXDRBH-VIOKTNGOSA-N 437.544 2.170 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781047029 NHZGEKPDKKTNIV-UHFFFAOYSA-N 445.541 2.028 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)C3CN(C(=O)OC(C)(C)C)C3)nc12 786976894 MSFSNRHQRKULCX-GFCCVEGCSA-N 448.476 2.158 10 20 IECD CC(C)Oc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 787984486 UXAHNTDIDURTJG-IBGZPJMESA-N 427.501 2.398 10 20 IECD COC(=O)c1cncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 788595588 LXDKEAGYTFIWLO-OKILXGFUSA-N 437.493 2.099 10 20 IECD O=C(COC(=O)c1c[nH]nc1-c1ccoc1)NCc1ccc(N2CCOCC2)c(F)c1 789077520 OTUDGLMUZOMDKX-UHFFFAOYSA-N 428.420 2.119 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCO[C@@H](c2ccccc2)C1 789801208 ZPMDKXSXJVTMQL-JOCHJYFZSA-N 441.503 2.269 10 20 IECD CCCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789824248 HMAHDLHACAAJCR-GGPKGHCWSA-N 448.583 2.246 10 20 IECD CC[C@@H](C)N(C)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949835 KXXZXNMUFNAWBF-OAHLLOKOSA-N 444.498 2.005 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1 791037672 UIXGRJIQJZYXKQ-UHFFFAOYSA-N 427.486 2.145 10 20 IECD COc1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1S(=O)(=O)NC1CC1 796429943 QGPBDOVQOHECNP-UHFFFAOYSA-N 430.574 2.500 10 20 IECD CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(OC)c1 799523194 CHXUTDUURHBWGG-UHFFFAOYSA-N 442.515 2.434 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCOc3ccc(F)cc3)CC2)cc1 803709789 KSNUDNRIBLFGGR-UHFFFAOYSA-N 429.492 2.458 10 20 IECD CC1(C)C[C@@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806806468 NGVPFHZIBWVQPK-LSDHHAIUSA-N 425.476 2.447 10 20 IECD COc1ccc(CN2CC[C@@H](NCc3ccc(N4CCN(C)CC4)cc3)C2=O)c(OC)c1 808423482 DCDFFSHLUOCKQA-HSZRJFAPSA-N 438.572 2.346 10 20 IECD CCOC(=O)NCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915027707 FZXPRCDOQOECFG-CYBMUJFWSA-N 438.436 2.468 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918310527 LFDVMTABHLLFBD-UHFFFAOYSA-N 438.528 2.131 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(Cc2ccc(F)cc2)c1C 1255920540 YSPBMNGWQOAIQA-KRWDZBQOSA-N 442.447 2.089 10 20 IECD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1 1785510289 TVICZWMWAUFASK-UMESLIDUSA-N 438.480 2.269 10 20 IECD CC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425460 RDGCMVKSAIRNNY-QGZVFWFLSA-N 426.473 2.155 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(-c2cc[nH]n2)cc1 1796604188 MXBINNNOEDPIIQ-BCDXTJNWSA-N 433.468 2.449 10 20 IECD O=C(/C=C/C1CCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1799314215 SDLFTMQFFYFZDU-XWYOSOOVSA-N 442.512 2.153 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnn2ccncc12 1800718298 UXCHPBBGAZMCLG-BTTYYORXSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)c3ncccc3F)sc2C1)c1cc(O)nc(O)c1 1820920912 RSLBINLLTFFHCQ-SNVBAGLBSA-N 429.433 2.023 10 20 IECD O=C(c1cccc2[nH]ncc12)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441512 FCBFGVBIQODEMN-UHFFFAOYSA-N 442.479 2.173 10 20 IECD CCNC(=O)COc1ccc(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1OC 728945790 JOVVBGLXMMQATN-CQSZACIVSA-N 431.489 2.485 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(O)nc4ccc([N+](=O)[O-])cc34)cc2)C1 732275431 WZLCYFSSYNILLQ-OAHLLOKOSA-N 449.467 2.480 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1 734648491 XCTDBBJJBCVMQH-UHFFFAOYSA-N 445.589 2.319 10 20 IECD CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 745649217 SBRMCRMPNANBQK-HXUWFJFHSA-N 435.588 2.220 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)cc2F)CC1 746229199 MFZOAEYDGFMEBT-VWLOTQADSA-N 440.563 2.221 10 20 IECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCNS(=O)(=O)CCCOC 747804540 LTLVEXBMTYOTNE-UHFFFAOYSA-N 441.575 2.389 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3csc([C@H](C)OC)n3)CC2)cc1 747850474 DAEFZJHWTPOYQI-WNNBVUDTSA-N 437.587 2.457 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCC(O)CC1 749563996 NJWJADSAKIPDKO-UHFFFAOYSA-N 438.572 2.479 10 20 IECD COCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 749733111 PRLHARVNELMYTH-UHFFFAOYSA-N 446.569 2.245 10 20 IECD COc1ccc(N2CCN(C(=O)c3c4c(cc([N+](=O)[O-])c3[N+](=O)[O-])OCCO4)CC2)cc1 751210536 GHAMIIUJKPRDLI-UHFFFAOYSA-N 444.400 2.245 10 20 IECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1F 759513515 QFVNJZWDXXEFGE-UHFFFAOYSA-N 431.536 2.064 10 20 IECD Cc1cc(C(=O)COC(=O)[C@H]2CCC(=O)[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761463856 YMLQPXKWGVIGNF-CJNGLKHVSA-N 446.525 2.473 10 20 IECD CON(C)C(=O)[C@H](CCSC)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 767163903 MEVSCCXCAKWORT-SJORKVTESA-N 425.551 2.224 10 20 IECD COc1ccc(O)c(CNC(=O)CCC(=O)N2CCc3cc(OC)c(OC)cc3C2)c1 768052838 AIYRKUNAXHIPDS-UHFFFAOYSA-N 428.485 2.399 10 20 IECD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773747674 DCOUMXQVUXNZDE-DGCLKSJQSA-N 437.474 2.198 10 20 IECD COc1ccc(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3O)CC2)cc1[N+](=O)[O-] 775641741 BPTFMVZFYOYYGB-UHFFFAOYSA-N 441.893 2.469 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@H](O)c3ccc(F)cc3)CC2)cc1 778389292 GCRRBYCNSDFWEI-MXLITWEKSA-N 441.503 2.277 10 20 IECD CCOC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 781449463 LEMITPBJYNRIEV-UHFFFAOYSA-N 439.512 2.327 10 20 IECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2ccc(-n3nccn3)nc2)cc1 782429170 KZTKVLIZLWUZAQ-UHFFFAOYSA-N 445.483 2.489 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)C2)cc1 783111937 MADZWYVEHXXGTD-MRXNPFEDSA-N 433.482 2.233 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CC[C@@H](C)C[C@@H]3C)CC2)cc1 785527018 IMQIKNVXBJSVTE-XQBPLPMBSA-N 430.593 2.264 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cnn(-c2ccccc2)c1 785968297 WRNTYESLXXNAIX-UHFFFAOYSA-N 435.553 2.358 10 20 IECD Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 789369670 ACCNWOBPXYFVQM-VQIMIIECSA-N 428.489 2.124 10 20 IECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789816314 CVLSROCPOMWWNG-IAGOWNOFSA-N 435.540 2.379 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3Cc3ccccc3)cc2)C1 793716744 FDUWYXYAGASCPS-GGAORHGYSA-N 448.567 2.238 10 20 IECD CCCC[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734114 PYSVKUZYANLALE-DYXWJJEUSA-N 428.577 2.480 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)CN3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 793907165 AHNYAZUNFRCCJR-HSALFYBXSA-N 430.593 2.217 10 20 IECD CC(=O)N[C@](C)(C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 797707011 IDJWPNBSPZIPOP-QHCPKHFHSA-N 443.569 2.358 10 20 IECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1 802755736 HXEVRQZUPLAWGJ-UHFFFAOYSA-N 425.513 2.418 10 20 IECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O2 803301892 BJTTWMBDAIGRNL-KLPGYIQLSA-N 445.560 2.138 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccccn3)CC2)cc1F 804852063 YDEVPYIXTSTNAP-UHFFFAOYSA-N 427.524 2.028 10 20 IECD Cc1cnccc1CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806584944 ATNPFBDTAUBWLK-QGZVFWFLSA-N 432.471 2.435 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807675070 UHNWINAUIMIGCS-XMSQKQJNSA-N 436.556 2.280 10 20 IECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(CCNC(C)=O)cc3)CC2)cc1 1253811690 KEUKUNNHWMMODV-UHFFFAOYSA-N 431.558 2.275 10 20 IECD Cc1nc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782006988 DYGDYJZMJCQWQQ-FQEVSTJZSA-N 435.864 2.113 10 20 IECD C[C@@]1(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC=CCC1 1784760960 WQCKQHQLABQWRC-CYEIDUMTSA-N 442.512 2.393 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1OCC1CC1)c1cc(O)nc(O)c1 1794773758 GSYJVPUPICWDDX-BJWYYQGGSA-N 438.484 2.242 10 20 IECD O=C(/C=C/c1ccoc1)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1806825225 GTHZIVHADVARQK-NSCUHMNNSA-N 447.582 2.384 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806015 HAZULPNLNMMHBQ-AMVTXUCVSA-N 445.903 2.237 10 20 IECD CCc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1816049796 NCRPJWSRJSMQPY-CYBMUJFWSA-N 439.497 2.446 10 20 IECD O=C(CC(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817105885 QPITZPBSBMFKEJ-JTQLQIEISA-N 449.480 2.215 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3)CC2)CC1 1838032369 PKHHKSMIJOMHDQ-KRWDZBQOSA-N 435.546 2.001 10 20 IECD O=C(c1cccc(-c2cnccn2)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250292 HUFRDSYEHYYOPI-UHFFFAOYSA-N 431.452 2.081 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)n2cnnn2)C3)cc1 1845399396 WHWMLEXSRJRBFU-GOSISDBHSA-N 433.516 2.159 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCCc2cccnc2)C1 1846674014 OLGMINXFOCLOGO-CSKARUKUSA-N 437.496 2.438 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1 195562759 FSWHAANMMWTXTA-UHFFFAOYSA-N 425.581 2.334 10 20 IECD CCN(Cc1ccccc1)c1ccc(CNCCN2CCN(S(C)(=O)=O)CC2)cc1 729681008 NDLDCHBZTVSYJI-UHFFFAOYSA-N 430.618 2.380 10 20 IECD O=C(NCCn1c(=O)oc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 730119791 QDBAIQAMEMDVRP-UHFFFAOYSA-N 428.464 2.194 10 20 IECD CCn1nc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc1=O 732370611 PKIKRZCWEJHXMR-CYBMUJFWSA-N 445.431 2.223 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 734073653 TZCWYLPCXWOSQB-OKILXGFUSA-N 431.464 2.408 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 741097320 ODRWLTKHKVGVHD-UHFFFAOYSA-N 432.480 2.361 10 20 IECD CCS(=O)(=O)NCc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 741698257 YTYJRSBIRCKQMG-UHFFFAOYSA-N 444.557 2.080 10 20 IECD CC(=O)N(C)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751238341 ZPIAXHNYWLSQCL-UHFFFAOYSA-N 431.558 2.357 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4cc(N(C)C)ccc43)CC2)cc1 754080698 HEQMKEXQXQRRBC-NRFANRHFSA-N 426.561 2.143 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cncc(Cl)n1 760813638 XATNACOUWJKCHG-UHFFFAOYSA-N 427.871 2.316 10 20 IECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1cccc(Br)c1O 765751199 RZDIVJBIWNTUKL-OAHLLOKOSA-N 431.294 2.059 10 20 IECD COc1cc(N2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c([N+](=O)[O-])cc1OC 766922382 AFLXIRSMRXEGOX-UHFFFAOYSA-N 431.474 2.004 10 20 IECD COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 767383750 RSPSKQYNBAQONQ-UHFFFAOYSA-N 432.546 2.125 10 20 IECD CC(C)C[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 768513047 VJGYYFXTVMJHEF-VBURHUQHSA-N 448.539 2.412 10 20 IECD COC1(CO)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 770236874 NXFZKJRLTKMFFZ-UHFFFAOYSA-N 431.455 2.225 10 20 IECD CN(CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1CCSC1 772059402 HXJYJYRLBSZYNL-OAHLLOKOSA-N 438.505 2.381 10 20 IECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@]1(CCO)CCOC1 773057249 COKKLYGBTGTIAH-DEQJRXDXSA-N 426.585 2.387 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]3C)nc12 776607776 WUKLETIWXCLICQ-UONOGXRCSA-N 433.509 2.441 10 20 IECD CC[C@@H]1C(=O)N(CC)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 778236852 XXDJITYEXWHART-QGZVFWFLSA-N 435.436 2.453 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1 779648821 PPTJVQOWNUHPCB-DLBZAZTESA-N 434.290 2.474 10 20 IECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 782041088 GFEBZEZQBIMUPZ-CYBMUJFWSA-N 437.474 2.070 10 20 IECD O=C1Cc2cc(NC(=O)C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc2N1 784767515 OSXBCVCUOFMKGG-QGZVFWFLSA-N 442.903 2.260 10 20 IECD CSCC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nnc2ccccn12 785605045 IBZTVCMNGBBHAK-SFHVURJKSA-N 440.573 2.331 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 787199739 RFFQXMCUNMIODF-QGZVFWFLSA-N 426.517 2.067 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N(C[C@H]1CCCO1)C1CCCC1 789800915 RTKSLKLAOGUTSM-LJQANCHMSA-N 433.524 2.229 10 20 IECD CN(CCOc1ccccc1F)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843401 KQUFEEKNZOPKBH-UHFFFAOYSA-N 447.482 2.080 10 20 IECD CN(C)c1ccc(CN(C(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)C2CC2)cc1 795055186 FTVKXIIBZJVTEM-UHFFFAOYSA-N 427.530 2.098 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 799672546 COGFFQLLNYDOOG-UHFFFAOYSA-N 426.489 2.151 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(N2CCOCC2)cc1 803303247 JGYTZEVYHZYBKG-IEBWSBKVSA-N 447.601 2.261 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)CC1 803934511 CQGXTYNJIWQDGX-UHFFFAOYSA-N 447.557 2.305 10 20 IECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1O 809714383 GTIAVUOGVIDAJU-MRXNPFEDSA-N 436.509 2.436 10 20 IECD Cc1ccccc1[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(N)=O 917834840 RHQBSSCAXLINOQ-NQIIRXRSSA-N 437.544 2.113 10 20 IECD CC1(C)Cc2cccc(S(=O)(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)c2O1 1321366321 JMRAZERMEDELMP-UHFFFAOYSA-N 436.555 2.436 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)CN(C4CCCC4)C3=O)cc2F)C[C@@H](C)O1 1333638699 IPVCOFBTIYZLIC-IYBDPMFKSA-N 446.523 2.262 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccns1 1785815741 GXWQIHIKMBSWTJ-WBIUFABUSA-N 437.905 2.115 10 20 IECD CC[C@H](C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786405766 CXDLSTWFWHGWAC-UGSOOPFHSA-N 449.598 2.388 10 20 IECD CC(C)(C)CC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1806311339 FMUHGFBXRZMTDR-DNVCBOLYSA-N 448.614 2.384 10 20 IECD Cc1noc(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815707434 BSTSELNRBSEERN-MRXNPFEDSA-N 440.460 2.369 10 20 IECD Cc1onc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1C 1817843658 VKROYJGNSQRJGO-CQSZACIVSA-N 426.433 2.440 10 20 IECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2)CC1 1825826323 ASEQIGNSRYIQFT-QGZVFWFLSA-N 446.598 2.175 10 20 IECD CC(C)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839850435 IMIQWHFJXMFUGR-NRFANRHFSA-N 440.924 2.257 10 20 IECD Cc1nc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1C 116495888 CJUPCHSOFJDEFX-UHFFFAOYSA-N 433.578 2.046 10 20 IECD NC(=O)c1cccc(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 727713171 XHXLSBOUKAPCIQ-UHFFFAOYSA-N 443.415 2.442 10 20 IECD COc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)c1 732450928 SJJKFKRBFYVCGZ-UHFFFAOYSA-N 447.507 2.384 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)c3ccccc3OC)CC2)cc1 734938456 LAQWYRSQPQJWKN-QFIPXVFZSA-N 442.560 2.249 10 20 IECD COCCOC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 735078073 VZUNHNHHQZWVJE-ROUUACIJSA-N 437.556 2.183 10 20 IECD O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)cc1 740742553 PTFCLMWTUOFWIS-PMERELPUSA-N 430.526 2.109 10 20 IECD Cc1c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1-c1ccccn1 742278573 OMQGZEFXVIBOSX-UHFFFAOYSA-N 431.493 2.030 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1F 753839156 JKONMJKZYFFCSY-UHFFFAOYSA-N 441.463 2.240 10 20 IECD COc1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1[N+](=O)[O-] 759147402 MOCWXWPGRFIBCK-UHFFFAOYSA-N 434.474 2.106 10 20 IECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 761290121 MLTIZPOJMPLBON-LBPRGKRZSA-N 444.531 2.211 10 20 IECD CNC(=O)COc1cccc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 772057050 IYUSCWIHVSTYIY-IAGOWNOFSA-N 443.519 2.423 10 20 IECD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(N(C)C)cc1 773846399 LIYBOOWZUUVEIY-INIZCTEOSA-N 437.544 2.270 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3c(C)cc(C)nc3OC)CC2)cc1 778253328 HEVWJDQXVHVUMS-MDZDMXLPSA-N 438.528 2.237 10 20 IECD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 785558821 JDHSQJULEITPPN-OAQYLSRUSA-N 442.535 2.006 10 20 IECD CSCC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 785600800 JNKWTKTXVWPDFI-INIZCTEOSA-N 444.536 2.161 10 20 IECD CCCN1CCC(N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789819503 NTUVOTHRDZTTRD-ROUUACIJSA-N 448.583 2.388 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@]4(CCCOC4)C3)cc2F)C[C@@H](C)O1 789823091 YUFGSIGRODMLOO-NXMSCROESA-N 447.551 2.475 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCOC[C@@H]1c1ccccc1 789837257 XRDNKIRVWBFWQM-JOCHJYFZSA-N 441.503 2.003 10 20 IECD C[C@@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(N(C)C)C1 789844414 RYPMQFOSOFMAAJ-OSPHWJPCSA-N 448.583 2.030 10 20 IECD C[C@H](COc1ccc(F)cc1F)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793798791 LUUGLKMWEAXADL-MRXNPFEDSA-N 447.482 2.344 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCc3ccccc3[N+](=O)[O-])CC2)cc1 796115296 OWRVVJPMDGSPKV-OAQYLSRUSA-N 428.533 2.261 10 20 IECD CC[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)[S@@]1=O 796365872 IXCFOZRYVAGKNB-LTHBHIFASA-N 439.597 2.287 10 20 IECD CCn1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C(F)(F)F 799251226 BOCNXBKDBKRETO-UHFFFAOYSA-N 443.401 2.152 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(CC(C)C)CC(C)(C)C)CC2)cc1 803750892 PKOVOPMQKPANHG-UHFFFAOYSA-N 432.609 2.464 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2C[C@H](O)c2cnn(C)c2)cc1F 804851432 BXDCQDFGYFFDTK-RXVVDRJESA-N 445.539 2.136 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)c3ncc(C)s3)cc2F)CC1 805007967 WJDBNWVFHWWIBZ-OAHLLOKOSA-N 447.580 2.269 10 20 IECD O=C(NCCCSc1nccs1)C(=O)NCc1cc(F)ccc1N1CCOCC1 806281133 OJAFEDZQOPWXKR-UHFFFAOYSA-N 438.550 2.034 10 20 IECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 806907244 ZTGOVCZJMWXTTA-UHFFFAOYSA-N 449.960 2.392 10 20 IECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C2CC2)O1 807771903 YTYWRHRICDZWRD-OGWOLHLISA-N 437.487 2.399 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)cc2)CC1 808338343 HMCFBPXPHIWFEN-DHIUTWEWSA-N 442.604 2.033 10 20 IECD CCOC(=O)[C@@H](CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(C)=O 816889662 HKCWLGABEBWXQU-INIZCTEOSA-N 430.423 2.317 10 20 IECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CN3CCCN(C)CC3)c2C)c1 916645145 SNGMZKGMYMNDDY-UHFFFAOYSA-N 441.528 2.488 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(CC(F)(F)F)CC3)cc2F)C[C@H](C)O1 916974677 IPSREJQHWQJCBY-HOTGVXAUSA-N 446.489 2.235 10 20 IECD CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccs1 917832519 CJVIVBKCBBIMGJ-HKUYNNGSSA-N 428.558 2.334 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H]3CCN(c4cnn(C)c4)C3)cc2F)C[C@@H](C)O1 1318570653 LZQSEUVESDRQHM-NUJGCVRESA-N 430.528 2.251 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1csc(-c2ccccn2)n1 1320274927 UGXCZHJTMSLPIN-INIZCTEOSA-N 427.482 2.449 10 20 IECD CN1CCN(c2ccc(CN3CCN(S(C)(=O)=O)c4ccccc4C3)cc2F)CC1 1341603919 DCASWHYFWHFKPC-UHFFFAOYSA-N 432.565 2.359 10 20 IECD CC(C)(C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786101942 AIQSEXSOEBWJLE-QGZVFWFLSA-N 449.598 2.388 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242227 WUOUKTNLGOMMBS-YEWDVWPNSA-N 431.876 2.053 10 20 IECD CNc1nsnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1792565503 IDJFJZAKCMMEAX-JGPRNRPPSA-N 437.909 2.210 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc([N+](=O)[O-])ccc1F)c1cc(O)nc(O)c1 1794061081 XFYSZYRKGKKXDD-QDMKHBRRSA-N 444.419 2.035 10 20 IECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)no1 1798904818 RTGQIHMIRNNTAB-ACHSLPGTSA-N 435.484 2.282 10 20 IECD CC(=O)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1800715906 XBDNTYQBGJBRSE-CLLJXQQHSA-N 432.864 2.243 10 20 IECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1804329949 AUGUDWDZZWJWGJ-MXASKKJJSA-N 431.583 2.289 10 20 IECD CC(=O)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294826 SKEAZVCSHJEQSQ-HNNXBMFYSA-N 449.895 2.306 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccc2nccn12 1821482166 WTVQBRFOEMAMLG-OAHLLOKOSA-N 447.455 2.483 10 20 IECD NC[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1 1842972161 RFCWGSVUTHSKEL-MRXNPFEDSA-N 429.904 2.311 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2noc3c2CCCC3)C1 1843259300 AIGIBLCWFZALGC-VQHVLOKHSA-N 439.468 2.201 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3 18553314 WNSUDBCZAQUALY-UHFFFAOYSA-N 434.496 2.224 10 20 IECD COc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1OCC(N)=O 108458379 CZZBKWWWGPTWHX-GASCZTMLSA-N 445.491 2.242 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CN3C(=O)COc4ccccc43)cc2F)CC1 730194742 OTFHISYBWMSVIH-UHFFFAOYSA-N 426.492 2.009 10 20 IECD O=C(Nc1ccccc1N1CCOC1=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 737111238 UMGVNNMOWRQERP-QGZVFWFLSA-N 439.468 2.495 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)c1O 737285418 BXILSKRDEKHNQL-UHFFFAOYSA-N 438.440 2.495 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c1O 739088231 NOYPEOLXKBBKRC-HOTGVXAUSA-N 427.501 2.265 10 20 IECD Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NCc3ccc(N4CCOCC4)cc3)cc12 742056867 ZQWXPRVBOUOILU-OAHLLOKOSA-N 441.557 2.215 10 20 IECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)NC2(CCN(C(=O)OC(C)(C)C)CC2)C1=O 742146027 XLAAUOTVEBGMCL-UHFFFAOYSA-N 445.564 2.463 10 20 IECD CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 743897745 UASZNXPYVMFBTG-UHFFFAOYSA-N 431.514 2.325 10 20 IECD COCCOC[C@@H]1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 744374525 WFHBLQCHLZYYCF-CQSZACIVSA-N 438.436 2.495 10 20 IECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 749635607 GSYCLXQVLPLUCQ-MRXNPFEDSA-N 449.515 2.013 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(F)c(C(=O)N(C)C)c3)CC2)cc1 752727565 YEVXHPPVYHOAKZ-UHFFFAOYSA-N 442.491 2.214 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(CNS(C)(=O)=O)o2)cc1 753597829 CQEBISYJKJZVJA-LJQANCHMSA-N 435.546 2.216 10 20 IECD CS(=O)(=O)NCc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 753624138 SITSBOFHNMLTHS-ZDUSSCGKSA-N 443.472 2.329 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 754067059 NKEGVQONSLYBQJ-FPOVZHCZSA-N 438.572 2.297 10 20 IECD Cc1cc(O)cc(=O)n1CCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 754242482 VVNDRIFPEHKSKG-UHFFFAOYSA-N 439.434 2.424 10 20 IECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(N4CCCC4=O)cc3)CC2)cc1 758223779 MOGOYKMSWZFWBP-NRFANRHFSA-N 425.529 2.384 10 20 IECD COc1cc(N2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)cc(OC)c1OC 758935177 IEUPVFNXAUTOMM-UHFFFAOYSA-N 438.410 2.496 10 20 IECD COc1cccc(NC(=O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759408504 CNIUKBPDJINKOS-UHFFFAOYSA-N 429.473 2.008 10 20 IECD COc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)Cc1cc(C)no1 762262148 QYCHAUOQBBEKFC-UHFFFAOYSA-N 446.481 2.349 10 20 IECD COC(=O)c1ncsc1S(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 765102055 YZKFEKFDSWPBRB-TXEJJXNPSA-N 443.522 2.161 10 20 IECD NC(=O)[C@H]1CC(C(=O)NCc2cccc(Br)c2O)=NN1c1ccc(F)cc1 765731242 IMBVVRQINAOKQO-OAHLLOKOSA-N 435.253 2.030 10 20 IECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)C[C@H](C)O1 768779830 YHOQISIJVATKPZ-STQMWFEESA-N 438.377 2.171 10 20 IECD O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 774189623 YVUQJNRVLYTJHN-MOPGFXCFSA-N 433.534 2.300 10 20 IECD COc1ccc(N2CCC(NC(=O)Nc3ccc(C[C@H]4NC(=O)NC4=O)cc3)CC2)cc1 775702504 LHHGAHMUNKQAJH-HXUWFJFHSA-N 437.500 2.236 10 20 IECD CNC(=O)[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCO1 782096261 AAMMXLYVIZADRY-LJQANCHMSA-N 434.334 2.486 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccc3nnnn3c2)c(C)n1-c1ccc2c(c1)OCCO2 786048637 ITXLUTDFYICKNQ-UHFFFAOYSA-N 433.424 2.343 10 20 IECD CC(C)Oc1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 787991648 WJNBOLHQBNUKOG-UHFFFAOYSA-N 428.558 2.355 10 20 IECD CCc1ccc([C@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CCO2)cc1 788312610 KXFHUGXPCNZPEJ-HSZRJFAPSA-N 437.540 2.302 10 20 IECD CCSCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789956620 WTMJMLXCETYPEL-UHFFFAOYSA-N 433.496 2.418 10 20 IECD COc1cncc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)c1 799183719 ZUUXILNXFAWWJJ-UHFFFAOYSA-N 425.513 2.418 10 20 IECD COc1cc(N2CCN(CN3C(=O)N[C@@](C)(C4CCCC4)C3=O)CC2)cc(OC)c1OC 802738247 LYCLXGUNOMITAV-QHCPKHFHSA-N 446.548 2.293 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@@H](C)N1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803297963 LDXHXJGUGYHWNB-RTBURBONSA-N 436.556 2.268 10 20 IECD Cc1cc(C(=O)OCCn2cc(C(N)=O)nn2)c(C)n1-c1ccccc1Br 805940671 XSBOQJJUQYCOAU-UHFFFAOYSA-N 432.278 2.404 10 20 IECD CC(C)[C@H](CO)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 806507448 MMGSFSICLPTKJL-SFHVURJKSA-N 430.528 2.006 10 20 IECD C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770364 LCTLFNCSEZYDAC-GJYPPUQNSA-N 438.519 2.172 10 20 IECD CCCc1nnc(SCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1N 813464599 FUPZRGPNZDSAAX-ZDUSSCGKSA-N 440.520 2.423 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@H](CS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 813590295 KBWLNSKEBCKFQS-INMHGKMJSA-N 427.542 2.015 10 20 IECD O=C(O)COc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1Br 864009303 KNONAFDQYHKWGV-WMZJFQQLSA-N 432.273 2.198 10 20 IECD CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cn2)CC1 916245690 RQZXILYQLZSEJA-NRFANRHFSA-N 439.560 2.430 10 20 IECD CC(C)N1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 919782640 CKXHUMKTNSSERU-UHFFFAOYSA-N 441.555 2.178 10 20 IECD C[C@H](NC(=O)NCCS(=O)(=O)NCc1ccccc1)c1ccc(N2CCOCC2)cc1 920866875 NMHSTPUZWZRFSJ-SFHVURJKSA-N 446.573 2.003 10 20 IECD CC(=O)N1CCN(C(=O)[C@@H](OC(=O)c2sc3nc(C)cc(C)c3c2N)C(C)C)CC1 924234782 XSWLCJIRKWORKB-KRWDZBQOSA-N 432.546 2.367 10 20 IECD O=C(COC(=O)c1ccc(OCC2CC2)nc1)NCc1ccc(N2CCOCC2)c(F)c1 1321474346 KNIZTVFROZZONZ-UHFFFAOYSA-N 443.475 2.319 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ccon3)cc2)CCC1 1787543647 WMWCMVXWCJDULB-UHFFFAOYSA-N 430.511 2.283 10 20 IECD Cc1n[nH]cc1C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1790122472 IZMSQRYXUSJFHW-UHFFFAOYSA-N 443.554 2.326 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)s1 1802081042 KZLJZGGCHRAGOU-CHWIUSCQSA-N 444.509 2.090 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1F)CC2)C1=NN(c2ccccc2)C(=O)C1 1817362581 ZYHZAQNNVICLLS-XBFCOCLRSA-N 441.488 2.206 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429260 QXKFQOHEPWRKDO-RBUKOAKNSA-N 446.548 2.031 10 20 IECD CC(F)(F)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898605 RSXBLFPCRJXKBZ-CYBMUJFWSA-N 433.546 2.122 10 20 IECD CN(C)c1ccc(CNC(=O)CNC(=O)c2ccccc2I)cc1 28669458 LVBJQXVWMGFZCE-UHFFFAOYSA-N 437.281 2.403 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)N[C@@H](C)c3ccc4c(c3)OCO4)nnc2n1 68735415 AYZNLYAKLSCXMD-NSHDSACASA-N 444.521 2.081 10 20 IECD CC(C)N(C)S(=O)(=O)c1ccc(N(C)C(=O)c2cn(C)nc2-c2cnn(C)c2)cc1 577163435 OEJKDIQOZVXHBC-UHFFFAOYSA-N 430.534 2.126 10 20 IECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)Nc1cccnc1 725863275 BZXBCLPGVGYRQJ-UHFFFAOYSA-N 437.422 2.375 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726543797 KCZCBAXTBBHXTA-UHFFFAOYSA-N 438.557 2.414 10 20 IECD CN(C)c1cc(C(F)(F)F)nc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 726968204 VRMVXPDTMZOCGB-UHFFFAOYSA-N 429.468 2.408 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)NCCS(=O)(=O)N2CCSCC2)cc1 730583859 QGMAARWZVQRVDZ-UHFFFAOYSA-N 428.624 2.053 10 20 IECD CCOCCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 732448521 OMNQPBXTFHFWAA-UHFFFAOYSA-N 444.498 2.406 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2c(nc1O)CCCCC2 737808001 RTELQICLHIUGSO-UHFFFAOYSA-N 429.542 2.221 10 20 IECD CN(c1ccc(CNS(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1)C1CCCCC1 742637411 WYMHYABCCIKCKU-UHFFFAOYSA-N 442.541 2.464 10 20 IECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800405 JSYSVLHHPITPCT-AWEZNQCLSA-N 431.443 2.260 10 20 IECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c2cccnc12 751213493 WZHUCCUMCANDGF-UHFFFAOYSA-N 447.538 2.279 10 20 IECD Cc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[nH]c2c1C(=O)CCC2 751639086 INPYHPNIKJXQBM-UHFFFAOYSA-N 443.475 2.291 10 20 IECD O=C(COC(=O)c1occc1Br)NCc1ccc(N2CCOCC2)c(F)c1 751700092 RNBUSPJHRHZRNE-UHFFFAOYSA-N 441.253 2.491 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3cc(OC)c(OC)c(OC)c3)CC2)cc1F 753856670 DTIDBRRCWLOSJF-UHFFFAOYSA-N 447.507 2.299 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc4c(c3)CCS4(=O)=O)CC2)cc1 757669852 OINNWVHCXURCEV-UHFFFAOYSA-N 429.542 2.493 10 20 IECD CCO[C@@H]1C[C@@H](NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)[C@]12CCCO2 759325610 ZVCMFPBGSPOEKQ-CQOQZXRMSA-N 446.592 2.233 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)c1 769860061 ZVVKKFRVVWLYJQ-UHFFFAOYSA-N 432.502 2.105 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4COc5ccccc5O4)n3)CC2)cc1 771055496 FVPIEVXTPZQEIH-FQEVSTJZSA-N 436.468 2.482 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(N(C)C)cc1 774855333 CAVTZKYBBRTYEH-VGOFRKELSA-N 442.535 2.259 10 20 IECD CN1CCN(C(=O)NCCCSc2nccs2)[C@H](CNC(=O)OC(C)(C)C)C1 775442417 CLPQIFZNIZWKNA-CQSZACIVSA-N 429.612 2.476 10 20 IECD C[C@@H](NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 775836326 MFPROLZIGFPNML-QGZVFWFLSA-N 448.564 2.075 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](c4n[nH]c(C)n4)C3)cc2F)CC1 776135531 OFSCIICGHAHCHB-SFHVURJKSA-N 429.544 2.483 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(N4CCOC4=O)c([N+](=O)[O-])c3)ccc21 777919847 MJCGYRBPASGNNU-UHFFFAOYSA-N 446.485 2.412 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1 778217498 HFKPEARJKWGMQT-ZVQQDINOSA-N 436.556 2.319 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc21 778595758 KXCAXVRDGQMFAK-UHFFFAOYSA-N 442.491 2.072 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 785563109 YYCXHULOOSUOIQ-XXBNENTESA-N 438.572 2.428 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789867516 HAYNWELDYJICAW-HXUWFJFHSA-N 427.570 2.230 10 20 IECD CCOC(=O)Cc1cccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 795350454 NHUGPOIJSSCBDA-UHFFFAOYSA-N 445.541 2.262 10 20 IECD COCCn1c([C@H]2CCS(=O)(=O)C2)nnc1N(C)Cc1ccc(N2CCCCC2)cc1 802508151 XPGPJSNOUWZLHF-IBGZPJMESA-N 447.605 2.453 10 20 IECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C2CC2)cc1 803685948 QBUIILZTBZAKHC-UHFFFAOYSA-N 434.540 2.236 10 20 IECD CC(C)(C)OC(=O)N1CC=C(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807288889 BQCACGKQRKRJOT-UHFFFAOYSA-N 440.544 2.362 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1COC2(CCCCCC2)O1 809675316 JJUMLPKEPJOGAY-NRFANRHFSA-N 445.560 2.064 10 20 IECD COc1ccc(N2CCN(C(=O)CCNS(=O)(=O)/C=C\c3ccccc3)CC2)cc1 913461763 QERQLBRVOLTOBU-PDGQHHTCSA-N 429.542 2.324 10 20 IECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 915083728 ISHQZIVHBUNLLY-XMMPIXPASA-N 436.512 2.379 10 20 IECD CON(C)S(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920881759 REXCDOVHIAHGQT-INIZCTEOSA-N 433.530 2.196 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCCN3Cc3cccnc3)CC2)cc1 1318550843 NTSOFGSVWUQROE-XMMPIXPASA-N 437.588 2.383 10 20 IECD CCOc1ccc(N2CCN(C(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 1341406551 IXXHRDNHIGTTQN-UHFFFAOYSA-N 426.473 2.462 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccccn12 1797476188 PUJACGWIIVMPHG-FJXIAYRNSA-N 448.479 2.416 10 20 IECD CCc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)co1 1804286394 SWDGBUXZBVOYQX-RRJKNOHSSA-N 427.457 2.319 10 20 IECD O=C(Cc1ccccc1O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1812701648 DHUSDENHUNWUGB-HXOBKFHXSA-N 448.479 2.156 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848373 GLARXZOQYUJOJF-MLGOLLRUSA-N 439.476 2.288 10 20 IECD Cn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)c(O)c(Cl)c4)sc3C2)n1 1823709017 VELJVHNVVCNLPZ-SNVBAGLBSA-N 447.904 2.481 10 20 IECD CC(C)(C)n1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1842250204 CMKNESZUEVMQSY-UHFFFAOYSA-N 448.527 2.248 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CCS(C)(=O)=O)C2)cc1 1846701052 ARFJMYYPRLBBOI-UHFFFAOYSA-N 443.569 2.346 10 20 IECD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 71956713 RBABZZUAVXDPFS-GOSISDBHSA-N 441.551 2.153 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(F)c(F)cc1F 729785080 RKSIHFWWGKGFAP-UHFFFAOYSA-N 425.382 2.459 10 20 IECD COc1ncc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 734049657 SPTFSPKCWFDHGR-LBPRGKRZSA-N 431.404 2.445 10 20 IECD Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 737117074 ICAARIOQWKLOJL-UHFFFAOYSA-N 449.511 2.320 10 20 IECD CC(=O)c1cc(Cl)cc(CN2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1O 748050457 CEVBJPPBHISVIM-UHFFFAOYSA-N 427.910 2.360 10 20 IECD CCc1cccc(NC(=O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 748461468 LIJRCBRHDLWSBZ-IBGZPJMESA-N 437.544 2.389 10 20 IECD COC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C1CC1 750538964 OWGLLTJTEXPVAW-QGZVFWFLSA-N 435.458 2.256 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(CC(F)(F)F)CC3(C)C)CC2)cc1 754164164 KNZYQBOWOFLUOL-LJQANCHMSA-N 444.542 2.137 10 20 IECD Cc1oc(S(N)(=O)=O)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754205848 VALDDPKZLSPERU-GFCCVEGCSA-N 429.445 2.236 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)c3cccs3)CC2)cc(OC)c1OC 759222067 TXSGYOHROYFMTF-UHFFFAOYSA-N 433.530 2.243 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)cc1 767454793 QEWOZBDPIGFXNU-ZDUSSCGKSA-N 444.506 2.413 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3c3nncn3C)cc2F)C[C@@H](C)O1 767761737 RTGHBOFVJVBJJQ-JXXFODFXSA-N 430.528 2.021 10 20 IECD O=C(O)[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 769523569 ZUDGSIBRGJAMCW-VWLVURMCSA-N 426.541 2.042 10 20 IECD CCOC1CC(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)(N2CCOCC2)C1 775154345 ZTQXVCVPBXBTQP-UZGSZPBKSA-N 447.576 2.353 10 20 IECD COc1ccc(O)c([C@H](C)NCC(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1 775375141 JAWGPXUOASKDKI-HNNXBMFYSA-N 433.530 2.475 10 20 IECD COc1c(F)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 777898716 VDFINYQHNOZYDV-UHFFFAOYSA-N 443.428 2.197 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(Cn4cncn4)c3)CC2)cc1 778241692 OCZDMXSUSZARJD-MDZDMXLPSA-N 446.511 2.179 10 20 IECD COC(=O)CC1(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 778312208 WBJGEJIUWNVCPC-KHPPLWFESA-N 443.544 2.282 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccccc3-c3ccno3)cc2)CC1 782432579 DRMKHEPDQBWWIF-UHFFFAOYSA-N 447.538 2.055 10 20 IECD CS(=O)(=O)CCCCOC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785410860 BPEGQTNRYHESMB-UHFFFAOYSA-N 433.529 2.236 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1 787203830 VIEHAWJLCCPNET-GOSISDBHSA-N 439.560 2.086 10 20 IECD CCc1ccc([C@@H](COC)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 789833547 GRKYPSACGBQBNR-LJQANCHMSA-N 447.507 2.062 10 20 IECD CC(C)C[C@@H](CO)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789953343 CFQWALMHPMUXPJ-KRWDZBQOSA-N 445.482 2.024 10 20 IECD COc1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)c(O)c1 794372510 ABAWMZVMFUMFEY-HXUWFJFHSA-N 435.839 2.277 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C3=C(C)N(C)c4ncnn4[C@@H]3C)cc2F)CC1 798958935 PMMKONWALGHBHY-MRXNPFEDSA-N 427.528 2.160 10 20 IECD O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(Cc2c(O)ccc3ccncc23)CC1 799391846 ZISUTYYXBSKQGY-UHFFFAOYSA-N 428.470 2.355 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCN(c4nccnc4C)CC3)cc2F)CC1 799583015 WYLOSDSBJSHCSY-UHFFFAOYSA-N 441.555 2.098 10 20 IECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662666 ZKCVMZAVYWTPKJ-KRWDZBQOSA-N 428.508 2.159 10 20 IECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCCCSc2nccs2)C1 806282047 GHYPHGQXTGREDO-KBPBESRZSA-N 428.580 2.115 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](n4cc(Cl)cn4)C3)cc2)C1 812009325 FTJCFDAINKHVNQ-LPHOPBHVSA-N 430.940 2.395 10 20 IECD NC(=O)c1ccc(CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C2CC2)cc1 918117006 FDODSAFUCDEEGL-FQEVSTJZSA-N 449.555 2.361 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(CCN2CCOCC2)cc1 918267818 ZUYBEQJWYWVKOX-UHFFFAOYSA-N 436.556 2.416 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3OC(F)F)cc2)C1 918463929 PIIWDTMQPCWIMP-HNNXBMFYSA-N 446.454 2.245 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 919088885 UDOYRYAMHCDWIO-HZPDHXFCSA-N 444.507 2.374 10 20 IECD C[C@@H](OC(=O)c1ccc(=O)n(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919199047 GPILHELRXZDKQE-CYBMUJFWSA-N 430.416 2.345 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc([S@](C)=O)cc3)CC2)cc1 1337366972 YJCLDAIAQIFKBM-IWRMORTISA-N 427.526 2.276 10 20 IECD Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777852252 LEDBBJULWXVRFM-WZONZLPQSA-N 425.485 2.243 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC=CCC3)C[C@@H]21 1792218133 YIZURCFWCCVZKI-YTLAJJPVSA-N 442.512 2.153 10 20 IECD Cc1nc2sccn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600936 SGDXVWDRDWYLQZ-BTTYYORXSA-N 427.486 2.076 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn(Cc2ccccc2)c1)c1cc(O)nc(O)c1 1798828285 AZOIJRVMOPHFIP-ACDBMABISA-N 447.495 2.303 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146145 UMTNSUHCJLDWDS-GOSISDBHSA-N 446.471 2.232 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1[C@H]3COC[C@H]31)CC2)c1cc(O)c(O)c(Cl)c1 1823713492 NKNQWNUVKLQWBS-ZSYFIWHWSA-N 449.916 2.326 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)C1=CCCC1)CC2 1828242942 XASBNNYQGLRBBP-LLVKDONJSA-N 436.584 2.026 10 20 IECD CC[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)N(CC)CC 1841673699 IXNJHBGCXVCHGZ-HXUWFJFHSA-N 439.560 2.103 10 20 IECD CC(C)COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)ccn1 1843249830 FDDLOGKCUQJCRZ-UHFFFAOYSA-N 426.473 2.053 10 20 IECD COc1ccc(N2CCCN(C(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)CC2)cc1 108429922 CABKKMDCRIKJKJ-VWLOTQADSA-N 448.523 2.127 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 726039535 UKWWDWSXESEJDS-RBUKOAKNSA-N 445.560 2.172 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](O)COc3ccccc3)cc2F)CC1 730134364 ZXNNKQKQFASEOL-IBGZPJMESA-N 430.524 2.207 10 20 IECD CCn1c(CN(C)Cc2ccccc2O)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 731843091 UMTRJSJFRCOGFG-UHFFFAOYSA-N 444.557 2.415 10 20 IECD Cc1nc(-c2cnn(C)c2)sc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 734320025 JECMHHARDRYOAY-MRXNPFEDSA-N 438.557 2.484 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](CN4CCCC4)C3)cc2F)C[C@@H](C)O1 739926967 PYSPCSRZIMUGBD-SBHAEUEKSA-N 432.584 2.473 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)o1 748092203 YNMBXKNWRQFNBF-UHFFFAOYSA-N 446.470 2.356 10 20 IECD CC1([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)OCCO1 753121967 PGIDZEGDQNLSTL-RBUKOAKNSA-N 430.549 2.073 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 754067068 NKEGVQONSLYBQJ-PZJWPPBQSA-N 438.572 2.297 10 20 IECD CNc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 756207644 WERPWONBPXZULM-STQMWFEESA-N 436.509 2.411 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3sc(C)nc3C)CC2)cc1 757254352 YAQLVSJDQZBYNT-UHFFFAOYSA-N 431.562 2.036 10 20 IECD COc1cc(N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 759099761 OVKRVRCJOVDPCX-UHFFFAOYSA-N 437.474 2.132 10 20 IECD COc1cc(N2CCN(C(=O)NCCC(=O)N3CCCCCC3)CC2)cc(OC)c1OC 759246797 YLCBYFNZRMCESQ-UHFFFAOYSA-N 448.564 2.337 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc2)C1 763555875 XTIJSUSZJVMFPL-KRWDZBQOSA-N 448.483 2.412 10 20 IECD C[C@H](NS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1ccc(N2CCOCC2)cc1 765105965 SITVFCUVRBRUDY-INIZCTEOSA-N 441.553 2.398 10 20 IECD O=C1N=C(N2CCOCC2)S/C1=C/c1ccc(OCCN2CCOCC2)c(Cl)c1 768491162 CKXJMXLYRMPMPS-NBVRZTHBSA-N 437.949 2.354 10 20 IECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)cc1F 769654054 KEISZSLUBFITLL-UHFFFAOYSA-N 429.539 2.440 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)c1 771567316 TYFCMEIHBIIDAW-WHEQGISXSA-N 427.457 2.054 10 20 IECD Cc1cc(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c(C)n1[C@H]1CCS(=O)(=O)C1 772766108 PUJYWEKQYLDNJH-LEXSJLIMSA-N 433.482 2.315 10 20 IECD Cc1ccn(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(=O)c1 773707619 BVDGEJXJRMDSGI-UHFFFAOYSA-N 430.416 2.114 10 20 IECD CC[C@@H]1CN([C@H](CC)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 773734520 SCLLJHVXTFTGEJ-FYYLOGMGSA-N 432.609 2.213 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(Oc4ncccc4F)CC3)CC2)cc1 773984006 NEVWTRYUAFNEBP-FQEVSTJZSA-N 444.551 2.256 10 20 IECD CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)CC1 774364067 PAEZAWBLAXHOHL-UHFFFAOYSA-N 425.485 2.267 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COC4(CCCCC4)O3)cc2)C1 775758277 BLIZWTLXLRJCSO-QUCCMNQESA-N 430.549 2.263 10 20 IECD COC(=O)[C@@H]1C[C@H](C)CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 775805461 BYIDNSNESOXKLO-VWXURSGXSA-N 435.540 2.329 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccc(F)cc4C3=O)cc2F)C[C@@H](C)O1 776284637 APIBXNGTQNCPIK-OKILXGFUSA-N 443.450 2.491 10 20 IECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)NC4CC4)c3)c2)CC1 780408217 CNFOVWSVNZTWFF-UHFFFAOYSA-N 442.541 2.048 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O 784027865 OCXGXXHTBROJES-UHFFFAOYSA-N 431.514 2.092 10 20 IECD COC(=O)COc1ccc(N(C)CC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)cc1 784562324 WTBBVYCUWXAFMX-SFHVURJKSA-N 448.541 2.335 10 20 IECD Cc1cc(C(=O)COC(=O)CCCCNC(N)=O)c(C)n1-c1ccc2c(c1)OCCO2 785573365 XNANCVQBXWYVFF-UHFFFAOYSA-N 429.473 2.430 10 20 IECD CN(c1ccc(CNC(=O)C(=O)NCc2ccc(-n3cncn3)nc2)cc1)C1CCCCC1 787259095 QNOUOUOMJCWPEV-UHFFFAOYSA-N 447.543 2.364 10 20 IECD COC(=O)c1cnc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[nH]1 788506824 XYLWWBKVSSNWOC-STQMWFEESA-N 436.509 2.358 10 20 IECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)C1 789823383 DLLALMVHIJEIKK-UGNRZPKXSA-N 448.583 2.244 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC4(CCN(C)CC4)C3)CC2)cc1 799030857 WFXBNMZWZFOPCH-HJWRWDBZSA-N 440.588 2.234 10 20 IECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1)c1ccc(N(C)C)cc1 803399515 BXQFYHRYBZBNAC-VGOFRKELSA-N 442.535 2.259 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3cc(S(=O)(=O)N4CCCC4)ccn3)cc2)C1 804366741 WOKBTEDTNQSASC-GOSISDBHSA-N 443.573 2.180 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3sc(C)nc3C)cc2F)CC1 805007056 LTOMYQARUXCBFD-UHFFFAOYSA-N 447.580 2.016 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(CCF)c1 806551564 VMEZDEYQQDEBBT-UHFFFAOYSA-N 427.459 2.038 10 20 IECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@@H](C)O1 807954408 QYVUZNNYYSQIQJ-NUJGCVRESA-N 437.968 2.455 10 20 IECD C[C@H](NC(=O)N(C)Cc1ccccc1S(N)(=O)=O)c1ccc(N2CCOCC2)cc1 814288479 YNETYVDHLQVJAB-INIZCTEOSA-N 432.546 2.073 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cn(Cc4ccccc4)nn3)CC2)cc1 815401217 QXDYYHNKPFIYSZ-UHFFFAOYSA-N 434.500 2.012 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN(C(=O)N(C)C)CC1 915217252 ROFPQLNVBXRONI-OAHLLOKOSA-N 434.496 2.088 10 20 IECD O=C(CN1C[C@H]2CN(c3ccccc3)C[C@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917080422 KQPFEKHEUMFSBA-OYRHEFFESA-N 438.547 2.347 10 20 IECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc2ccsc2c1=O 917202722 RNZBERAVUILVFQ-UHFFFAOYSA-N 448.545 2.379 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCn3c(=O)oc4ccccc43)cc2)C1 917832371 VUTMVJBRYKVAMS-GOSISDBHSA-N 436.512 2.393 10 20 IECD COc1cc(F)ccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603203 DEJVZZKIDOIXPQ-BJWYYQGGSA-N 429.448 2.135 10 20 IECD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1845500579 QYAXSWIBVIYVAU-CHWSQXEVSA-N 436.892 2.158 10 20 IECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)cc21 472787400 IBKWKWPLOOFDEQ-UHFFFAOYSA-N 431.496 2.442 10 20 IECD CNC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726726360 LFPUWCFZPGJMSP-UHFFFAOYSA-N 446.454 2.371 10 20 IECD COc1cccc([C@@H](C)N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 728980790 GIRKSPGIPCTVGS-OAHLLOKOSA-N 433.530 2.291 10 20 IECD CC(=O)Nc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 729049024 BGIROJDERWUQDQ-HXUWFJFHSA-N 437.544 2.389 10 20 IECD CC[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 729227541 VJIWTOCIFATHRJ-FQEVSTJZSA-N 432.546 2.121 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H](C)N1CCOCC1 729594532 PHXOXDQHHVFHKD-JKSUJKDBSA-N 444.498 2.450 10 20 IECD COc1ccc(O)c(CNC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 734064557 FQSOKOBZVIBTSY-UHFFFAOYSA-N 433.530 2.362 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C[C@H]2CCOC2)CC1 736395245 NDLZPYVNMRHQDR-GOSISDBHSA-N 434.556 2.087 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C)nn3C(C)(C)C)cc2F)CC1 737187275 BQYUTNXXHNSIPL-UHFFFAOYSA-N 444.555 2.482 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCN3C(=O)CCc4ccccc43)cc2)C1 737516736 DGGRFOLUGQHBOW-FQEVSTJZSA-N 434.540 2.374 10 20 IECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(Cl)c(N2CCNC2=O)c1 742576480 CHEFMEIDGNROAO-UHFFFAOYSA-N 448.932 2.357 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3n[nH]c4nc5ccccc5n34)CC2)cc1 758186877 SOPJLLKSEHAYFV-KRWDZBQOSA-N 438.557 2.494 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CNCc3ccc(-n4ccnc4)c(F)c3)CC2)cc1 758201808 FJYGYVMCLCSPAS-NRFANRHFSA-N 439.535 2.293 10 20 IECD O=C1CN(C(=O)/C=C\c2cccnc2)c2ccc(S(=O)(=O)N3CCCCC3)cc2N1 759763350 HRKAVLIMKLFOBD-TWGQIWQCSA-N 426.498 2.255 10 20 IECD C[C@H]1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS1(=O)=O 760000745 XEUCASSCSPSREP-LSDHHAIUSA-N 440.521 2.298 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3COc4cc(OC)ccc43)nc12 760609727 AGVJJXDYQIBRAO-LBPRGKRZSA-N 427.413 2.230 10 20 IECD CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)n1 770281501 JIHBOQCRQSQLLT-QGZVFWFLSA-N 433.528 2.461 10 20 IECD Cc1ccc(C(=O)N(C)C)cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772910006 JQTNFBKFTYVGSX-UHFFFAOYSA-N 428.508 2.401 10 20 IECD CC(C)N1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 774856362 GRIGSYRZTMBTOV-CALCHBBNSA-N 434.556 2.045 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](c4n[nH]c(C)n4)C3)CC2)cc1 776100859 CQEFUJVZIWJIGP-IBGZPJMESA-N 441.580 2.223 10 20 IECD O=C(c1cccc(O)c1O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1 776312490 CXBPWJQYNFWQNC-UHFFFAOYSA-N 426.860 2.260 10 20 IECD Cc1ccc(C(=O)N2CCC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c(O)c1O 777397767 ZWVCLVSQGZYBCT-OAHLLOKOSA-N 433.505 2.090 10 20 IECD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 783833882 GHQBMLUVASHGLZ-CHWSQXEVSA-N 427.523 2.329 10 20 IECD O=C(COC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl)c1ccc(O)c(O)c1 783989931 YLVCCWKZCPILBS-UHFFFAOYSA-N 425.846 2.185 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 784024058 KCMNETCBMSLBAS-UHFFFAOYSA-N 425.485 2.242 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](C)c1cccnc1 789842195 BERQRBMSSWNLRK-INIZCTEOSA-N 428.508 2.408 10 20 IECD C[C@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)Cn1cccn1 790228928 OQGDULVNWRJQOL-OAHLLOKOSA-N 435.475 2.022 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@H]1COC(=O)N[C@H]1CCOC1 796529324 GYMQZEZRTRDQBE-FPOVZHCZSA-N 432.565 2.081 10 20 IECD CNC(=O)CC[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 796588504 VOONKLJWSNAQGS-WSTZPKSXSA-N 448.583 2.436 10 20 IECD COCCCn1nccc1CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 801720784 LBBMPJZNTWNZJS-UHFFFAOYSA-N 439.539 2.465 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](CNC(=O)c4ccccc4)C3)ccc21 803686497 LWENKHPEVNSEAS-FQEVSTJZSA-N 448.567 2.354 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 804315475 MBZYWBYDZPYOTO-FDDCHVKYSA-N 440.588 2.256 10 20 IECD CC(C)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855263 VJLVKAWRLOSRSB-HSZRJFAPSA-N 442.604 2.108 10 20 IECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(=O)N(C)C1CCCCC1 917059479 DDGRZACKBVQWAT-UHFFFAOYSA-N 434.556 2.001 10 20 IECD CC(C)NS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917709026 OXHHYYMMVHJJOC-UHFFFAOYSA-N 435.521 2.279 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918297260 OMNNDQSFDIRBFG-LJQANCHMSA-N 425.485 2.288 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 918371058 BSHDZYIJXXTUDW-UHFFFAOYSA-N 427.482 2.082 10 20 IECD Cc1nccc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 919783290 QYEVTYPTNRGGNX-UHFFFAOYSA-N 436.495 2.040 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(=O)n(C)c4ccccc34)CC2)cc1 1318016199 PUXLWCUIKWYFJV-UHFFFAOYSA-N 435.480 2.053 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OCC4CC4)nc3)CC2)cc1 1318258279 CGKJQCKSJBQSBX-UHFFFAOYSA-N 425.485 2.385 10 20 IECD Cc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423990 MHXXYXFEBRQWPR-SFHVURJKSA-N 427.505 2.082 10 20 IECD Cc1nnc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)s1 1827426140 LPCJRSWPABLFDM-MRXNPFEDSA-N 445.545 2.129 10 20 IECD CC[C@H](C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1831054249 SDXLPGQZPAJQGR-QKKBWIMNSA-N 440.924 2.257 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc4c3ccn4C)CC2)cc1 727033441 RTIZSONXEMLPQF-UHFFFAOYSA-N 449.555 2.454 10 20 IECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)cn1 727244623 FDQRCZGFILBRIJ-UHFFFAOYSA-N 427.533 2.199 10 20 IECD CCc1cccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 727978374 IJBFHYSDOZSEFV-UHFFFAOYSA-N 433.603 2.499 10 20 IECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cccc4c3OCCO4)CC2)cc1 729875789 DBTFFMNCYYJVEZ-PMERELPUSA-N 430.526 2.064 10 20 IECD CCN1CCN(c2ccc(CNC(=O)NCCNC(=O)c3ccc(F)cc3)cc2F)CC1 730120430 METUORSTVPCVOR-UHFFFAOYSA-N 445.514 2.336 10 20 IECD COc1ccc(C[C@@]2(C)NC(=O)N(CN3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1 730252114 MMZMTGZDMXHQFQ-XMMPIXPASA-N 438.528 2.337 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 732999584 GVXRFQGBQCNMMB-FZKQIMNGSA-N 449.485 2.340 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 740491867 OOBZISRQVDKLJH-JOCHJYFZSA-N 439.512 2.288 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1N1CCOC1=O 743917698 MDXFUALQMWEEAB-UHFFFAOYSA-N 436.468 2.283 10 20 IECD CCN(CC(=O)N1CCN(c2cnccn2)CC1)Cc1cc(Br)ccc1O 744426727 WHEOIMIHLLGEIY-UHFFFAOYSA-N 434.338 2.115 10 20 IECD C[C@H](O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 747390707 WIIWIQTVMNPCFL-HKUYNNGSSA-N 442.539 2.245 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3cscn3)CC2)c1 748066676 JRJRRSPCSPNDOF-UHFFFAOYSA-N 430.574 2.201 10 20 IECD COc1ccc(N2CCN(C(=O)CONC(=O)c3cccc(Br)c3)CC2)cc1 749393401 HCYYXDSKUKRVDP-UHFFFAOYSA-N 448.317 2.468 10 20 IECD O=C(NC1CC1)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751241279 ZMXXSRCQCZJPMB-UHFFFAOYSA-N 443.569 2.266 10 20 IECD CCOC(=O)C1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 751684422 OSCHJRZRQZKFBT-UHFFFAOYSA-N 441.507 2.292 10 20 IECD COC(=O)c1cccc([C@@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)OC)c1 754003619 OSMSZIKFMRPZQB-PZJWPPBQSA-N 439.512 2.179 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](CO)C[C@H](O)c3ccccc3)cc2F)CC1 754641101 QAOCMFSROURGTB-OFNKIYASSA-N 444.551 2.251 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765926536 MRSBYMNATZRBAL-UHFFFAOYSA-N 436.262 2.043 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(O)cc(O)c3)cc2F)C[C@@H](C)O1 768594599 MHIYPAUZCHEJLR-OKILXGFUSA-N 432.448 2.324 10 20 IECD CC(C)N(Cc1nc(O)c2ccccc2n1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769713699 MXHGMMFYIABLBX-UHFFFAOYSA-N 430.486 2.463 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1cccc(NC(=O)CCN2CCOCC2)c1 779500374 PCKFZPGZBQWNTQ-FNORWQNLSA-N 425.485 2.088 10 20 IECD CCOc1cc(/C=C\C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1O 780896118 CURDQXQWVHGSDJ-POHAHGRESA-N 430.526 2.355 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)[C@H]4CCCC[C@@H]43)CC2)cc1 785530035 ZMTGSZQFSSKYLX-PMOQBDJRSA-N 442.604 2.361 10 20 IECD COc1cccc(C[C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788333205 PXNOIQMMOHFBMA-QFIPXVFZSA-N 437.540 2.382 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCC1(N2CCSCC2)CCCC1 788936975 LPSYPJMTPHISBR-UHFFFAOYSA-N 430.618 2.381 10 20 IECD COc1ccc(N2CCN(C(=O)CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)CC2)cc1 795126055 YHMUFCBPVBQCED-KDURUIRLSA-N 430.593 2.311 10 20 IECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)cn1 799636804 ZWXBQAXFVIQQAP-UHFFFAOYSA-N 440.528 2.386 10 20 IECD C[C@H](NC(=O)C(=O)NCc1nc(C(F)(F)F)cs1)c1ccc(N2CCOCC2)cc1 803297594 AZJIUJYBTKDSAW-LBPRGKRZSA-N 442.463 2.492 10 20 IECD C[C@H](NC(=O)C(=O)N(CCO)[C@@H]1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 803309857 DLVSMDZCUGGXFM-FDDCHVKYSA-N 437.540 2.209 10 20 IECD COc1cccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 803690856 YJSAPWLHEYIMGN-OAHLLOKOSA-N 434.443 2.093 10 20 IECD COC(=O)C[C@@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 805819579 UVWHVBAARQVCBG-LJQANCHMSA-N 428.485 2.327 10 20 IECD COc1ccc(OC)c2c1CN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C[C@H]2O 807673622 WTOKCKPVTDCIJI-KBXCAEBGSA-N 427.501 2.023 10 20 IECD CS(=O)(=O)C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 813662560 YPRJVFGNHIBZNO-HUUCEWRRSA-N 431.505 2.333 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3ccccc3F)C2)C1 1780481920 UGLZMJCIUHRMEO-AVAOGFIGSA-N 442.443 2.099 10 20 IECD Cc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)s1 1782005384 CATKLTYNNPDSPE-IBGZPJMESA-N 437.905 2.273 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cccc(F)n1 1788869024 GZZCSKHONOBWRA-BNLOLNQZSA-N 449.866 2.192 10 20 IECD CCC[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)CC1 1800650398 WLPBPOUPNLGFAO-NDJUXDTMSA-N 431.533 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H](F)c1ccccc1 1804330606 AHAUOIBDVXBUBD-BASYENTBSA-N 435.546 2.196 10 20 IECD O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H]2CO)cc1)c1ccc(C2=S=CC=C2)o1 557462058 RRCWNYUUSWKTSV-HNNXBMFYSA-N 432.523 2.303 10 20 IECD O=C(NCCOC[C@@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 731681413 AFDVORJFJMOQDW-OAHLLOKOSA-N 431.455 2.394 10 20 IECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NCCCSc2nccs2)c1 733972886 YNZTVXABMZAZAG-UHFFFAOYSA-N 428.561 2.385 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(C[C@H]2CCCO2)CC1 734269417 JZPIAKMYLPYFSL-HXUWFJFHSA-N 434.556 2.229 10 20 IECD C[C@H](NC(=O)N1CCN(c2ccc(C(N)=O)cc2)CC1)c1ccc(N2CCOCC2)cc1 735512787 NDFKYXMVXBCUOU-SFHVURJKSA-N 437.544 2.215 10 20 IECD O=C(NCC1(O)CCS(=O)(=O)CC1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 741430673 JIKOVKLZHOTDDD-UHFFFAOYSA-N 430.486 2.096 10 20 IECD CN(CC(=O)Nc1ccccc1SCC(N)=O)Cc1ccc(N2CCOCC2)cc1 741735527 KSEQIQKCCUUCOX-UHFFFAOYSA-N 428.558 2.171 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(c4cnn(C)c4)C(=O)C3)c2C)cc1 750058341 YLWYLJRLWIMBLQ-UHFFFAOYSA-N 449.511 2.146 10 20 IECD CCc1noc(CC)c1CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 756473206 DQSHFMUBVAASNP-UHFFFAOYSA-N 433.480 2.177 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@]4(C[C@@H](C)C[C@@H](C)C4)C3=O)CC2)cc1 756864648 VPBLBSLKBWAORA-GPVSGQMNSA-N 428.533 2.091 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O 760092589 NFEGBSBMSARZCT-UHFFFAOYSA-N 435.521 2.424 10 20 IECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1F 761116304 AAIBFPSOHLOLOU-JXFKEZNVSA-N 440.475 2.329 10 20 IECD O=C(NCc1ccc2c(c1)CCS2(=O)=O)NCc1cccc(Br)c1O 764795871 BRPJYOLZRHGUQX-UHFFFAOYSA-N 425.304 2.484 10 20 IECD Cn1nc2c(c1C(=O)NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)CCCC2 765031980 YKMLEHYFQFYVRF-UHFFFAOYSA-N 449.534 2.485 10 20 IECD CC(C)C[C@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769807453 BJNHWYGTNPQHOV-CQSZACIVSA-N 429.539 2.433 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@H](O)c4cccc(F)c4)n3)CC2)cc1 771056062 KTPRRNVRXMCLQP-HXUWFJFHSA-N 440.475 2.385 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3cnc(C4OCCO4)s3)CC2)cc1 773727785 NRSQJAJCIWQWML-UHFFFAOYSA-N 432.546 2.139 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2nnc(C(F)(F)F)s2)CC1 776860279 NMZBWCQHTDRBLX-UHFFFAOYSA-N 442.511 2.404 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCCN(C(=O)C4CC4)CC3)cc2F)CC1 780415522 KTIHUZHOKIJCQN-UHFFFAOYSA-N 431.556 2.122 10 20 IECD COc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCCC1 786124549 HBQMKKHIOAGWRJ-UHFFFAOYSA-N 435.502 2.255 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCc4occc43)cc2F)CC1 788629516 VSYCGSRUDPVLFR-LJQANCHMSA-N 428.508 2.371 10 20 IECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 789800304 TWVKAAURJJSFIN-UHFFFAOYSA-N 435.540 2.382 10 20 IECD Cc1csc(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789813771 VPIYSIIYKBRWRI-UHFFFAOYSA-N 434.537 2.183 10 20 IECD Cc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C2CC2)o1 793733182 LQFJVNLJAJPQFV-SFHVURJKSA-N 438.528 2.097 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1F 803661959 PHTWMQANZUXARG-INIZCTEOSA-N 436.528 2.271 10 20 IECD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687523 FJWSRPFSCUTKCZ-QGZVFWFLSA-N 432.528 2.486 10 20 IECD CNS(=O)(=O)c1cccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)c1 805134947 CYUHBLWETWZODY-UHFFFAOYSA-N 425.315 2.086 10 20 IECD Cc1cccn2cc(CCNC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)nc12 806536798 NKFKWIDKGHSWAA-FQEVSTJZSA-N 436.512 2.215 10 20 IECD COCCN1C(=O)/C(=C(/C)Nc2cccc3c2C(=O)c2ccccc2C3=O)C(=O)NC1=S 814334933 KINKQPREDFTURN-ATVHPVEESA-N 449.488 2.038 10 20 IECD CSc1nnnn1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 915778174 COHFZKDITVXFFO-UHFFFAOYSA-N 437.529 2.239 10 20 IECD O=C(NCCNC(=O)c1ccco1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916259546 OGMIPPBRMAGSFP-UHFFFAOYSA-N 440.422 2.364 10 20 IECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1C 918443555 WRVKCMNIBCBKFB-UHFFFAOYSA-N 438.528 2.417 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 920927544 YCDNVJNUTDZAGG-QGZVFWFLSA-N 438.528 2.397 10 20 IECD Cc1nn(C)cc1CCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1324801769 LKJVWQVOIWRMKD-HOTGVXAUSA-N 446.523 2.273 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc(F)cc(Cl)c1 1791980227 CRFWSHDWWSNOSM-GOPGUHFVSA-N 449.866 2.192 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994639 XHFHYNFQLRYGTB-IFXJQAMLSA-N 426.498 2.228 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccnc(F)c1 1815422005 RDUKSFODROABOD-CQSZACIVSA-N 426.408 2.370 10 20 IECD O=C1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)N1 1826662596 JZFOFLZDIHXTMP-IAGOWNOFSA-N 449.935 2.263 10 20 IECD Cc1ccccc1NCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842988399 UGDAJXHNGJTWLO-CSKARUKUSA-N 437.496 2.441 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)nc1 1843441432 WXTQWJDCACVDNB-UHFFFAOYSA-N 445.523 2.319 10 20 IECD COc1ccnc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1OC 1845501891 OTTBAIZAHMSJSF-UHFFFAOYSA-N 447.875 2.294 10 20 IECD CCc1ncsc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038286 MDGFHMBPBYSLFC-FNORWQNLSA-N 429.498 2.353 10 20 IECD CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 104983477 UGPAACUELWUGPE-UHFFFAOYSA-N 447.557 2.175 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 108577135 UZRHBPRWWYABRR-KRWDZBQOSA-N 447.557 2.110 10 20 IECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)ccc21 108898232 IFHSEPALALWVMN-UHFFFAOYSA-N 447.539 2.494 10 20 IECD C[C@H]1CN(C(=O)Cc2noc(-c3ccc(NC(=O)C4=S=CC=C4)cc3)n2)C[C@@H](C)O1 445398236 RHEVHEUZMHGWQE-OKILXGFUSA-N 426.498 2.131 10 20 IECD COc1ccc(Cl)cc1N1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 726624990 BQRLMHASOYDXFR-AWEZNQCLSA-N 439.921 2.434 10 20 IECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3cccc(OC)c3O)CC2)cc1 729859812 TYHSBXPYYJXXCY-UHFFFAOYSA-N 434.514 2.127 10 20 IECD CS(=O)(=O)Nc1ccc(S(=O)(=O)NCCCSc2nccs2)c(F)c1 733899573 KBENEHMIPAPPRO-UHFFFAOYSA-N 425.554 2.114 10 20 IECD COCCNC(=O)CN1CCN(CC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CC1 741607450 YFBWUJCOJMDMNI-UHFFFAOYSA-N 440.588 2.274 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1 747571335 NNYLPYZCNQKWSK-CALCHBBNSA-N 428.537 2.215 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 749346813 KZGUBODPJGPGBS-SFHVURJKSA-N 431.558 2.134 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)CC2)cc1 749809974 KAVIRHVCMGPPKF-LJQANCHMSA-N 432.565 2.285 10 20 IECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c2ccccc12 759036613 SWMAAWWAQNJRNI-UHFFFAOYSA-N 438.436 2.361 10 20 IECD O=C(NC[C@@H]1COC2(CCOCC2)O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776944672 DPUYMQOLFXGOPI-CRAIPNDOSA-N 441.475 2.478 10 20 IECD CSc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1[N+](=O)[O-] 777129010 UFHXNWWELKCAQL-UHFFFAOYSA-N 435.527 2.482 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1 778225384 GAQIQVQZQRRMSQ-CMDGGOBGSA-N 436.468 2.398 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CCN(C)C)C3CCCC3)CC2)cc1 778274014 WRPZCZYTCPMOFW-SEYXRHQNSA-N 428.577 2.233 10 20 IECD C[C@@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788314113 YGPAFTDSYJZZTI-SFHVURJKSA-N 442.585 2.106 10 20 IECD C[C@@H]1N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOC1(C)C 789951227 UOXDVOHFEUGMMP-AWEZNQCLSA-N 443.466 2.184 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)NC[C@H]1CCCS1 789955630 QRXUTVXIRUMWRL-OAHLLOKOSA-N 431.480 2.170 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3cnccn3)cc2F)C[C@@H](C)O1 795920248 WUGAJSJXABBAPN-HZPDHXFCSA-N 430.480 2.022 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@@H](N1CCOCC1)C(F)(F)F 804969522 QUHZRLJMMKOWSG-QGZVFWFLSA-N 432.512 2.302 10 20 IECD COc1cc(OC)c(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1 805154693 QOQJTPBMQISYKW-UHFFFAOYSA-N 439.512 2.064 10 20 IECD CCN(C)C(=O)OC[C@@H]1CCCCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 805762202 DZTANVIYZVSNFW-FQEVSTJZSA-N 432.565 2.287 10 20 IECD C[C@@H](NC(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1)c1ccc(N(C)C)cc1 807378857 NEEKGEINUCFAEQ-MRXNPFEDSA-N 428.508 2.222 10 20 IECD C[C@H](NC(=O)C(=O)N1CCCN(C(=O)c2ccccc2F)CC1)c1ccc(N(C)C)cc1 807672147 WUSRHBPFDHNYDM-KRWDZBQOSA-N 440.519 2.444 10 20 IECD C[C@@H](NC(=O)C(=O)N1CCN(c2ncnc3sccc23)CC1)c1ccc(N(C)C)cc1 807675280 VZJVECZSXMSXHP-OAHLLOKOSA-N 438.557 2.283 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(c2cc(CC)ncn2)CC1 808450271 NFFMGQWNLVVCIP-UHFFFAOYSA-N 425.533 2.268 10 20 IECD CCS(=O)(=O)N1CCC([C@H](C)N(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 808775499 CSFVQTYVOWWJJK-SFHVURJKSA-N 438.638 2.093 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3CN3CCOCC3)cc2F)C[C@H](C)O1 812008955 JXOWDEJBSYXNHO-BJLQDIEVSA-N 434.556 2.446 10 20 IECD CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NCc2ccc(N(C)C)cc2)c1 913124980 CKWUHQLZXUDLES-UHFFFAOYSA-N 425.518 2.095 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3cc([N+](=O)[O-])cn3)c2C)cc1 913303484 ULVKOPYIAVCWIX-UHFFFAOYSA-N 440.412 2.412 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OC[C@@H]2CCCO2)cc1 916676231 CQPFHVVCHKYZPR-QFIPXVFZSA-N 444.553 2.409 10 20 IECD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 918306313 YEKNSDOAJNDNAP-UHFFFAOYSA-N 432.546 2.036 10 20 IECD COC(=O)c1cc(-c2csc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)c[nH]1 919811572 KNFIARVNNVEDFN-UHFFFAOYSA-N 436.471 2.254 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NCCc3nc(C(C)C)no3)CC2)cc1 1251740718 DRJWKORXYRXQKB-UHFFFAOYSA-N 430.553 2.256 10 20 IECD CC(=O)O[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C(C)C 1804286341 QVSRVEYFPQYHPY-NQEVSOEBSA-N 446.500 2.043 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCSC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001764 QMDSDGNZHXQDOS-TWOQFEAHSA-N 442.541 2.351 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469397 MMDGXEMCTSEALA-PGRDOPGGSA-N 431.496 2.290 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3cocn3)C2)CC1 1808747111 YJUOPEHYFYWURJ-UHFFFAOYSA-N 435.484 2.312 10 20 IECD CCc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)co1 1811009036 NTMXJHFFSPOUDV-VBKZILBWSA-N 437.456 2.072 10 20 IECD C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812584198 KNUNDRWOPJOEEG-LBIFLRBASA-N 444.582 2.080 10 20 IECD CC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834452350 JAMJUKVLRCNQIR-FNORWQNLSA-N 445.560 2.434 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(OC2CCN(C(=O)c3cc[nH]n3)CC2)CC1 1836948595 GUNMBBNYBNGPAK-UHFFFAOYSA-N 448.907 2.400 10 20 IECD CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C(C)(C)C 1845500660 YEETWSBZGUYCQI-KRWDZBQOSA-N 437.924 2.119 10 20 IECD CCN(CC)c1ccc(CNC(=O)Cn2cc(Br)c(O)nc2=O)cc1F 303349841 NJUKATQIIRKOMJ-UHFFFAOYSA-N 427.274 2.013 10 20 IECD Cc1c(CNC(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)n(C)c2ccccc12 550825443 UIZMCLIYBHLAGG-UHFFFAOYSA-N 433.556 2.041 10 20 IECD CC(=O)N(CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)Cc1ccccc1 726143453 CXCVLCWJIHTONF-QFIPXVFZSA-N 436.556 2.443 10 20 IECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 726977011 VPEBDOXZTLTPKS-UHFFFAOYSA-N 438.571 2.107 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cnn(-c3ccc(Cl)cc3)c2)SC1=S 727177082 WDWWVEXLBUJYSC-RIYZIHGNSA-N 442.975 2.276 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(F)(F)Oc3ccc(C=O)cc3)nc12 730873595 XUYKTMVBLRJMOG-UHFFFAOYSA-N 435.339 2.139 10 20 IECD COCCN1CCC(N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 743485794 PRRPHJJSVDCFSU-MRXNPFEDSA-N 435.524 2.489 10 20 IECD Cc1cc([N+](=O)[O-])c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 751212350 AXCPDKJTFXPCAD-UHFFFAOYSA-N 439.515 2.247 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3cccnc3N3CCN(C)CC3)CC2)cc1F 753876898 GVWFLWDBGXXAMI-UHFFFAOYSA-N 442.539 2.013 10 20 IECD C[C@@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)S(C)(=O)=O 754234609 CKQRJLFVCJQEFL-GJSJWPQCSA-N 432.614 2.279 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ncc(C(C)C)s3)CC2)cc1 756099658 SCQUDLUNADPLOU-UHFFFAOYSA-N 431.562 2.152 10 20 IECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 756151196 RSJNVBOLJAWRBJ-UHFFFAOYSA-N 425.894 2.041 10 20 IECD COc1cc(N2CCN(Cc3cnc(N4CCOCC4)s3)CC2)cc(OC)c1OC 761219485 QTQZCUGINGWQPP-UHFFFAOYSA-N 434.562 2.328 10 20 IECD C[C@H]1CCS(=O)(=O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 763199034 ZJGWBFNCUCHGOK-AWEZNQCLSA-N 449.495 2.261 10 20 IECD CON(C)C(=O)[C@H](CCSC)NC(=O)NCc1ccc(N2CCSCC2)cc1 765679421 SWMFVEUGVSDADQ-KRWDZBQOSA-N 426.608 2.181 10 20 IECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NCc1cccc(Br)c1O 765731514 JIYPGVVXYYZRCI-VNHYZAJKSA-N 428.352 2.497 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1F 765903144 FWHXNKMDHCOBOD-UHFFFAOYSA-N 425.210 2.335 10 20 IECD CCN1CCN(c2cccc(NC(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)c2)CC1 770145895 BMRWFOJGEDCRFX-UHFFFAOYSA-N 434.537 2.470 10 20 IECD Cc1cc(C(=O)COC(=O)c2ccnc(S(N)(=O)=O)c2)c(C)n1-c1cccc(F)c1 772438232 RYKOVROAMZMGKB-UHFFFAOYSA-N 431.445 2.315 10 20 IECD C[C@H](NS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1ccc(N(C)C)cc1 773982950 VIEBDJVSYOCUEM-HOCLYGCPSA-N 431.514 2.230 10 20 IECD CC[C@H]1CCCCN1CCNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778276412 QXJLQCBEYNBWMF-SGWGQVFISA-N 428.577 2.281 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@@H](CCO)c3ccccc3)CC2)cc1 778389921 KKXSVYQZMZSEIF-FRHQNKJESA-N 437.540 2.482 10 20 IECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 781448868 IPLNGIFNVWANHO-UHFFFAOYSA-N 431.489 2.420 10 20 IECD Cc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1S(N)(=O)=O 783317318 PKXGSCIPMUTMKB-UHFFFAOYSA-N 432.546 2.084 10 20 IECD CN(C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)C(=O)OC(C)(C)C 785439820 WKCKXJAXLSZEEK-GOSISDBHSA-N 432.565 2.474 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1 785481312 QCKDBQFOWVNXJK-UHFFFAOYSA-N 438.572 2.250 10 20 IECD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786121511 GEHFMCVCEHAXBU-UHFFFAOYSA-N 446.529 2.304 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@@H](c2ccccc2Cl)C1 788319533 LLHANLGMXOSRBD-OAQYLSRUSA-N 443.931 2.393 10 20 IECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788931490 GZRRJAVYMCSMQI-PKOBYXMFSA-N 430.549 2.276 10 20 IECD CCc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833158 DIUSKXJHXMAZBK-HNNXBMFYSA-N 428.508 2.238 10 20 IECD COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 789855130 KIKHXABIMUUNKD-QGZVFWFLSA-N 443.569 2.448 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12 789867509 HANBWIMFADHZKO-KZNAEPCWSA-N 437.656 2.352 10 20 IECD CCc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)on1 789948550 CGUXIAGGOJAPSB-UHFFFAOYSA-N 440.422 2.025 10 20 IECD NC(=O)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(Br)c1 792839984 CCSJWYKUEGSKAC-SFHVURJKSA-N 447.333 2.312 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](n4cc(Cl)cn4)C3)CC2)cc1 794246918 NTINITGRVPWZAP-GHOSXJJBSA-N 443.935 2.224 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCN(c3ncccn3)CC2)n1C 800765077 MIHBCPBNCLYWFO-UHFFFAOYSA-N 448.575 2.462 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12 803448319 OGLSWXMXQDUGNU-GUDVDZBRSA-N 437.487 2.447 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1F 804853904 XBPLRHMLPOOBGS-QWFCFKBJSA-N 448.583 2.388 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H]3[C@@H]3CNC(=O)C3)cc2)CC1 805024392 DUFRZIRAWUXQGY-FPOVZHCZSA-N 426.561 2.056 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(OC2CCOCC2)c1 805539971 DQHMPAKQVKJDLJ-UHFFFAOYSA-N 440.544 2.370 10 20 IECD COCc1cnc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 806844152 UOSODENYLKCUGV-STQMWFEESA-N 436.509 2.297 10 20 IECD C[C@H](NC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(N(C)C)cc1 807673845 AGOWAABXBJDURJ-CVDCTZTESA-N 438.572 2.337 10 20 IECD COc1ccc([C@H](O)CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 916196565 MEPAJQNELVKGFZ-HSZRJFAPSA-N 442.560 2.249 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc1 916731669 LUKDSFMGSRTOJT-UHFFFAOYSA-N 439.560 2.201 10 20 IECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1NC(C)=O 918436766 BUOAVANKJOOOLZ-UHFFFAOYSA-N 442.541 2.462 10 20 IECD CC(C)(C)c1nnc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 918442486 MNWMEDKJEDMZBL-UHFFFAOYSA-N 431.562 2.299 10 20 IECD Cc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1 1782005579 OYVUXOZNABNYJO-OAQYLSRUSA-N 431.876 2.212 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CCC(CC3)CC4)C[C@@H]21)c1cc(O)nc(O)c1 1787295213 VOKCPXZWNBOTMS-UPQNXWCWSA-N 429.517 2.057 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cn2cc(Cl)ccc2n1 1796601258 KVVIHEJIQMIQCJ-QDMKHBRRSA-N 441.875 2.360 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc2ccccn2n1 1804285793 DQKINCMRAYHJFK-ZBTRPWJCSA-N 448.479 2.416 10 20 IECD C[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340173 JZPHHWCJUSQBAU-NRSFXHEJSA-N 445.610 2.364 10 20 IECD O=C(Cc1ccc(F)cn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817540742 RTUMLKXHNFPMJB-INIZCTEOSA-N 440.435 2.299 10 20 IECD CN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843598 SFFXFRAETWVYDU-JKSUJKDBSA-N 428.493 2.006 10 20 IECD CCc1ncccc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441356 MKNAJUDQFUSFOB-UHFFFAOYSA-N 431.496 2.254 10 20 IECD Cc1ccc(SCC(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc1 1843828629 XFNKFSNXFGBPHR-UHFFFAOYSA-N 449.623 2.151 10 20 IECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(CS(N)(=O)=O)c2)cc1 726533535 BOZUFUUQOQVVIB-OAQYLSRUSA-N 431.558 2.363 10 20 IECD CCCOc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1OC 727177017 ARVMJDHPWHTKSX-RVDMUPIBSA-N 430.573 2.234 10 20 IECD NS(=O)(=O)c1ccc(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 728313756 KJMACKOBEQDYIY-UHFFFAOYSA-N 439.484 2.263 10 20 IECD COc1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc(OC)c1OCC(N)=O 742476323 WCCGUOHJJCINOF-UHFFFAOYSA-N 427.501 2.488 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCCn3cccn3)cc2F)C[C@@H](C)O1 743225476 ZYTDGKRIKCNNTM-CALCHBBNSA-N 432.496 2.276 10 20 IECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)c(Br)cc1F 743901793 PDYSZQIFCULHEL-UHFFFAOYSA-N 425.210 2.335 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1 747571749 PFSMFBXLFSXNPG-KFWWJZLASA-N 431.493 2.116 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754039710 DHVUUVGYANBAJF-UHFFFAOYSA-N 426.441 2.271 10 20 IECD O=C1N[C@H]([C@@H]2CCCOC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761094747 GQJKORMIFZKQNK-RHSMWYFYSA-N 427.423 2.389 10 20 IECD C[C@H](NC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773845460 GWRHRPQKDUDFJQ-AWEZNQCLSA-N 430.530 2.009 10 20 IECD CS(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(F)F)c3)n2)cc1 777665908 BQQGQXUSUOMFJG-UHFFFAOYSA-N 448.498 2.476 10 20 IECD COc1ccc(OCCNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778222013 SBYIYIMNZXODMN-QXMHVHEDSA-N 439.512 2.104 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1)c1ccc(N(C)C)cc1 778729825 RLLCISRJTIBLIE-OAHLLOKOSA-N 442.491 2.180 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCN(Cc2ccccn2)C1=O 784222204 LZPUTQHWVWPIRM-FQEVSTJZSA-N 441.507 2.048 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1 785296600 OGACQYBMMGYERP-HRCADAONSA-N 427.501 2.397 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)c(F)c3)cc2)CC1 786657110 SHEGZIQKKJIJIM-UHFFFAOYSA-N 440.519 2.261 10 20 IECD O=C([C@@H](CNCc1ccc(N2CCOCC2)cc1)Cc1cccc(F)c1)N1CCOCC1 788530175 VZRGJUGQNWZFRJ-JOCHJYFZSA-N 441.547 2.470 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 789826001 OLFCMXSTNNJHKC-QWFCFKBJSA-N 446.567 2.142 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@]2(CCO[C@H](C)C2)O1 789862545 VSBQUXDNAVVHSM-IEGUWTFLSA-N 447.601 2.041 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1 791475124 KKWJICIGJWHFMY-KRWDZBQOSA-N 428.499 2.208 10 20 IECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccc(N2CCOCC2)cc1 803301582 UIMPPULMYVDELQ-LLUDDFSJSA-N 427.545 2.164 10 20 IECD C[C@@H]([C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)S(C)(=O)=O 803677023 CUHSCUNTMLLZLI-SJORKVTESA-N 437.606 2.352 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(C(=O)NCc4ccccc4)CC3)ccc21 803687510 FBLHLTWPFAOJPP-UHFFFAOYSA-N 448.567 2.240 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 807287283 IRYFPYUZUNDPTF-PKTZIBPZSA-N 435.524 2.030 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1 807379245 WCLFSNFVNJCERJ-UHFFFAOYSA-N 429.492 2.423 10 20 IECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NCc2cc(Br)ccc2O)nn1 807387764 VYLCBLUZFJQVOQ-UHFFFAOYSA-N 445.277 2.002 10 20 IECD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835504 VYCXTKJFKDJSOL-OKZBNKHCSA-N 431.920 2.077 10 20 IECD CC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 916185901 MUXTXJUCYDSYDW-UHFFFAOYSA-N 428.491 2.224 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)cc1 918433818 IHKOEZWIZDHHNI-UHFFFAOYSA-N 433.512 2.393 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12CCC(=O)N1c1ccccc1S2 1254761682 RHOOLPRMZJLBEV-RCDICMHDSA-N 442.493 2.317 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@@H]1CCc2ccccc2[C@@H]1O 1796601115 VPVXIJILJAWHLK-KFFFPCEGSA-N 437.496 2.041 10 20 IECD Cc1cnn([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804291947 ZRCCULDDJHIPBP-CVYHMRKMSA-N 440.500 2.221 10 20 IECD O=C(Cn1ccnn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1819701313 DVELDUHOGCVYSI-CQSZACIVSA-N 445.867 2.072 10 20 IECD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831133997 PVJHKUXETVHIAA-WMLDXEAASA-N 449.504 2.288 10 20 IECD O=C(c1c(Cl)ccc2c1OCO2)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249423 HLLDPBUTGUPSDE-UHFFFAOYSA-N 431.832 2.006 10 20 IECD CC(C)n1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1844814956 DMENOGSGWZXZCY-UHFFFAOYSA-N 434.500 2.074 10 20 IECD Cc1cc2cccc(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)c2[nH]1 1847054720 XQEATLBYMHLMGX-UHFFFAOYSA-N 442.566 2.154 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4C)C3=O)CC2)cc1 110757862 YTIDQARWCGKCMG-DEOSSOPVSA-N 436.512 2.119 10 20 IECD Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c(O)c1O 727003569 AYSJERHAFXJMBJ-AWEZNQCLSA-N 425.441 2.388 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 741741860 MNOKHQWLAYJZPJ-IBGZPJMESA-N 441.557 2.047 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(S(N)(=O)=O)ccc1Br 742952604 NMCHGKMWAXKQNH-UHFFFAOYSA-N 440.319 2.202 10 20 IECD Cn1cccc1CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743819472 RHKSGUIGEILKNX-UHFFFAOYSA-N 430.442 2.370 10 20 IECD CCOCCO[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 750261787 ISNMPXWINOGHGN-GGPKGHCWSA-N 437.556 2.183 10 20 IECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Br)cn1 751237718 UKFCWYAWTFTNOM-UHFFFAOYSA-N 444.326 2.423 10 20 IECD CC(C)[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(-c2nc[nH]n2)no1 752647571 CIEOIGKEPPFQEO-INIZCTEOSA-N 444.471 2.027 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc(F)cc4c3OCOC4)CC2)cc1 753873220 FEYOFDRQJOREIO-UHFFFAOYSA-N 444.459 2.135 10 20 IECD COC(=O)c1coc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)c1 753919375 VQTREEXHSAGVBF-UHFFFAOYSA-N 442.496 2.394 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCc3ccncn3)cc2F)C[C@@H](C)O1 755633770 PHJKCLUMRHOXEW-HZPDHXFCSA-N 430.480 2.022 10 20 IECD CC(C)(O)CN1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 760187142 GKEIBOQJOHENDB-INIZCTEOSA-N 426.508 2.355 10 20 IECD COC(=O)c1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1[N+](=O)[O-] 763494939 LQBFVMCGJPCXHZ-UHFFFAOYSA-N 429.429 2.118 10 20 IECD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NCc2cccc(Br)c2O)c1 765752971 KUKVBVRQWNNBLE-UHFFFAOYSA-N 431.283 2.474 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 769164830 VYNZJSNNHZMBDE-XZOQPEGZSA-N 430.593 2.433 10 20 IECD CCOc1cccc(CN2CCN(CCNS(=O)(=O)c3ccc(C)cc3)CC2)c1O 769379844 OXQLZSCRJIGADK-UHFFFAOYSA-N 433.574 2.195 10 20 IECD O=C(CCN1C(=O)CNC1=O)Nc1ccc(NCc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 770524430 NAJCWWNMAYQPTR-UHFFFAOYSA-N 447.835 2.446 10 20 IECD Cc1ncc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1 777197362 LLZZJXUKAANLHH-KBPBESRZSA-N 430.480 2.319 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](CCO)c3ccccc3)CC2)cc1 778321790 VRVFNBIEZXBIRR-VIOKTNGOSA-N 437.540 2.182 10 20 IECD Cc1nc(Cn2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)nn2)no1 783345871 XBSBOAXIKVWFQU-UHFFFAOYSA-N 433.419 2.018 10 20 IECD O=C(Nc1ccc2c(c1)OCO2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784764648 JHYUUNKJWLCJAM-INIZCTEOSA-N 431.876 2.494 10 20 IECD COc1cc(N2CCN(C(=O)[C@H]3CN(C)C(=O)c4ccccc43)CC2)cc(OC)c1OC 784798974 RZPKRIBCZVYVAM-IBGZPJMESA-N 439.512 2.230 10 20 IECD C[C@@H](CN1CCCCC1)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787752928 WPRYNOPFAWUGCZ-IRXDYDNUSA-N 438.519 2.364 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]1c1ccccn1 789842202 BHWAQWIUKORICF-OAQYLSRUSA-N 426.492 2.162 10 20 IECD Cc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 793717357 FTUFBJLEFJLTGL-WBVHZDCISA-N 428.558 2.252 10 20 IECD CCN(CC)[C@H](C)CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450646 NHCXOYDSOFWWPP-OAHLLOKOSA-N 426.508 2.220 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(C[C@H]3CCCO3)CC2)cc1)C1CCCCC1 803676466 JMGYDYAHZLZSDB-HSZRJFAPSA-N 442.604 2.395 10 20 IECD CCCN(CCN1CCCC1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 804441387 LTDCAPXRDGWPIT-KHPPLWFESA-N 428.577 2.234 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)CCc3nccs3)cc2F)CC1 805007485 STMVDOQSBHYXHH-UHFFFAOYSA-N 447.580 2.132 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@H](C)CC3)CC2)cc(OC)c1OC 806965521 JNAPMXKKAQNDIU-DLBZAZTESA-N 433.549 2.446 10 20 IECD CC(C)CO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 807290646 ZJFWORBWYXVVEG-QGZVFWFLSA-N 441.532 2.454 10 20 IECD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 807671447 PESHUCSSBHUFRB-MTNREXPMSA-N 425.529 2.281 10 20 IECD C[C@@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808854256 AKIMVVAWHCAONJ-SFHVURJKSA-N 430.618 2.046 10 20 IECD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OCC(F)F)c1 810348258 KNPJNFHYCKPXAC-UHFFFAOYSA-N 446.454 2.285 10 20 IECD O=C1CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2N1 815715508 KCACBONNTXFITR-AWEZNQCLSA-N 444.438 2.369 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CCC(=O)NCc1ccc(N2CCSCC2)cc1 917385653 JHWDNSHOKUHQDY-UHFFFAOYSA-N 425.562 2.126 10 20 IECD CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccs1 917832522 CJVIVBKCBBIMGJ-PKOBYXMFSA-N 428.558 2.334 10 20 IECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1ccccc1 918119190 YBIRBHWOGAMJIB-FYYLOGMGSA-N 437.588 2.360 10 20 IECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 918374668 UCCBGPLNLLPWFJ-UHFFFAOYSA-N 433.530 2.009 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cc3F)cc2)C1 918463921 PEYPKYNRYGNRSE-AWEZNQCLSA-N 432.883 2.436 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccn(-c4ccccc4F)n3)nc12 919120979 VNJWBBKHVJXKID-UHFFFAOYSA-N 425.376 2.293 10 20 IECD CCNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 920927542 YCDNVJNUTDZAGG-KRWDZBQOSA-N 438.528 2.397 10 20 IECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc(C(=O)OC)c1 920938433 SFPAGUFYPCMGOK-UHFFFAOYSA-N 427.457 2.418 10 20 IECD Cc1ocnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1779870917 SCZYIQVUASPDBT-IIBYNOLFSA-N 449.891 2.489 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1 1780509763 MFSHJBSMSJQVBR-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1F 1799614283 HTKZUIOQJBCBOB-QDMKHBRRSA-N 435.546 2.246 10 20 IECD COC[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1806154445 FMQXLEUPVGHOGO-BIENSFFJSA-N 432.517 2.330 10 20 IECD Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)s1 1807990666 KAKBPUWHFORTMN-KSSFIOAISA-N 439.497 2.286 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2cccc(F)n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994227 DTGFNPATYBHZBV-VLIAUNLRSA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H](O)c1ccccc1 1817079654 TXCXTMYTPYMTBS-OXQOHEQNSA-N 437.456 2.255 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1cc(O)nc(O)c1 1817848692 XXHYCMOXEPVVRD-BBRMVZONSA-N 429.477 2.339 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccncc1F 1818394736 AJGQOIGHHDXXPB-OAHLLOKOSA-N 426.408 2.370 10 20 IECD O=C(CCCn1ccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822716918 HMHZBEWCYIAYHP-INIZCTEOSA-N 439.476 2.199 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C2=CCCC2)[nH]n1 1823496221 IGOYFQUKFXEYDD-CQSZACIVSA-N 433.559 2.372 10 20 IECD Cc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988943 WWYSDXLRTIVBKF-UHFFFAOYSA-N 438.528 2.300 10 20 IECD CS(=O)(=O)NCCC1=S=C(C(=O)Nc2c(-c3ccco3)nc3ccccn23)C=C1 476408704 RWKYXMLUTMLEOC-UHFFFAOYSA-N 430.511 2.120 10 20 IECD CCOCCCN1CC[C@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)[C@H](C)C1 516592937 TYPJBUUKDMNHFC-XLIONFOSSA-N 428.577 2.356 10 20 IECD COc1ccc(N2CCC(Nc3ccc(S(=O)(=O)N4CCN(C)CC4)cn3)CC2)cc1 726594304 OSTITJSJQFLTFW-UHFFFAOYSA-N 445.589 2.107 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3C3OCCO3)cc2F)C[C@@H](C)O1 728172988 QENMDEBXXWZEEG-FVJLSDCUSA-N 435.540 2.283 10 20 IECD C[C@@H]1COCCN1CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729595109 XALJMRXAOVRVIW-OAHLLOKOSA-N 430.471 2.062 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3O)C[C@H]3CCCO3)nc12 731844529 JKQAYIBRWBMNCE-QGZVFWFLSA-N 426.473 2.498 10 20 IECD C[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)N1CCN(C)CC1 742749127 CVQGIDPDVHQYCW-YLJYHZDGSA-N 433.597 2.071 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccccc3[N+](=O)[O-])cc2)C1 743674062 RPTHITMXRLXDPK-SFHVURJKSA-N 425.489 2.338 10 20 IECD CNS(=O)(=O)C[C@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 749852838 OQNWZQAEKIVZKD-LJQANCHMSA-N 447.557 2.077 10 20 IECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)N1CCC(C(=O)OC)CC1 751468413 VUULIXWQBMCTCM-UHFFFAOYSA-N 435.340 2.106 10 20 IECD CCC1CCC(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)(C(=O)OC)CC1 755990722 RZAVNWBMYAFDOR-UHFFFAOYSA-N 435.540 2.380 10 20 IECD CN1CCC([C@H]2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)CC1 756683380 OBYQCLBOYNTXAX-SFTDATJTSA-N 427.593 2.262 10 20 IECD COc1cc(N2CCN(C(=O)c3cnn(C)c3-n3cccc3)CC2)cc(OC)c1OC 760088648 JXCRDIYBSJKNMI-UHFFFAOYSA-N 425.489 2.199 10 20 IECD Cc1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 765668800 FRJHKEVLAJVZND-UHFFFAOYSA-N 428.963 2.362 10 20 IECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771064863 LEKSRTBHYIUKEY-INIZCTEOSA-N 443.939 2.006 10 20 IECD CCOC(=O)CNC(=O)C1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 771862230 KULJJJPXJLNETP-UHFFFAOYSA-N 440.496 2.220 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1)c1ccc(N2CCOCC2)cc1 774163801 IVFQAGJQPMLVRO-ILHIWHGASA-N 433.505 2.216 10 20 IECD Cn1cc(S(=O)(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)c(=O)n(C)c1=O 776792379 UAPGBXDZVFORKD-UHFFFAOYSA-N 446.432 2.027 10 20 IECD COc1ccc(N2CCCN(C(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 779479669 MSSVXTLGPPBQMT-PMACEKPBSA-N 427.526 2.438 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CN(C)C(=O)c4ccccc43)CC2)cc1 782053868 YTMQUZAZXAIDDO-HSZRJFAPSA-N 436.556 2.193 10 20 IECD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)OCC(=O)c3ccc(O)c(O)c3)nn2)CC1 783354295 CPGRPZMDSTVHLV-UHFFFAOYSA-N 446.460 2.301 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H]1CCCCS1(=O)=O 784216379 RFGUMQACNYDEHF-MRXNPFEDSA-N 449.495 2.309 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCC[C@H]3C3CCC3)CC2)cc1 785526073 BBPWYQGYSLPBLS-QFIPXVFZSA-N 428.577 2.115 10 20 IECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)N(C)c1ccccc1 787634666 CRKLHHPGLCHUIH-QGZVFWFLSA-N 442.535 2.044 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)NCCSC(C)(C)C)CC2)cc(OC)c1OC 788344210 DEPWCOUXMLKBMB-UHFFFAOYSA-N 439.578 2.009 10 20 IECD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 789168610 KMGYMJPNSVGHKV-MJGOQNOKSA-N 442.560 2.262 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)ccc1O 790346838 UMJDHFGMCVZKLM-UHFFFAOYSA-N 428.385 2.259 10 20 IECD Cc1cccc(OC[C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 793803892 YWYYNCUNWKICCU-LJQANCHMSA-N 425.529 2.374 10 20 IECD CCc1[nH]nc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1[N+](=O)[O-] 795613531 LNFGBKDEDHGHOP-UHFFFAOYSA-N 448.391 2.451 10 20 IECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(N2CCOCC2)cc1 803308772 JSLAYSOCSDMORU-INIZCTEOSA-N 428.508 2.222 10 20 IECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 807633603 FOFAHVFYIBZRMQ-QGZVFWFLSA-N 429.492 2.204 10 20 IECD CO[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC[C@@H]1C 807771064 RGIFDVHWOWEWFB-RLFYNMQTSA-N 425.476 2.256 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)S1(=O)=O 811864542 CMTGVKLOHGPDSK-WCVJEAGWSA-N 427.542 2.156 10 20 IECD CCS(=O)(=O)Nc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1C 919817154 PRHWINQKEGPHCS-UHFFFAOYSA-N 427.504 2.086 10 20 IECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)c1ccccc1 1793967588 HHVBMNYTJDGDQK-BASYENTBSA-N 435.546 2.196 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cncc(F)c1 1804285838 WYYDLRRHMUFOTH-KYXSFPASSA-N 427.432 2.303 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc2[nH]ccc2s1 1804333448 NSBYCFRTIAPHDJ-ZSBIGDGJSA-N 448.595 2.342 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806017 HAZULPNLNMMHBQ-HWLIBYHHSA-N 445.903 2.237 10 20 IECD O=C(CC1CCC1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814122987 FHBROOPUIWMFSM-UZLBHIALSA-N 446.598 2.138 10 20 IECD O=C(/C=C/C1CC1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896881 SMALWKFUEWCNAD-DKRLNXSXSA-N 435.615 2.433 10 20 IECD Cc1nc2ccccn2c1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037298 JHKIRWLRRVZGKF-VQHVLOKHSA-N 448.479 2.290 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(CCNC(C)=O)s3)CC2)cc1 726600545 AUCATMWCEQGZSN-UHFFFAOYSA-N 437.587 2.383 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3nnnn3-c3ccccc3)cc2F)C[C@@H](C)O1 730579712 FJLLDMGGAKJODU-IYBDPMFKSA-N 439.495 2.414 10 20 IECD CN(C)c1ccc(CNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F 746798623 ZFBBQCGPUQKERS-UHFFFAOYSA-N 449.548 2.162 10 20 IECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407158 SUEUDASUGFUUMS-QGZVFWFLSA-N 448.499 2.244 10 20 IECD C/C=C(/C)C(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 750895438 IBSOQANIXZAWKA-XUADVIOWSA-N 448.522 2.242 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)c(C(=O)OC)s1 750999720 UQUHEZXEZTVWTE-UHFFFAOYSA-N 438.527 2.400 10 20 IECD Cc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C(=O)N(C)C 751555382 LDODGXOGDUALCO-UHFFFAOYSA-N 444.557 2.253 10 20 IECD COC[C@@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(F)c(F)c1 754170683 XLOSNCZWQGAUCM-WMZHIEFXSA-N 435.515 2.434 10 20 IECD Cc1cccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 756765193 FVDGLDMWYLDLAX-UHFFFAOYSA-N 433.512 2.331 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CNCC3(N4CCSCC4)CCCC3)CC2)cc1 758210312 PJDBGIITBUXCOE-JOCHJYFZSA-N 448.677 2.129 10 20 IECD COc1cc(N2CCN(C(=O)CCNC(=O)Cc3ccccc3)CC2)cc(OC)c1OC 759226095 VEHGMHLYRKLNDI-UHFFFAOYSA-N 441.528 2.110 10 20 IECD Cc1cc(C(=O)CS(=O)(=O)Cc2nnnn2CC(F)(F)F)c(C)n1-c1ccccc1 761619891 MGISIVXHKPMHHH-UHFFFAOYSA-N 441.435 2.441 10 20 IECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n(-c2ccccc2)n1 761871190 JVEDJCMQXFJBLK-UHFFFAOYSA-N 437.475 2.411 10 20 IECD COC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 763505013 OZMIUGXYISVGBY-UHFFFAOYSA-N 447.419 2.052 10 20 IECD CCOC(=O)c1cnn2c(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)ccnc12 764544001 KPGQJDGDGYKMRT-UHFFFAOYSA-N 427.436 2.016 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(N4CCNC4=O)c3)CC2)cc1 778231745 GOSAJHAAHYCDKJ-KTKRTIGZSA-N 449.511 2.068 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3OCCc4ccccc43)CC2)cc1 778275049 GTALUYUQIOICSA-ZXEGGCGDSA-N 435.524 2.330 10 20 IECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785303815 LPLFJGHBHHIQLH-CQSZACIVSA-N 434.514 2.107 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3noc4ccccc34)cc2)CC1 786122091 NGXQZKUMSRMGRY-UHFFFAOYSA-N 428.514 2.116 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cc([C@H]4CCCOC4)nn3C)CC2)cc1 790539881 TUQHXBBJGIQRKF-SFHVURJKSA-N 442.564 2.266 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3(Cc4ccccc4)CC3)cc2)C1 793725651 QYWGSPIIDXGWOC-NRFANRHFSA-N 448.567 2.144 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1F 803663856 CEQGGKKXPAQLGP-UHFFFAOYSA-N 440.519 2.063 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@H]3CCCN(c4ccccc4)C3=O)ccc21 803687855 ILXWYJVLBSHBID-QFIPXVFZSA-N 434.540 2.339 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H](CNC(=O)OC(C)(C)C)C3)ccc21 803688216 MESVARSQKRYNDB-KRWDZBQOSA-N 430.549 2.058 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)CC2)cc1 806334885 XCMYPDNVXOBIQG-NZQKXSOJSA-N 429.609 2.476 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C 807097499 OYVINCFHYRSXNB-VQIMIIECSA-N 432.565 2.439 10 20 IECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807634517 HJBQGRUCUYFHCL-MJGOQNOKSA-N 442.512 2.492 10 20 IECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCc2ccnc(O)c2C1 807769797 VYNMBKDWVKWJAH-HNNXBMFYSA-N 446.454 2.059 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1F 808586971 QQGQNGILXZOJDJ-KRWDZBQOSA-N 432.883 2.083 10 20 IECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 808771323 WWNQXTWTPMXSBQ-VQIMIIECSA-N 432.565 2.473 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCN(c3cc(C)nn3C)C2)cc1 809870896 BRUHGRISDLVEBT-FQEVSTJZSA-N 440.592 2.318 10 20 IECD COc1ccc(CNC(=O)c2ccc(C(=O)NCc3ccc(OC)cc3O)nc2)c(O)c1 813553718 HGZLEQOVAMMHKW-UHFFFAOYSA-N 437.452 2.370 10 20 IECD CC(C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCO2 814330155 AXTNMYOUCARSRU-UHFFFAOYSA-N 430.526 2.244 10 20 IECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)C[C@@H](C)N1C 818626190 NCQRHVPRTVPDSE-OKILXGFUSA-N 448.501 2.266 10 20 IECD COCCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916631517 SYDXRCDUALMDMV-UHFFFAOYSA-N 430.471 2.016 10 20 IECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)s1 917386059 NRPYEGMWAPDBDH-UHFFFAOYSA-N 439.628 2.323 10 20 IECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 917954558 QCMLNVXNJNGWKA-UHFFFAOYSA-N 433.512 2.178 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CCN(c4ccc(C)cn4)CC3)nc12 920613624 KBQZGOZZNGSCEN-UHFFFAOYSA-N 439.472 2.275 10 20 IECD CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 921086729 OOPLMABVYXPENU-AWEZNQCLSA-N 427.523 2.283 10 20 IECD CCOC(=O)C[C@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 1255272835 MCBBSLHBFPIMPL-GOSISDBHSA-N 447.557 2.342 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@H]3c3cccn3C)cc2F)C[C@@H](C)O1 1321602067 HRBGTYFYEMTBTI-PNCHPQGNSA-N 444.551 2.468 10 20 IECD CC1=CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1778110333 QUCKOKXYDSWVGG-MJZLESEISA-N 442.512 2.393 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cn[nH]c2)C3)cc1 1799620429 KDCLGDHPMDXVDT-VTYHHJSWSA-N 433.512 2.334 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2CCNC2=N)C3)cc1 1800513785 VCKVXEDJYWSMLK-QQFNCUIESA-N 448.571 2.186 10 20 IECD CC(C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804081849 YRGVIEAXGVOVQY-QRWLVFNGSA-N 428.489 2.023 10 20 IECD O=C1CSC(=S)N1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CC1)C2 1804334115 ADNRMKHLJUGDSD-BJWYYQGGSA-N 443.594 2.217 10 20 IECD CC(C)(C)OC(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815457523 QUFPXXMYSBTGOM-CQSZACIVSA-N 445.476 2.254 10 20 IECD CC(C)n1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816727313 NNLUUADUJHNILQ-GFCCVEGCSA-N 442.501 2.266 10 20 IECD Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)o1 1827082265 HVINAYVOWXCJHE-LBPRGKRZSA-N 428.470 2.319 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCN([C@@H]4CCN(C)C4=O)CC3)ccc21 579624805 VBOHIIGEPCYGPG-JOCHJYFZSA-N 426.561 2.329 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc(Br)cs2)SC1=S 727177560 LXXWZPXBLSIEJV-WEVVVXLNSA-N 427.392 2.261 10 20 IECD COC(=O)CCc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 729785943 DATYSVSMHBYGFB-QGZVFWFLSA-N 439.512 2.445 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2ccc(Br)cc21 732893767 FCSDIXMVHVQWHY-UHFFFAOYSA-N 444.329 2.491 10 20 IECD O=C(c1nc2ncc(Br)cn2n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520352 YRUZAZYWTWNYMW-AWEZNQCLSA-N 432.278 2.414 10 20 IECD CC(C)NC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738906064 OVLCHVCAGPCZGT-UHFFFAOYSA-N 444.557 2.381 10 20 IECD C[C@H](C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742242850 OZZCUQPULSHRDQ-WEUUYRGXSA-N 425.529 2.186 10 20 IECD CCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 746011389 UVZHEUNJEPCWAW-UHFFFAOYSA-N 435.521 2.015 10 20 IECD Cc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(S(N)(=O)=O)c1C 746280636 RQSUHIBYXDLNEA-UHFFFAOYSA-N 431.558 2.090 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](CN4CCCC4)C3)CC2)cc1 746413453 INCUFYDUVBPTHB-NRFANRHFSA-N 429.609 2.335 10 20 IECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 749406805 QBNHXOSGRLSYDF-INIZCTEOSA-N 449.548 2.078 10 20 IECD C[C@@H](OC(=O)c1cc(C(N)=O)c[nH]1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 750418198 OLBBSDQTUIJPNS-LLVKDONJSA-N 431.404 2.073 10 20 IECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1nnc2n1CCC2 754666059 IBRWABKSNGXABI-AWEZNQCLSA-N 429.480 2.459 10 20 IECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1 756179360 CVSUVVRGBVFMPO-UHFFFAOYSA-N 425.416 2.005 10 20 IECD COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(C[C@@H](C)C[C@H](C)C4)C3=O)CC2)cc1F 757053896 SCUAHYWBTPVGII-HOTGVXAUSA-N 446.523 2.230 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3scnc3Br)CC2)cc1 758151049 JKSGGFGCMBSZTJ-UHFFFAOYSA-N 425.352 2.466 10 20 IECD CC(=O)N1CCN(c2ccc(CNc3ncccc3S(=O)(=O)NC(C)C)cc2)CC1 763026907 AVFWQYWCZNRKKH-UHFFFAOYSA-N 431.562 2.049 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)cc1 766318322 ICAJSWLFOHOUKR-UHFFFAOYSA-N 429.911 2.254 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(-c4ncco4)cc3)CC2)cc1 766576687 SRXHBVANQUNHCW-UHFFFAOYSA-N 449.511 2.227 10 20 IECD CC(C)(CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 769036716 HGIMVIWXJDXKRY-QGZVFWFLSA-N 447.580 2.491 10 20 IECD Cc1nc([C@H]2COCCN2C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 780055136 LDSVIGIBPXSCKA-MRXNPFEDSA-N 448.391 2.275 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2noc(-c3ccc(F)cc3F)n2)c1 781169352 NGCJHBMREHPQIB-UHFFFAOYSA-N 425.369 2.449 10 20 IECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Oc1cccc(F)c1 788312280 GJVOFNMUVMMZOT-FQEVSTJZSA-N 429.492 2.252 10 20 IECD CN(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2n1 788313374 RRLUUNFDJOAHJX-UHFFFAOYSA-N 447.539 2.070 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H](C)N3CCCCC3)cc2F)C[C@@H](C)O1 789823752 FXFCVHZKKZIYTR-OKZBNKHCSA-N 434.556 2.046 10 20 IECD C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832562 AKEHDTDMLZXGJO-OPAMFIHVSA-N 440.519 2.408 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2cccc(F)c2C1 789840426 HPLVMUSOATYPQN-UHFFFAOYSA-N 429.467 2.127 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(=O)C(C)(C)C)cc2)ccc1O 790407068 RVCUHZFYFWLAJU-UHFFFAOYSA-N 426.516 2.330 10 20 IECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCC1 793727075 VOMZLNOWZFPGDA-SFHVURJKSA-N 428.577 2.337 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 793864183 KXMDOHMAODECGM-KRWDZBQOSA-N 441.528 2.077 10 20 IECD CCn1ncnc1COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 801321822 GROALYRCCXRORB-UHFFFAOYSA-N 447.429 2.070 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCc2ncsc2C1 803448339 OOCAPUNRYAPUHZ-UHFFFAOYSA-N 436.484 2.414 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687211 XVXZHOXVZSNOBS-UHFFFAOYSA-N 436.556 2.180 10 20 IECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687786 PPIHSKSTPRLONX-QFBILLFUSA-N 444.576 2.447 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N3C[C@@H](C)[C@@H]3c3ccccc3)CC2)cc1 803751852 XFDZOBKWXHYDMI-AUSIDOKSSA-N 436.556 2.153 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cn(C)nc2C(F)(F)F)cc1F 804852764 GBOSUTNFCUQCKI-UHFFFAOYSA-N 429.418 2.357 10 20 IECD COCCn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(=O)cc1C 806513663 MFVISUFKLDOGJM-IRXDYDNUSA-N 431.508 2.486 10 20 IECD COCC[C@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 813038010 MJSVIRCDWXAOSX-KRWDZBQOSA-N 431.455 2.489 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](O)c1ccc(Cl)cc1F 813416403 PMYHCLKJESVWNT-SFHVURJKSA-N 426.897 2.064 10 20 IECD O=C(CN[C@H](C1CC1)[C@@]1(CO)CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 815289696 JEHXCPYQPLVZJS-RPBOFIJWSA-N 434.492 2.310 10 20 IECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 915194933 LFOWRTVMGHXTKS-KRWDZBQOSA-N 448.317 2.360 10 20 IECD O=C1CC[C@]2(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)SCCN12 916456522 GZHYJWWHSQKWKJ-GOSISDBHSA-N 429.464 2.224 10 20 IECD Cc1cc(=O)oc(C)c1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918919763 QKZLVLDVBANDQX-GASCZTMLSA-N 446.475 2.483 10 20 IECD CN1CCN(c2ccc(CNc3cccc(C(=O)N4CCC[C@H]4CO)n3)cc2F)CC1 1320662540 SHBPDZWMQCYFIR-SFHVURJKSA-N 427.524 2.182 10 20 IECD Cc1ccc(C(=O)Nc2c(Cl)ccc3nonc23)cc1S(=O)(=O)N1CCOCC1 1320947448 YVVOQDVVTCWJDZ-UHFFFAOYSA-N 436.877 2.458 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2nc(CC)cs2)c1 1325763037 MCASPQRVPXAAQA-HNNXBMFYSA-N 430.486 2.207 10 20 IECD COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)s1 1777847529 DNWIXFUPQVFZNG-QVKFZJNVSA-N 447.513 2.004 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2[C@@H]1O)c1cc(O)nc(O)c1 1793181603 YQFTYKGGDPWEAK-UGPLMPIKSA-N 437.496 2.041 10 20 IECD Cc1nn[nH]c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1795979983 KJHWPSLNTVAIQU-HATOLVCRSA-N 448.527 2.038 10 20 IECD Cc1nscc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991732 SNTBEJAAHUGXEC-AUUYWEPGSA-N 439.497 2.286 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cccn3cn2)[nH]n1)c1cc(O)nc(O)c1 1817845569 PEJLQCRXVGMMBY-KRWDZBQOSA-N 447.455 2.483 10 20 IECD COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)cc1 1822217784 PFZQGPZNDNBCHL-ZDUSSCGKSA-N 440.481 2.498 10 20 IECD C[C@@H](Cc1ccccn1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846522486 PHVSCGOXDLFWJG-SFHVURJKSA-N 445.523 2.257 10 20 IECD O=C(c1ccc2c[nH]nc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039180 VAGVOQHPMAQPLN-FNORWQNLSA-N 434.452 2.210 10 20 IECD O=C(CSc1nnnn1C[C@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 16409604 HGUWWLLYZMWWQG-CYBMUJFWSA-N 449.492 2.358 10 20 IECD COC(=O)c1cc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc(C(=O)OC)c1 105169474 MOLAIBKUSLSOMN-UHFFFAOYSA-N 441.484 2.029 10 20 IECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN([C@@H](C)C(=O)NC4CC4)CC3)ccc21 484907449 SBXYPFDMQWVGTJ-SFHVURJKSA-N 426.561 2.329 10 20 IECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3cc(C)on3)CC2)c1 732524550 ICUUVVXLCVERNK-UHFFFAOYSA-N 428.533 2.041 10 20 IECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1=O 735517205 HSTZHIUZGQGPCI-PWRODBHTSA-N 429.561 2.233 10 20 IECD Cc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(Cl)c1 737246128 UOWXKYMLMCLDHG-UHFFFAOYSA-N 449.960 2.447 10 20 IECD O=C(NCCNC(=O)c1cccnc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745491220 IOOURWHSZBGUQC-MRXNPFEDSA-N 433.459 2.381 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 754080957 HCLRPWPWNPFJCN-PZJWPPBQSA-N 440.592 2.053 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 754140345 MXHMCZWRDWQYEX-GCJKJVERSA-N 438.572 2.048 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](c3nc(C4CC4)no3)C(C)C)CC2)cc1 754181621 DXGFRBJVRUQKJN-CTNGQTDRSA-N 429.565 2.425 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnc2nccnc2c1 758998807 ZBAQATDHUAHURW-UHFFFAOYSA-N 444.474 2.211 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)CC2)cc(OC)c1OC 759221886 RQGFVLKEQMCBKE-QGZVFWFLSA-N 431.533 2.010 10 20 IECD C[C@H]1CCCN(C(=O)C2CCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)C1 759587900 FSYAMJCVRGUOIV-WRLNGNIRSA-N 430.501 2.151 10 20 IECD COCCO[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 760965379 JVNGPRPRQOFARX-CMKODMSKSA-N 437.556 2.183 10 20 IECD CN(C)CCN(CC(=O)O)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 769451482 KAQUMGVYAJKLFY-KAMYIIQDSA-N 441.600 2.204 10 20 IECD CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 769934262 QSEDMTZKNYRNGD-LBPRGKRZSA-N 426.495 2.153 10 20 IECD CN(C)c1ccc(CNS(=O)(=O)c2cc(C(=O)NCC(F)(F)F)n(C)c2)cc1F 775700610 GHGUFDWTGMDAOS-UHFFFAOYSA-N 436.431 2.001 10 20 IECD O=C(N[C@H]1CCCOCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 776496694 CTDGZKUDIFURLH-ZDUSSCGKSA-N 435.458 2.400 10 20 IECD CCOC(=O)CC1CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778239942 XQMNBTXONKOZOB-CMDGGOBGSA-N 443.544 2.092 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@@H](O)Cc3ccccc3)CC2)cc1 778391195 KHHKJRVDQPUXKX-VKIUOOOBSA-N 437.540 2.008 10 20 IECD C[C@H](NC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(N2CCOCC2)cc1 779503481 QBPAHCOZQYHRTF-GKCIPKSASA-N 427.526 2.405 10 20 IECD O=C(COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(O)c(O)c1 782564877 KZBRKXMIOVVDIW-AWEZNQCLSA-N 437.445 2.064 10 20 IECD O=C1Cc2cc(NC(=O)C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc2N1 784767514 OSXBCVCUOFMKGG-KRWDZBQOSA-N 442.903 2.260 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nn(-c4ccccc4)c(C)cc3=O)cc2)CC1 786656039 JPXMZDUCCAJNNH-UHFFFAOYSA-N 445.523 2.139 10 20 IECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1C(=O)N1CCOCC1 787453968 DHDQEEOLYGBRNQ-UHFFFAOYSA-N 438.528 2.131 10 20 IECD C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 787916639 XSKPXEVJTYDVCT-WOJBJXKFSA-N 430.593 2.014 10 20 IECD COc1cc(OC)c(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1 790111037 KKRWLHGSIRUTPJ-UHFFFAOYSA-N 425.485 2.021 10 20 IECD Cc1ccn(C[C@](C)(O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(=O)c1 790626305 DCCQFJCJQFXTSS-QFIPXVFZSA-N 435.471 2.294 10 20 IECD Cc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 790835056 IKCHMIJKKUJDQI-KRWDZBQOSA-N 446.529 2.392 10 20 IECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c(C)[nH]c2ccnn2c1=O 791245557 BKIQHONDTGCDNG-UHFFFAOYSA-N 439.516 2.262 10 20 IECD CN(C)S(=O)(=O)c1ccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nc1 797652801 PSGAHQMUBUPBOK-MRXNPFEDSA-N 434.518 2.251 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)c1 799673520 FZBMODWCVQFDPD-LLVKDONJSA-N 429.445 2.018 10 20 IECD COC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(F)c(F)c1 803297683 CWENCRVGCGJJBK-YCRPNKLZSA-N 447.482 2.483 10 20 IECD COCCN(CCc1ccccc1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803304043 CGINQYFKMBPQOF-FQEVSTJZSA-N 439.556 2.418 10 20 IECD CC(C)[C@@H]1CN(C)CCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449408 YVNYHQKYGAELEU-IBGZPJMESA-N 438.519 2.172 10 20 IECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688465 RPFKSKILLTYHQG-UHFFFAOYSA-N 433.512 2.383 10 20 IECD COCC(C)(C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 813598832 JOQFWPAMGLYWPT-UHFFFAOYSA-N 430.528 2.414 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3ccc(CC(=O)N4CCOCC4)cc3)CC2)cc1 915698949 KKVMZHYFKIGHTB-UHFFFAOYSA-N 438.528 2.451 10 20 IECD CC(=O)Nc1cccc2c1CCN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 917417965 PWWQWNHEQJIIFU-UHFFFAOYSA-N 440.519 2.295 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)C[C@@H](C)O1 917710827 XSJIQAABVWYRRU-SCTDSRPQSA-N 440.519 2.499 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H]1CN(Cc2ccccc2)CCO1 918179398 PJXJZXXDTYFHFJ-NRFANRHFSA-N 442.535 2.363 10 20 IECD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918438558 HKGGCYWXDVLKGI-UHFFFAOYSA-N 430.436 2.258 10 20 IECD CCN(CC)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 918442849 RBSUFNQONTVGQH-UHFFFAOYSA-N 439.560 2.391 10 20 IECD NC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 919855216 KHESKNHJDZPIMZ-UHFFFAOYSA-N 449.490 2.363 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2 1782007824 QGLHTOTVKKNLJA-HNAYVOBHSA-N 426.922 2.090 10 20 IECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603434 LCDLGYKFRHWEKI-QKPAOTATSA-N 448.520 2.048 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nncn2c1)c1cc(O)c(O)c(Cl)c1 1798124653 CJLSJWGVUUWJQW-QDMKHBRRSA-N 441.875 2.360 10 20 IECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)nc1C 1799767527 WBHPIUIDWRHTDF-CCWDJLKJSA-N 445.903 2.280 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993920 RBRBPZUISBETES-KSFYIVLOSA-N 436.468 2.433 10 20 IECD Cc1nccn1[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429056 ODPDQSKCWZNXLT-HNAYVOBHSA-N 441.532 2.492 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cnnc3ccccc23)C1 1843679442 HPZLFCXENUZAAE-VQHVLOKHSA-N 446.463 2.277 10 20 IECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 18150691 PTAIOADNLFKCFS-UHFFFAOYSA-N 434.562 2.417 10 20 IECD O=C(CCNS(=O)(=O)c1ccccc1Cl)NCc1ccc(N2CCOCC2)cc1 108807992 MKSAVLJEUKTJKN-UHFFFAOYSA-N 437.949 2.161 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc(C(=O)NC2CC2)cc1 738891031 VVCRCEWJJOUUTQ-UHFFFAOYSA-N 442.541 2.135 10 20 IECD CCOC(=O)COc1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 742361355 CCJRUOYMSYOLNC-UHFFFAOYSA-N 428.485 2.365 10 20 IECD O=C(CSc1ncc[nH]1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 742455811 WHHQWBUVOOTLQQ-RIYZIHGNSA-N 448.551 2.248 10 20 IECD Cc1ccc(-n2[nH]c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2=O)cc1 746148346 WKBYYSDLIYAYHP-GOSISDBHSA-N 433.512 2.106 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(-c4ccccn4)nc3O)cc2)C1 746837136 ZDZXBQSNFUCIMH-QGZVFWFLSA-N 431.496 2.481 10 20 IECD NC(=O)c1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)s1 748964146 AFNUVAGDWDPMOA-UHFFFAOYSA-N 434.429 2.418 10 20 IECD O=C(CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 749515635 NEYIBVOWROAJDD-SIKLNZKXSA-N 430.568 2.227 10 20 IECD O=C(NC[C@@H](O)COc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065340 OZIPLZKSPHLJAV-OAHLLOKOSA-N 448.522 2.424 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](OCC(F)(F)F)C3)CC2)cc1 754043143 PVXGDTAVVYGRNV-UYAOXDASSA-N 431.499 2.221 10 20 IECD COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754068191 RZSIIGZJESWWEW-JTHBVZDNSA-N 427.545 2.024 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1nnc2n1CCC2 754666060 IBRWABKSNGXABI-CQSZACIVSA-N 429.480 2.459 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1 769938637 ZMANKNLRVGZCKV-KRWDZBQOSA-N 431.514 2.188 10 20 IECD Cc1cc(Br)ncc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 774168418 XEXATAYAPCLQFZ-UHFFFAOYSA-N 433.306 2.244 10 20 IECD Cc1cc(Br)cc(CNCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1O 776175819 SXDQCBFEALSEBB-UHFFFAOYSA-N 444.307 2.439 10 20 IECD COCCO[C@@H]1COCC[C@@H]1NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 776942854 NWPNAKNTCAUOMP-AYOQOUSVSA-N 443.491 2.377 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3(c4noc(C)n4)CCCC3)CC2)cc1 778242098 QXXAUNZDHIZPPD-MDZDMXLPSA-N 439.516 2.177 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)N3CCC(C)CC3)CC2)cc1 778249882 FVRXRXCVNMPOEC-IBDYFIJFSA-N 428.577 2.137 10 20 IECD COC(=O)CCC1CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778318784 UKHHRSHMZQMIST-HJWRWDBZSA-N 443.544 2.092 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccccc3CO)cc2F)C[C@@H](C)O1 787065919 JBNKSLSRGPQLMJ-CALCHBBNSA-N 444.503 2.334 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1nc2c(s1)CCCC2 789378334 OXTGUUJKQMPGJN-UHFFFAOYSA-N 428.558 2.486 10 20 IECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)O2 789861069 PLGRLSUODFCRHO-WEQDKIBNSA-N 447.601 2.294 10 20 IECD CN(Cc1ccc(Cl)s1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793721826 JMDNKTNQEGZILH-HNNXBMFYSA-N 448.976 2.378 10 20 IECD CCN(CC)[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 793844402 MRZAVMDGIXKQPM-GHTZIAJQSA-N 442.560 2.493 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@@H]1COC(=O)N[C@@H]1CCOC1 796529326 GYMQZEZRTRDQBE-TZIWHRDSSA-N 432.565 2.081 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)n3cccn3)c2)c(O)c1 797390830 VDLKCOZSDIJICF-AWEZNQCLSA-N 437.456 2.052 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1 804009142 QWMXSXZRWWZKOS-UHFFFAOYSA-N 443.636 2.166 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(Cc4ccsc4)CC3)CC2)cc1 804315626 OBFXRCFSOCNLDY-UHFFFAOYSA-N 442.585 2.186 10 20 IECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(O)c(C(=O)O)c3)cc2F)C[C@H](C)O1 917918652 RNLNANHOFSODKW-STQMWFEESA-N 438.477 2.322 10 20 IECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1ccc(CNC(N)=O)cc1 920265643 OIAHLOAQQJXHIC-UHFFFAOYSA-N 432.527 2.443 10 20 IECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)c(F)c1)C2)c1cc(O)nc(O)c1 1777852696 PMHYGHFDTVAIMP-VGOFRKELSA-N 447.438 2.212 10 20 IECD CCC1(C(=O)Nc2ccc(C3(NC(=O)CN4C(=O)CSC4=S)CCC3)cc2)COC1 1791175343 VLTZQCHMXAFKKT-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nc1 1805867233 DWMJIONHQQLCRR-KKSFZXQISA-N 433.468 2.225 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993173 FGAVWODDBGSDAE-YWZLYKJASA-N 437.431 2.055 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(F)nc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994510 HILUWBOMMKPIJM-VLIAUNLRSA-N 437.431 2.055 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1cc(O)nc(O)c1 1817846457 YURIDSFFIVSRNA-CQSZACIVSA-N 426.408 2.370 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)[C@H]1CCCO1 1819701902 SNYPQYGHWJYXCP-KYZJMWGYSA-N 442.472 2.411 10 20 IECD Cn1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1Cl 1820008717 YRXCTGKBHDBESO-CYBMUJFWSA-N 445.867 2.223 10 20 IECD CN1CCCC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424268 VMXDGDVZCAOZKG-RBUKOAKNSA-N 430.549 2.210 10 20 IECD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc(Cl)cc1[N+](=O)[O-] 1843250609 QVKNWUGITHIBEL-UHFFFAOYSA-N 446.847 2.494 10 20 IECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nc1 1847034036 WLSYLEIEJJGMQQ-WEVVVXLNSA-N 437.496 2.356 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1 3555565 NANTVKPQWLNQOH-UHFFFAOYSA-N 433.892 2.445 10 20 IECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccoc4C)n3N)CC2)cc1 23880469 NWDHFCUWZDEYAE-UHFFFAOYSA-N 428.518 2.010 10 20 IECD C[C@H](NC(=O)NCc1cccnc1N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 725867239 XDCOUJGYYHLYOP-IBGZPJMESA-N 438.576 2.230 10 20 IECD O=C(CN1CCO[C@@H](c2cccc(F)c2)C1)NCc1ccc(N2CCOCC2)c(F)c1 727434103 FALCHYYIZLNDDN-JOCHJYFZSA-N 431.483 2.491 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1 728943691 BNDDRGDUKIYEDP-LBPRGKRZSA-N 427.910 2.393 10 20 IECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N2CCSCC2)cc1 729285834 OQIMOWOEZCQXIY-HXUWFJFHSA-N 437.573 2.144 10 20 IECD COC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 734524419 BEIVTTIHKCQARD-UHFFFAOYSA-N 431.464 2.214 10 20 IECD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)C1 740919532 ZXSGSLFYWNLBKB-NHCUHLMSSA-N 439.604 2.395 10 20 IECD CCOC(=O)c1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nc1C 742920740 RUIFUTMZHCNJLZ-UHFFFAOYSA-N 426.517 2.127 10 20 IECD Cc1c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n(-c2ccccc2)n1C 743958144 NJMYBKCTLUWRJT-UHFFFAOYSA-N 434.496 2.324 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@H](O)COCC1CC1 749009603 GOMYIADGWXRHMW-KRWDZBQOSA-N 431.455 2.129 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 751097199 HYBKDIZHLGDYRA-YSIASYRMSA-N 428.577 2.289 10 20 IECD COc1ccc(N2CCN(C(=O)NCc3ccnc(N4CCN(C)CC4)c3)CC2)cc1F 753847036 UWOUUJZILFASOG-UHFFFAOYSA-N 442.539 2.013 10 20 IECD COc1cc(N2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)cc(OC)c1OC 759886162 IURSEWMMYLWTQI-UHFFFAOYSA-N 430.461 2.042 10 20 IECD Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 773231132 ASKCUFYHDJLKBO-SFHVURJKSA-N 431.558 2.493 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1 774273312 BWNBDULJOQJOFQ-OAQYLSRUSA-N 431.558 2.451 10 20 IECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccc(F)cc4)CC3)cc2)CC1 775645464 AILNNOBQSNUXQV-UHFFFAOYSA-N 425.552 2.334 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCCc4nc(O)ccc43)CC2)cc1 778224146 RJJQIEQCESJXOB-RJRNSMGGSA-N 436.512 2.194 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3ccccc3Cl)CC2)cc1 778327851 HEHSZIYWFCZSFK-KUFMOJEASA-N 443.931 2.403 10 20 IECD Cn1cc([C@H](CO)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 778401653 DKAPGLUIKRYRBF-QDECMSLZSA-N 436.584 2.313 10 20 IECD CCOCc1cc(CNC2CN(S(=O)(=O)c3ccc4c(c3)OCCO4)C2)ccc1OC 779177691 GDANIAHOLHDKAW-UHFFFAOYSA-N 448.541 2.166 10 20 IECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781441152 RYBIWSFQZFUXAT-UHFFFAOYSA-N 447.438 2.233 10 20 IECD COC(=O)[C@@H]1[C@@H](O)CCCN1CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 781959313 UTJBNEFWQYSINA-AVRDEDQJSA-N 428.485 2.046 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)cc1 785424696 LLFZELBKLMTNAN-OAQYLSRUSA-N 444.963 2.212 10 20 IECD CC(C)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)N1CCOCC1 786462439 IZBQSEOJBRMDDE-QFIPXVFZSA-N 430.593 2.108 10 20 IECD CCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 787207868 GOEAQFRISLQBGT-UHFFFAOYSA-N 429.492 2.384 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3sc4nc(C)nc(N)c4c3C)cc2)CC1 787320088 RLKNWBGZHGUYPQ-UHFFFAOYSA-N 438.557 2.489 10 20 IECD COCn1nc(C)c(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 788631418 PUFVUNWAKYBBHG-KRWDZBQOSA-N 442.969 2.406 10 20 IECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788912804 YMWIRGDHCFQGFN-KRWDZBQOSA-N 430.549 2.276 10 20 IECD CCOc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789798844 DTHCXDMIKJMDRJ-UHFFFAOYSA-N 429.492 2.336 10 20 IECD CCc1cnc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789826239 PHVDSEZCZUGATO-GASCZTMLSA-N 448.564 2.433 10 20 IECD CN(CCOCC1CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951606 WYGQWUJNLZFZDY-UHFFFAOYSA-N 443.466 2.043 10 20 IECD CCCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793723819 NLTIVXMZWYGHLD-NRFANRHFSA-N 436.556 2.443 10 20 IECD Cc1nccn1-c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 793899738 QLEBXEXIWTZXOZ-UHFFFAOYSA-N 427.455 2.458 10 20 IECD O=C(CN1CCC[C@@H](CN2CCOCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 800477966 PDNZMALKTRRWTB-SFHVURJKSA-N 447.535 2.445 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)N3CCc4cc(F)ccc43)CC2)cc(OC)c1OC 802565791 LCEQZOCJFZCUKG-UHFFFAOYSA-N 443.475 2.089 10 20 IECD CS(=O)(=O)c1ccc(C(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)cn1 803225370 BHKCVBBDEPZMLI-UHFFFAOYSA-N 449.440 2.300 10 20 IECD CN(c1ccc(CNC(=O)C(=O)N2CCN(C[C@@H]3CCCO3)CC2)cc1)C1CCCCC1 803676467 JMGYDYAHZLZSDB-QHCPKHFHSA-N 442.604 2.395 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1 806087358 DUFPUGMYOPAVCK-YADHBBJMSA-N 430.593 2.251 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H]([C@H]2CCOC2)C1 807769651 ICMKWBHDPPJCSN-YESZJQIVSA-N 437.487 2.258 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc(F)c(F)c1F 808359829 MBQDHBHXZVKDBX-UHFFFAOYSA-N 435.446 2.258 10 20 IECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@@H](C)S1(=O)=O 811864952 QEGZSSMBTUOQDQ-OKILXGFUSA-N 449.495 2.259 10 20 IECD CNS(=O)(=O)c1ccc(CCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917384050 RLZAJDOSHLKHGN-UHFFFAOYSA-N 433.599 2.397 10 20 IECD CC1CCC2(CC1)NC(=O)N(NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1)C2=O 917416956 DXYLXQJQJKZIFP-UHFFFAOYSA-N 427.549 2.249 10 20 IECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 917714946 XCSOIEKVMXFVBR-HOTGVXAUSA-N 441.569 2.117 10 20 IECD Cc1cc(C)n([C@@H](C)CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 919314673 KUTVJCUULUFIIA-KRWDZBQOSA-N 432.496 2.286 10 20 IECD COCCOCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 920710783 PKWYARYPTGASLE-AWEZNQCLSA-N 425.437 2.385 10 20 IECD COc1ccc([C@@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N2CCCC2)cc1 920979846 KCJCWRKRVIPTNO-TVNWYLLRSA-N 430.574 2.205 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4nnc(C(F)F)n4c3)cc2)CC1 1256348427 YOZBSRXZSRTJQZ-UHFFFAOYSA-N 428.443 2.265 10 20 IECD O=C(Cc1ccccc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782001866 NMPWJOZKIAOQFR-QFIPXVFZSA-N 430.888 2.437 10 20 IECD Cc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790242171 QUBGPEAYQGDBCZ-AXHNFQJDSA-N 445.903 2.362 10 20 IECD O=Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)s1 1815370990 DFUJJEMUMGFCIS-JTQLQIEISA-N 444.494 2.363 10 20 IECD COCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1826448847 MDZFEQFUZICYOS-FQEVSTJZSA-N 426.517 2.045 10 20 IECD CCC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429258 QXKFQOHEPWRKDO-OALUTQOASA-N 446.548 2.031 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CNc2ccc(F)cc2)C1 1842887779 FDBREZYRXIKFQW-YCRREMRBSA-N 441.459 2.271 10 20 IECD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847544240 OIBJXIFSCMPSHY-GJZGRUSLSA-N 446.847 2.113 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)NC(=O)c3cccs3)CC2)cc1 28839851 BSBPPBACKCEGGU-QGZVFWFLSA-N 430.574 2.204 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)NC[C@](C)(O)c3ccsc3)CC2)cc1 303842268 JEIHKHIUYCLAHA-QFIPXVFZSA-N 432.590 2.476 10 20 IECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1 581207399 KISZQVKECROEIV-UHFFFAOYSA-N 439.559 2.029 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C3=Cc4cccc(OC)c4OC3)CC2)cc1 725976696 MBXBMFTXLUHXEX-UHFFFAOYSA-N 438.480 2.372 10 20 IECD CC(C)CN1C(=O)/C(=C/Nc2ccccc2C(=O)NCC(F)(F)F)C(=O)NC1=S 730998912 OIXKLHNUBDKDQQ-KPKJPENVSA-N 428.436 2.174 10 20 IECD C[C@H](NC(=O)Nc1ccc(CNS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 735577024 NFXGZMXCQFBJSV-INIZCTEOSA-N 432.546 2.455 10 20 IECD Cc1cc(C(=O)CN2CCc3nn(C)c(=O)cc3C2)c(C)n1-c1ccc2c(c1)OCCO2 742428693 JKXKCCYKKKUVIO-UHFFFAOYSA-N 434.496 2.200 10 20 IECD CC1CCN(c2ccc(CNC(=O)Nc3cnn(CC(=O)N4CCOCC4)c3)cc2)CC1 747569799 GKRXVNDNLVISBM-UHFFFAOYSA-N 440.548 2.300 10 20 IECD CNS(=O)(=O)[C@H]1CCN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)C1 749589464 IGBKBFDDUQJYPJ-OALUTQOASA-N 441.513 2.357 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cc1C 751273805 XKXBVNNEIKINSE-UHFFFAOYSA-N 446.478 2.160 10 20 IECD C[C@@]1(CO)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760093993 CEAPTJXRZZHLPN-IBGZPJMESA-N 435.458 2.088 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)CC2)cc1 764391574 ZFIYZSGNNZXCHU-AUSIDOKSSA-N 429.609 2.331 10 20 IECD O=S(=O)(c1ccc(NC(=S)NCc2ccc3c(n2)CCCC3)cc1)N1CCOCC1 766512349 LFALBAGLYVMCAB-UHFFFAOYSA-N 446.598 2.468 10 20 IECD CCn1c(=O)oc2cc(S(=O)(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc21 767736648 KVFFMFMROQKGJN-HNNXBMFYSA-N 431.514 2.491 10 20 IECD CCc1ccc(O[C@@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc1 768446456 KJDYAHQRWYAQJU-KSFYIVLOSA-N 426.513 2.492 10 20 IECD CN(Cc1ccccc1O)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1 769281255 UVHJDXFDJUOCTC-KRWDZBQOSA-N 438.933 2.237 10 20 IECD COCCCN(CCc1ccc(OC)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769862864 FKUQDHUASSWZDT-UHFFFAOYSA-N 436.530 2.494 10 20 IECD CC(C)N(C)Cc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 787160496 WRVIFEOHWJUMNH-UHFFFAOYSA-N 438.572 2.296 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCCN3CCC(C)CC3)CC2)cc1 787896102 SPKYFMSBBNSVQU-UHFFFAOYSA-N 430.593 2.409 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 788812273 BKWQCWDSMFSHFN-NRFANRHFSA-N 436.556 2.124 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797962 AAIUWIIQGRKIFY-UHFFFAOYSA-N 442.535 2.393 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cc2F)C[C@@H](C)O1 789824578 JIIJRYVEXCVNJJ-USPHFKCKSA-N 433.524 2.129 10 20 IECD CC(C)(C)c1cc(CS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)no1 790161961 IZRGXBXAZWVHPD-MRXNPFEDSA-N 434.562 2.293 10 20 IECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1nc(C)cs1 793721173 QHVVADPRBDQGBZ-AEFFLSMTSA-N 443.573 2.037 10 20 IECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc1 797432868 WQQRRHNFJWEJCL-UHFFFAOYSA-N 440.547 2.348 10 20 IECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O2 803301893 BJTTWMBDAIGRNL-UIWQWBILSA-N 445.560 2.138 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@](C)(CNC(=O)OC(C)(C)C)C3)ccc21 803687335 KPJJUTUDOSQHSB-XMMPIXPASA-N 444.576 2.449 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](OCC4CC4)C3)cc2F)CC1 805007695 XLGWWCJNKIOGPE-HXUWFJFHSA-N 446.567 2.001 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3C[C@H](C)O[C@@H](C)C3)cc2)CC1 805023890 MVVLRKLARRZFNY-PMACEKPBSA-N 430.593 2.155 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(C[C@@H]2CCOC2)CC1 807102591 JKZLMBGJSBQYRU-NRFANRHFSA-N 442.604 2.252 10 20 IECD CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1 807513215 UTMJVFDRLXWJJI-UHFFFAOYSA-N 443.287 2.449 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)Oc3ccc(F)cc3)CC2)cc1 807633244 VSDGFYQHSCICGY-KRWDZBQOSA-N 429.492 2.457 10 20 IECD O=C(C[C@@H]1CCCS(=O)(=O)C1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 815044258 AIRVBLJJHJGNFS-AWEZNQCLSA-N 434.480 2.373 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCCCN3CCCC3)CC2)cc1 818336647 CODULTCJHRQIQY-VAWYXSNFSA-N 428.577 2.282 10 20 IECD O=C(O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Cl)c1 871824118 WJYQDBFVDBNVPY-UHFFFAOYSA-N 428.869 2.492 10 20 IECD CC(C)CN1C[C@H](C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914676173 MPHIHMAOGCBFPX-OAHLLOKOSA-N 448.475 2.448 10 20 IECD O=C(CN1CCN(Cc2ccsc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 916972729 QHNZRBUEUIHHLE-UHFFFAOYSA-N 432.565 2.158 10 20 IECD C[C@H](NC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 920867473 VEMNYJZSNGIAIZ-KRWDZBQOSA-N 446.573 2.334 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1317894888 KTZFZKFODLFDQB-UHFFFAOYSA-N 436.505 2.151 10 20 IECD C[C@H]1C[C@@]1(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1780622276 JUFVMGQFGBSNNL-WYIYNHIUSA-N 444.528 2.377 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1 1781680598 NIQQVIGPPPGADT-HXUWFJFHSA-N 435.839 2.043 10 20 IECD Cc1cc(/C=C/C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)no1 1819937764 YFRPWKGJUUBMIV-OGOUPESXSA-N 441.469 2.185 10 20 IECD C[C@@H](Nc1cccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842925732 YGDKWAYSBHZXHO-CYBMUJFWSA-N 430.892 2.464 10 20 IECD C[C@H](NC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O)c1ccc(N2CCOCC2)cc1 109180435 OGGMBSBGTKJRST-HKARXFIJSA-N 428.533 2.201 10 20 IECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 726098937 VFQXCGPIVWXFCR-HKUYNNGSSA-N 434.606 2.313 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(N3CCCCC3)cc2)SC1=S 727177803 NZLKQULNTPVAEK-SSZFMOIBSA-N 425.601 2.427 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)c1 728949905 VZCFOPWSPKKCBK-AWEZNQCLSA-N 431.489 2.437 10 20 IECD Cc1cc(C(=O)NCCS(=O)(=O)NC[C@@H]2CCCCO2)c(C)n1-c1ccc(F)cc1 732163893 OQXMOTPRQLVXCI-IBGZPJMESA-N 437.537 2.452 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)OC)c2)cc1C 739671037 RFAGNESVUXCGNL-UHFFFAOYSA-N 442.515 2.353 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOc2ccc(OC)cc2)cc1OC 742028095 QNPKQWBIALTLEA-UHFFFAOYSA-N 444.531 2.286 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc(NC(C)=O)c3)CC2)cc1 742948109 MMKXHKXUMWZWMG-UHFFFAOYSA-N 425.533 2.275 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)NC(=O)[C@H](C)O4)CC2)cc1 743287442 IUJLRFYQGQTNQP-INIZCTEOSA-N 439.516 2.358 10 20 IECD C[C@@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2NC1=O 745986806 DZRYUMFULBPZFO-MRXNPFEDSA-N 426.492 2.373 10 20 IECD CN(C)c1ccc(CNC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1F 746976070 VBLZKPKWRMQFPB-UHFFFAOYSA-N 438.500 2.247 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1 748861877 GZDBSUGRXMTWJJ-UHFFFAOYSA-N 445.541 2.312 10 20 IECD CC(C)N(CCN(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749175208 HLVLFDZEJQYDCI-UHFFFAOYSA-N 443.571 2.424 10 20 IECD COC(=O)c1c(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n[nH]c1C 751455255 AJHKQOFXKHJOTC-GFCCVEGCSA-N 444.460 2.053 10 20 IECD COc1ccc(N2CCC(NCCNS(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 765403956 YENXIXXJQXQDKW-UHFFFAOYSA-N 434.518 2.140 10 20 IECD COC(=O)C1(O)CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 769971239 SAXGTCXYGPFINO-UHFFFAOYSA-N 428.485 2.048 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3COc4ccccc4C3)CC2)cc1 778220776 CLFPATFAOUBFBT-VYENPZKTSA-N 435.524 2.268 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](C4CCN(C)CC4)C3)CC2)cc1 778393967 CBXZLOCORJFIOR-GIWCCYDRSA-N 440.588 2.090 10 20 IECD O=S(=O)(c1ccccc1Cn1cncn1)N(Cc1ccccc1O)C[C@H]1CCCO1 781399801 HNVGXMGXYODOPN-LJQANCHMSA-N 428.514 2.402 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CC3CCC4(CC3)OCCO4)CC2)cc1 788171917 VPMDONNGDDAKIN-UHFFFAOYSA-N 432.517 2.210 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)cc1 788950044 CNELCGNSPMHWGP-UHFFFAOYSA-N 427.549 2.098 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 795913962 FOXKDCABOXBHIY-MRXNPFEDSA-N 434.514 2.284 10 20 IECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCS(C)(=O)=O 802445645 SZDFPEFVNXOXQB-UHFFFAOYSA-N 431.562 2.480 10 20 IECD C[C@H](NC(=O)C(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccc(N2CCOCC2)cc1 803303893 VTONDHHQWMGJRH-YDWJEQILSA-N 440.588 2.033 10 20 IECD C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665384 ZWGKIOSIIPRXSP-ZBFHGGJFSA-N 436.528 2.412 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@H]3c3ccc(C)o3)CC2)cc1 804317411 CCMQQMLWQUAFCH-FQEVSTJZSA-N 427.501 2.282 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOC[C@@H]1[C@@H]1CCCO1 804395414 RRPZKGMAAPJHRN-WBVHZDCISA-N 438.527 2.275 10 20 IECD COC1CCN(C(C)(C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 805157836 VLGPYQANLGSKJL-UHFFFAOYSA-N 430.593 2.249 10 20 IECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387012 VCBPVNJHCKWCIT-UHFFFAOYSA-N 443.200 2.474 10 20 IECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)c(C)c1 917371596 JLRRPVCNMMMVQN-UHFFFAOYSA-N 432.542 2.474 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCCN3C(=O)c3ccco3)cc2)C1 918659671 REVLMFJDEUSKBV-AZUAARDMSA-N 438.528 2.292 10 20 IECD CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 920345300 GAFFTUJOUBBFIO-RTBURBONSA-N 428.577 2.289 10 20 IECD COC(=O)c1ccc(C)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920927335 UHMYMUDRKKVCOH-INIZCTEOSA-N 425.485 2.434 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-n4cnnc4)c3)CC2)cc1 1348241897 PJIISCRGMKXLJH-KTKRTIGZSA-N 432.484 2.119 10 20 IECD CCc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)co1 1782007161 LFDRCLDRWSFECK-HXUWFJFHSA-N 435.864 2.059 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)C(F)F 1806438760 JDNARMXSJAXVCX-HMHLKJFASA-N 433.411 2.183 10 20 IECD CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)nn1C 1827428267 LNLSEZQYCRDUEX-IBGZPJMESA-N 441.532 2.336 10 20 IECD O=C(c1ncon1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877023 QXFFTTPDYYEBDZ-YERXGYGTSA-N 442.472 2.133 10 20 IECD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846343522 LRSVQNNFEGEAKS-LSDHHAIUSA-N 448.903 2.324 10 20 IECD COc1ccsc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038898 UGQXBLPNCFIKHX-GQCTYLIASA-N 430.482 2.404 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1 1847607469 RIMAPZAIKOGCAO-KNCCTNLNSA-N 429.423 2.390 10 20 IECD COc1ccc(N2CCC(NC(=O)c3nc(S(C)(=O)=O)n4ccccc34)CC2)cc1 726562940 RDVHBMDIOLPRPI-UHFFFAOYSA-N 428.514 2.145 10 20 IECD CN(C)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 728140189 VWKAHSDEMLMRRX-UHFFFAOYSA-N 438.572 2.254 10 20 IECD CCN(CC)c1ccc(CNC(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 737507183 CBJOUEBBBJYWPF-UHFFFAOYSA-N 434.518 2.378 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cc4ccccc4[nH]3)cc2F)CC1 742645242 NKFVKBIRRREHNZ-UHFFFAOYSA-N 437.519 2.495 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1 743890353 XJJJZTWQGRPRTP-UHFFFAOYSA-N 437.479 2.342 10 20 IECD CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)c2ccccc2O1 750351126 BETVSPSSGCJQMO-OAQYLSRUSA-N 439.512 2.450 10 20 IECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cnn([C@H]4CCOC4)c3)cc2F)C[C@@H](C)O1 751974299 MAWNOYBYZHMJNS-INMHGKMJSA-N 438.525 2.076 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CN(c5ccccc5)C[C@H]4C3)CC2)cc1 754011502 LIWSSJIFTJHQHU-FBLLAGFSSA-N 436.600 2.246 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCO[C@@H]([C@@H]2CCCO2)C1 757425488 MHJYULLDGIPZMF-DLBZAZTESA-N 438.527 2.275 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnn(Cc2ccccc2)c1 762414955 WDOJEFFAFCQQEH-UHFFFAOYSA-N 437.475 2.162 10 20 IECD Cc1n[nH]c(C)c1[C@@H](C)CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772028572 NOKYCCQDQGAVKK-AWEZNQCLSA-N 432.496 2.355 10 20 IECD O=C(CN1CCN(Cc2cc(Br)cc(Br)c2O)CC1)NC1CC1 775644532 NJHXWLMOJLEUQV-UHFFFAOYSA-N 447.171 2.313 10 20 IECD COc1ccc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)c(OC)c1 775658789 SMILHCPRHFRXGS-UHFFFAOYSA-N 438.572 2.414 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCCc4nc(C)ncc43)CC2)cc1 778284694 QQPUDJQIXQRXGD-GMAFFVFYSA-N 435.528 2.192 10 20 IECD COCCN1C(=O)CCc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)ccc21 778728683 HCCQEEWUENFSQE-INIZCTEOSA-N 438.528 2.494 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)nc12 785807457 OMLHGOZOSJBOLE-MHDGFBEUSA-N 429.351 2.011 10 20 IECD Cc1cccc([C@H](CNC(=O)C(=O)NCCCSc2nccs2)N2CCOCC2)c1 787611107 DYYNVHGBQCPXAR-SFHVURJKSA-N 448.614 2.240 10 20 IECD CC1CCC(N2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 789811791 IJWXPSNIWPIJQR-UHFFFAOYSA-N 446.567 2.001 10 20 IECD Cc1nn(Cc2ccccc2)c(N)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795395311 CCEBAMJLMDVLAZ-FQEVSTJZSA-N 446.555 2.454 10 20 IECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 797672739 ZPSLKDQGAYKJNY-UHFFFAOYSA-N 447.513 2.038 10 20 IECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661989 QICAHBJCMMGHNK-PBHICJAKSA-N 436.528 2.270 10 20 IECD Cc1cnc(COCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)o1 803897326 QIYSVQFCIDJFEH-UHFFFAOYSA-N 434.404 2.457 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCN3CCCc4ccccc43)CC2)cc1 803999810 GTVWEGCSUJUUSC-UHFFFAOYSA-N 436.556 2.303 10 20 IECD CS(=O)(=O)CCn1cccc(NC(=O)NCc2cc(Cl)cc(Cl)c2O)c1=O 806372434 SYJGLRUGVVCOAU-UHFFFAOYSA-N 434.301 2.227 10 20 IECD COCCNC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 806855910 ALLQUGSWXJBZJW-UHFFFAOYSA-N 438.528 2.259 10 20 IECD CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807512384 VBZPWCYXMQDBKN-UHFFFAOYSA-N 426.256 2.322 10 20 IECD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)OCC(=O)c1ccc(O)c(O)c1 916607811 UIUUCFZVRYAZDB-UHFFFAOYSA-N 433.482 2.241 10 20 IECD COc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CCCC1 917355409 BGKMMAXIAJABOG-UHFFFAOYSA-N 434.514 2.300 10 20 IECD Cc1cccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918133760 JLQYHTXZJOEMGT-UHFFFAOYSA-N 428.508 2.324 10 20 IECD Cc1cc(CN2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)no1 1322223492 TVUAPALWLIWYLI-UHFFFAOYSA-N 431.512 2.376 10 20 IECD CCC1(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CCC1 1778334494 KGVIKGFYOOSBLA-NKOINVLESA-N 430.501 2.227 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(F)(F)F)c1cc(O)nc(O)c1 1795076287 FKAQBTHFVTWRDU-CLLJXQQHSA-N 436.390 2.472 10 20 IECD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)oc2ccccc12 1796138231 ZSGURZXEDIDSIT-YVWYUNDQSA-N 437.452 2.064 10 20 IECD COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1F 1796603615 VDYHLOJUXNAWRB-MUJYYYPQSA-N 429.448 2.135 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)n1)c1cc(O)nc(O)c1 1798767022 NHAKDTYJHPBGBC-CLLJXQQHSA-N 436.390 2.472 10 20 IECD Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cs1 1807039945 WWBOHPWRQXTFRE-UHFFFAOYSA-N 430.530 2.345 10 20 IECD O=C1CC(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)C1 1811813587 SLBIYHNYOPSFCV-DJJJIMSYSA-N 443.887 2.445 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@@H](O)C2)CC1 1832875817 BKCVVIWKQTXYCG-AZDNCTHESA-N 444.528 2.207 10 20 IECD Cc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841158718 XMGCHJZESXZQMQ-UHFFFAOYSA-N 437.974 2.326 10 20 IECD O=C(c1ccc2cnccc2n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037838 UXJOGZGRNBVTFI-QPJJXVBHSA-N 446.463 2.277 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCCN1C(=O)c2ccccc2C1=O 27067831 QKWKHFDBQIOTCV-UHFFFAOYSA-N 437.496 2.331 10 20 IECD Cc1c(CNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)n(C)c2ccccc12 471775771 VQBPOTHYNDSQAI-UHFFFAOYSA-N 434.544 2.420 10 20 IECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccccc3OC(F)F)cc2)CC1 726976842 RNIFNEPOFAHMBW-UHFFFAOYSA-N 446.497 2.001 10 20 IECD CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1C 740609850 NGWHLYXDKQTHOC-UHFFFAOYSA-N 430.530 2.456 10 20 IECD CN(CC(=O)N1CCN(c2ccccc2F)CC1)Cc1ccc(N2CCOCC2)cc1 741734383 DGJCWDAOFQFJBX-UHFFFAOYSA-N 426.536 2.443 10 20 IECD CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2C=CS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 742750399 MXTRIWUKCTWDDJ-CRAIPNDOSA-N 437.562 2.383 10 20 IECD O=C(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)NCc1ccccc1 751064515 LHQDSRANGFPCEV-UHFFFAOYSA-N 445.522 2.301 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cc1 751271625 KDHOTOZJQWPUHN-UHFFFAOYSA-N 446.478 2.242 10 20 IECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)CC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 754643430 XAJBPLMZWGTPNI-IBGZPJMESA-N 445.585 2.210 10 20 IECD COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NS(=O)(=O)c1cccc2nonc12 765090413 RPHNHKHJVMPAAZ-UHFFFAOYSA-N 440.503 2.109 10 20 IECD COC(=O)[C@H](COC(C)C)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767116059 RDHOTQQPUCDRSH-FQEVSTJZSA-N 438.480 2.299 10 20 IECD CN(Cc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1)Cc1cscn1 774362447 MBBDDRVAXICSAD-UHFFFAOYSA-N 440.525 2.484 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(OC)c(OC)c3)CC2)cc1 774728327 MPTVODORZJICDV-UHFFFAOYSA-N 441.528 2.110 10 20 IECD Cc1nn(C)c2c1N(C(=O)c1ccc3c(c1[N+](=O)[O-])C(=O)c1ccccc1C3=O)CCO2 776211936 HEXGNSLRHLBLOD-UHFFFAOYSA-N 432.392 2.451 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccc(OC)c(O)c3)CC2)cc1 778326400 OWHQFQJYJDWYRA-KHPPLWFESA-N 439.512 2.273 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccccc1OC(F)F 787006543 JZZSWNKZIFZSFO-UHFFFAOYSA-N 447.482 2.442 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1 788310949 NNBCFSCBPABPSM-HXUWFJFHSA-N 440.519 2.064 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3nccn3C(F)F)CC2)cc1 788953217 ZPAJSWVHDYVBEQ-UHFFFAOYSA-N 448.518 2.085 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C[C@H]3CCOC3)C3CC3)cc2F)C[C@@H](C)O1 789812554 MGJYGYIIKJKUHN-SOLBZPMBSA-N 433.524 2.083 10 20 IECD C[C@H](O)C[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820940 RABFBGFHKWDCGC-IMBTUZDBSA-N 435.540 2.208 10 20 IECD CC(C)n1cc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 789842240 CGWHTUMBHRTXLU-OAHLLOKOSA-N 431.512 2.058 10 20 IECD COC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 794808993 VESKVVQRMUBPSF-VWLOTQADSA-N 437.540 2.161 10 20 IECD COc1ccc2c(c1)CCCN2CC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1 796324338 HWLWOXCDUCOGCS-UHFFFAOYSA-N 440.519 2.370 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCS(=O)(=O)c2ccccc21 796814992 VFTCQTVEORTBKP-SFHVURJKSA-N 432.517 2.364 10 20 IECD Cc1cccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)c1 803299454 KLYCQTAVSRPFNS-FQEVSTJZSA-N 436.556 2.358 10 20 IECD COC(=O)c1cc(C)nc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 804365533 DECPQNZROFYYSR-HNNXBMFYSA-N 427.461 2.399 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)cc2)CC1 805024670 LDQSUBGDSSTCRJ-VQTJNVASSA-N 428.577 2.302 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCO)Cc3ccccn3)cc2F)C[C@H](C)O1 805755237 QUZLVEXKDYOIEL-OALUTQOASA-N 444.551 2.335 10 20 IECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C2CC2)cc1 807287363 JFNSFRHXWNIYEN-UHFFFAOYSA-N 432.524 2.230 10 20 IECD CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)c(F)c1 913078270 ZWKXMTMHRMROQE-UHFFFAOYSA-N 437.478 2.146 10 20 IECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1NC(C)=O 918310023 JLTLVNMLZPXLOR-UHFFFAOYSA-N 440.500 2.087 10 20 IECD Cc1noc(CCCC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 919115762 RTBVKSTTXQWOJX-GJZGRUSLSA-N 448.495 2.313 10 20 IECD COc1ccc([C@@H](NC(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C2CC2)cc1 920637008 VCEVUCMLEKDHNY-FQEVSTJZSA-N 448.497 2.197 10 20 IECD C[C@@H](NC(=O)c1nc2ncc(Br)cn2n1)c1ccc(N2CCOCC2)cc1 920882656 VHNYZLMTXIXNTC-GFCCVEGCSA-N 431.294 2.214 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CCCCC3)C[C@@H]21)c1cc(O)nc(O)c1 1787295396 MVADRISURANGNI-YMKQDGHPSA-N 429.517 2.223 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)Cl)[C@H]2C1 1791427457 QSKKUGZHHMZDSX-FWDPORAESA-N 439.242 2.176 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1O 1801723595 VBNYVOKIMSMXEA-GFPDGJBOSA-N 438.480 2.403 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992404 YAFRCSZGBCOWKS-MBSDFSHPSA-N 432.480 2.450 10 20 IECD O=C(CN1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425865 BJPLAQVTEFEOSL-LJQANCHMSA-N 430.549 2.212 10 20 IECD CC1(C(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)CC1 1834352398 OFDYLZFXQUUEPW-HWKANZROSA-N 443.544 2.188 10 20 IECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c2cc(O)ccc2n1 1843249501 QLDBMPPTVKHOKA-UHFFFAOYSA-N 434.452 2.186 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2nc3ccc(F)cn3n2)C1 1845729789 OROCGWUIRAXLQL-UHFFFAOYSA-N 445.838 2.064 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCc2ccoc2C1 1847659149 CEZSJGUUQGWGFK-YVLKKCADSA-N 438.480 2.417 10 20 IECD CCOc1ccccc1OCC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 24664522 IVBCELGYMJWHMK-UHFFFAOYSA-N 428.485 2.365 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1 729038432 RZKVPGDTOKAJFH-OAHLLOKOSA-N 448.545 2.220 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3c(F)cccc3Cl)cc2)C1 730590896 WDQZOMKOKMJROI-HNNXBMFYSA-N 446.910 2.227 10 20 IECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1F 731372750 CBTXETXGASKPSI-UHFFFAOYSA-N 435.521 2.469 10 20 IECD CCCS(=O)(=O)Nc1ccc(NC(=O)C2=CC=S=C2NC(=O)c2ccco2)cc1 731473362 VBSBENCPLRWNHO-UHFFFAOYSA-N 433.511 2.405 10 20 IECD O=C(COC(=O)c1cccc(-n2cccn2)c1)NCc1ccc(N2CCOCC2)c(F)c1 735154374 ICNNXTBZJWTRIU-UHFFFAOYSA-N 438.459 2.321 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(C[C@@H]2CCOC2)CC1 736392503 PMTSAIRSOXTBGA-NRFANRHFSA-N 430.593 2.195 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)nc12 740301550 XTPNVWLVWZDCBC-HIFRSBDPSA-N 448.476 2.348 10 20 IECD CCN(C(=O)[C@@H](C)N(CC)Cc1cc(Br)ccc1O)[C@H]1CCS(=O)(=O)C1 743870899 GKWLZYZBMVCWFD-CJNGLKHVSA-N 447.395 2.401 10 20 IECD CCS(=O)(=O)C[C@@H](C)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744399454 NJGLAYHFDSDABT-CQSZACIVSA-N 428.510 2.156 10 20 IECD C[C@H](NC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 748232436 WCIQJQAYSOWANE-INIZCTEOSA-N 441.488 2.108 10 20 IECD C/C=C(\C)C(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 750895432 IBSOQANIXZAWKA-CERSLXQCSA-N 448.522 2.242 10 20 IECD CN(CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)CC(F)(F)F 751067919 FHRHLNXNQUCMJW-UHFFFAOYSA-N 437.465 2.478 10 20 IECD CCOC(=O)C1CCN(S(=O)(=O)N(CC)Cc2cc(Br)ccc2O)CC1 751465520 HESGSNASDLDJDX-UHFFFAOYSA-N 449.367 2.497 10 20 IECD CC[C@@H]1CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)[C@H](CC)CN1C(C)=O 752911216 ZWZGONSJNLOMLA-NHCUHLMSSA-N 445.608 2.248 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@](C)(c4ccccc4)C3)CC2)cc1 754062800 WLEWZDIACCSFOK-ILBGXUMGSA-N 425.573 2.426 10 20 IECD O=C(COC(=O)CNC(=O)c1cccs1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 757690904 CYGCQPOBFYILTA-UHFFFAOYSA-N 448.456 2.435 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)NCCCCCS(C)(=O)=O)cc2F)C[C@@H](C)O1 773236257 JBULULKWDYMBDI-HZPDHXFCSA-N 429.558 2.453 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](Cc3ccccc3)N(C)C)CC2)cc1 774916308 BEXZFNJTLZURSI-JOCHJYFZSA-N 438.572 2.023 10 20 IECD CCCCn1c(N)c(N(CCC(C)C)C(=O)/C=C\c2cnc(OC)nc2)c(O)nc1=O 775824257 ODGFAGZHSGONOB-FPLPWBNLSA-N 430.509 2.222 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3([C@@H](C)CCO)CCC3)CC2)cc1 778419540 LTFYCDZIUJOQPJ-SGQUHAKNSA-N 429.561 2.205 10 20 IECD Cc1nc([C@@H]2COCCN2CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)no1 779632655 QLORNBWFGGSYCU-SFHVURJKSA-N 432.436 2.165 10 20 IECD O=C(COC(=O)CCCCc1cnn[nH]1)Nc1cccc2c1C(=O)c1ccccc1C2=O 782311196 KJFWPGIECMYHQB-UHFFFAOYSA-N 432.436 2.475 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(-n4ccnc4)nc3)cc2)CC1 785987324 KTVKWWJDHIBXBY-UHFFFAOYSA-N 432.528 2.436 10 20 IECD CN(C)[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccsc1 787655796 RKXDCJNCLAHZFI-OALUTQOASA-N 431.558 2.380 10 20 IECD CO[C@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 789865277 ZMZBUKQSOVDZJD-CQSZACIVSA-N 434.587 2.336 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C)c(Br)cc2C)ccc1O 790408058 VWRXPEOSNKFZSO-UHFFFAOYSA-N 449.348 2.480 10 20 IECD Cc1cc(C(=O)COC(=O)C[C@H]2CCC(=O)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796250886 MXGQQHRQESQNCI-GDBMZVCRSA-N 446.525 2.473 10 20 IECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCc2cccc(Br)c2O)nc1 797652972 XUCTUDSMZGNJMU-UHFFFAOYSA-N 429.296 2.122 10 20 IECD C[C@H](O)C[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 803311322 UFNLVYNBGFEUIV-IPJJNNNSSA-N 439.556 2.371 10 20 IECD O=C(NCCc1ccn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804107585 SHYRHMUHZGHTPD-QFIPXVFZSA-N 448.523 2.444 10 20 IECD CCN(C)C(=O)OC[C@H]1CCCCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 805762100 NJNSWSXSOGQVNQ-FGZHOGPDSA-N 448.608 2.121 10 20 IECD CC(=O)NCC[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 805825077 JHLXIOLEZRARAF-WSTZPKSXSA-N 448.583 2.294 10 20 IECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@H]1[C@@H]1CCCO1)c2[N+](=O)[O-] 808902506 MXKIAVPTBAGSDW-ROUUACIJSA-N 436.420 2.390 10 20 IECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 809719262 CWLXXPAAJWBDCA-OAHLLOKOSA-N 439.465 2.293 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCN(CC(F)(F)F)CC3)cc2)C1 918117211 IUEHKYMJQJKAIJ-QGZVFWFLSA-N 441.498 2.168 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1 1317894548 XXWFJWHWUOYJAM-GOSISDBHSA-N 445.589 2.426 10 20 IECD CCCCN(C(=O)CN1CCN(c2ccc(OCC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 1336436238 YCJYQNREZAZROO-HXUWFJFHSA-N 437.606 2.023 10 20 IECD CC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781121368 RFUFAFBJEWTZHM-DYESRHJHSA-N 438.908 2.248 10 20 IECD O=C(c1ccc(O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008212 SYRGNGCIXWAPSV-NRFANRHFSA-N 432.860 2.214 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(F)(C3)C4)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242985 KBFUXOIGAGETGB-RIEFPYHGSA-N 438.883 2.237 10 20 IECD Cc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1796995145 QGOPVTJGFVNHEM-GGPHIMKMSA-N 431.496 2.435 10 20 IECD CC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799620475 XMSZKSBVKJWJKY-NPDDRXJXSA-N 425.529 2.068 10 20 IECD Cc1cnn([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1802933598 RHBUKTLLPFBDSE-CVYHMRKMSA-N 440.500 2.221 10 20 IECD Cc1nscc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805185371 NCJORRLFAGPRKY-IFXJQAMLSA-N 439.497 2.286 10 20 IECD C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812584199 KNUNDRWOPJOEEG-UGAVNNIXSA-N 444.582 2.080 10 20 IECD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)o1 1815387817 XJHKGRDRLPRCNO-CYBMUJFWSA-N 447.542 2.477 10 20 IECD CCC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1821904757 HNVAYSOMEXBGLM-QGZVFWFLSA-N 436.472 2.174 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)C(F)F)CC2 1828198433 DGVULELOQMEPEY-YUWISIADSA-N 425.413 2.150 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc(O)ccc2F)C1 1845339156 BDKAQSLCCGZENU-XVNBXDOJSA-N 428.416 2.179 10 20 IECD Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@H](CCS(C)(=O)=O)C3=O)c2C)c1 16573915 BOYXKAYESPGISX-LJQANCHMSA-N 445.541 2.249 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H](C)NC(=O)C3CCCCC3)CC2)cc1 727531160 LZRKOMRPCQYOQJ-GOSISDBHSA-N 445.560 2.362 10 20 IECD O=C(CN(C1CC1)[C@H]1CCS(=O)(=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 731843340 ACAPVBZJVITAQM-HNNXBMFYSA-N 438.505 2.052 10 20 IECD Cc1cc(C(=O)N2CC[C@@H](S(N)(=O)=O)C2)c(C)n1-c1ccccc1Br 732664153 JCYWPMZDMWOEDE-CYBMUJFWSA-N 426.336 2.360 10 20 IECD COc1ccc(O)c(CNC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)c1 734068869 KAMLCCKCLFNFBZ-UHFFFAOYSA-N 427.501 2.442 10 20 IECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(=O)n(-c2ccccc2)n1C 741099515 CAQXBIUFBVGOSK-UHFFFAOYSA-N 431.496 2.116 10 20 IECD C[C@@H](NC(=O)CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1 744384193 IOKXOFRXZKTCMG-GOSISDBHSA-N 442.535 2.088 10 20 IECD COc1ccc(N2CCN(CC(=O)Nc3oc(C)c4c(C)nnc(O)c34)CC2)cc1F 753857475 MJTMBTWBUUDEFQ-UHFFFAOYSA-N 429.452 2.454 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(CN(C)C)ccc3C)CC2)cc1F 754210621 CKUAVWYRCVSWTE-UHFFFAOYSA-N 428.508 2.492 10 20 IECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(-c4ccncc4)n3C)CC2)cc1 758197930 SHAWDVIAPFLEPA-LJQANCHMSA-N 440.573 2.161 10 20 IECD COC(=O)[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C(=O)[C@@H]2C1 761091369 NZJOUPNZTRLXLN-DZASIIFFSA-N 433.480 2.155 10 20 IECD Cc1c(Br)cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(=O)n1C 764780256 NBMAYTNKDIFZJL-UHFFFAOYSA-N 438.297 2.362 10 20 IECD CCN1CCN(c2cccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)c2)CC1 770729911 LEJDXMQBJKJMRN-UHFFFAOYSA-N 427.524 2.289 10 20 IECD Cn1c(=O)n(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 771055122 XMHFUNXZBOYZTO-QGZVFWFLSA-N 428.920 2.480 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=N)Cc3cccnc3)cc2F)C[C@@H](C)O1 771663841 BIKIBQPOWJDRGY-HZPDHXFCSA-N 429.496 2.192 10 20 IECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc2o1 774153201 MZSUUZATPVHTIX-INIZCTEOSA-N 435.484 2.093 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3(N(C)C)CCCCC3)cc2F)C[C@H](C)O1 774815490 LHILSYMYXBULDT-ROUUACIJSA-N 448.583 2.436 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(O)(C(F)F)CC3)cc2F)C[C@@H](C)O1 778310895 JSTKCZRAXGXLPT-GASCZTMLSA-N 429.483 2.148 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(Cc4cccc(C)c4)CC3)CC2)cc1 779213937 OUYOQCOUZKLSEZ-RUZDIDTESA-N 438.616 2.304 10 20 IECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766925 LJLHBBVKIHLSFJ-AWEZNQCLSA-N 441.866 2.227 10 20 IECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](C(F)(F)F)O1 789864811 RXZKVEDWEIWHNX-CZUORRHYSA-N 431.480 2.034 10 20 IECD COc1ccc(CNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)c(O)c1 794379742 VWCCWSWBNVBTAH-UHFFFAOYSA-N 428.304 2.395 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)ccc21 803648037 UBKHPBQKUGPOIE-QFIPXVFZSA-N 434.584 2.366 10 20 IECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677022 CUHSCUNTMLLZLI-IRXDYDNUSA-N 437.606 2.352 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](CN(C)C(=O)OC(C)(C)C)C1 807096028 RNHLUQGBXJYCCB-QGZVFWFLSA-N 432.565 2.393 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3COC4(CCCCCC4)O3)CC2)cc1 809672203 AGBMQGLNYGNMBQ-NRFANRHFSA-N 445.560 2.316 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3COc4ccc(OC)cc4C3)CC2)cc1 914827460 IFJCEGPAIYVYCN-SFHVURJKSA-N 440.496 2.147 10 20 IECD CS(=O)(=O)N1CCCc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 917708885 KVVIVKXSBCWHDJ-UHFFFAOYSA-N 447.532 2.305 10 20 IECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 918372192 WCZLZYBLEVBYRB-HXUWFJFHSA-N 445.541 2.233 10 20 IECD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 918444264 PTGWFZPWYBONKG-OAQYLSRUSA-N 437.496 2.157 10 20 IECD C[C@@H](NC(=O)c1ccc(CCNS(C)(=O)=O)s1)c1ccc(N2CCOCC2)cc1 920880807 IPYBMTPUSAHAKV-OAHLLOKOSA-N 437.587 2.167 10 20 IECD C[C@@H](NC(=O)CNC(=O)c1ccc(Br)o1)c1ccc(N2CCOCC2)cc1 920890319 WKMZQCQDTGZJPI-CYBMUJFWSA-N 436.306 2.486 10 20 IECD Cc1nccn1-c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 920926719 UDDLAOQCMDRHOV-MRXNPFEDSA-N 434.500 2.228 10 20 IECD CCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 1317768223 YBENKMRFRWZGOD-UHFFFAOYSA-N 433.530 2.330 10 20 IECD COc1ccc(S(=O)(=O)CCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 1321805390 IKWLCQFHYAAXJM-UHFFFAOYSA-N 432.542 2.354 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1)CC2)c1cc(O)nc(O)c1 1816726993 ARHVUGMXYNGEIJ-LBPRGKRZSA-N 426.454 2.195 10 20 IECD COCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1826448848 MDZFEQFUZICYOS-HXUWFJFHSA-N 426.517 2.045 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)C1=CCCC1)CC2 1828242944 XASBNNYQGLRBBP-NSHDSACASA-N 436.584 2.026 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C(Cl)(Cl)Cl)C1 1846036294 SXUDHVCCHFJJCD-UHFFFAOYSA-N 443.718 2.353 10 20 IECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1 479298404 ZIIWVCRGOKLCOI-HNNXBMFYSA-N 446.550 2.292 10 20 IECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4nc(O)[nH]c4c3)cc2F)CC1 730269213 RJZUJUGPRBCJCX-UHFFFAOYSA-N 433.509 2.028 10 20 IECD Cn1ccnc1[C@](O)(CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(F)(F)F 731857996 HWUJVQZBPPSARZ-DNVCBOLYSA-N 427.423 2.474 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3cc(S(=O)(=O)N(C)C)cn3)c2C)cc1 737405537 FRRZEDPDQJZTLO-UHFFFAOYSA-N 444.513 2.210 10 20 IECD C[C@H](OC(=O)c1cc(C(N)=O)c[nH]1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 750421874 YMWAIKWDBRXACA-NSHDSACASA-N 431.404 2.073 10 20 IECD CC[C@H]1CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 755994432 HBCZSSRPPLTNHH-KPYNCUPYSA-N 447.582 2.465 10 20 IECD COc1ccc([C@]2(C)NC(=O)N(NC(=O)CN(C)c3ccc(OC)c(Cl)c3)C2=O)cc1 757857108 KIXKHMOUEUCSCX-NRFANRHFSA-N 446.891 2.292 10 20 IECD CS(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c1 759594926 OPXAHQAXRUZPCV-XVNBXDOJSA-N 425.846 2.350 10 20 IECD O=C(COC(=O)C[C@@H]1CSCCS1)NCc1ccc(N2CCOCC2)c(F)c1 767701200 RDPRQAOUJRWNNX-OAHLLOKOSA-N 428.551 2.060 10 20 IECD CC(C)[C@@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768516486 DTCOHJKPNBLJOX-CKNGIIGNSA-N 433.524 2.477 10 20 IECD COc1nc(O)cc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 770518643 DQZOZHJKMDZDON-NSHDSACASA-N 447.403 2.150 10 20 IECD CNS(=O)(=O)c1cccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 772398237 HDRVPUHDTXKBMV-UHFFFAOYSA-N 436.509 2.405 10 20 IECD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 773740395 LUHMTRWMHUEHRI-GFCCVEGCSA-N 442.921 2.037 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F)c1ccc(N(C)C)cc1 773845442 JPIOAPXFPWNTQV-CQSZACIVSA-N 448.520 2.248 10 20 IECD CCO[C@@H]1C[C@H](NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C12CCC2 778290565 XIMPUCVIFMWQNK-FSDCKFOESA-N 427.545 2.364 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CCO)c3cccs3)CC2)cc1 778370693 GZHBOLCQXNRGCA-CSHXORCISA-N 429.542 2.201 10 20 IECD C[C@H](O)CN1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 779186430 PATWYACOTNJLEZ-QXPQOBGOSA-N 439.628 2.255 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12 785604314 YDRNWLPFNJVKSC-UHFFFAOYSA-N 444.417 2.057 10 20 IECD Cc1nccn1CCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787654828 PSMMGCFAPSXYGK-INIZCTEOSA-N 435.475 2.084 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCC1(CN2CCOCC2)CCCCC1 788930932 BXNYTGALZJNOJA-UHFFFAOYSA-N 442.604 2.302 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1 788955461 WMKTVUXJBXSQEU-QHCPKHFHSA-N 438.572 2.032 10 20 IECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2c(F)cccc2OC(F)(F)F)SC1=S 790589256 AYOXOLYELRBQIQ-YRNVUSSQSA-N 444.453 2.475 10 20 IECD CCN(CCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 803448413 QQVCSUWXQQYHLG-UHFFFAOYSA-N 426.508 2.220 10 20 IECD CCN(C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@H](C)CS(C)(=O)=O 803677608 RVEFTHBESBSUIM-QGZVFWFLSA-N 437.606 2.353 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 804318689 QZDXDJMQTWCZIL-HXUWFJFHSA-N 428.577 2.257 10 20 IECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 804843670 RURNANYVQNVOSE-CYBMUJFWSA-N 426.514 2.415 10 20 IECD CCC[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807768333 HGDGDELBVIOGDX-QAPCUYQASA-N 425.476 2.401 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@H](N2CCCC2)C1 807768603 MXFBJQWYYNWYNI-AEFFLSMTSA-N 436.503 2.070 10 20 IECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCC3([S@](C)=O)CC3)cc2Cl)C1 807955259 RBJBRKTUUITVNT-POXGOYDTSA-N 425.982 2.220 10 20 IECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2ccnn2)cc1 809613255 PLYJTRXJRITCSX-UTKZUKDTSA-N 449.511 2.358 10 20 IECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 810167421 JAILGRCOXCKNSD-IAGOWNOFSA-N 449.548 2.342 10 20 IECD Cc1cc(C(=O)COC(=O)CC[C@@H]2CCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 914969866 FMXUPKAECUSGOD-KRWDZBQOSA-N 434.514 2.427 10 20 IECD NC(=O)CCOc1ccccc1NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 916701989 SNIQWRDOQWQWJD-UHFFFAOYSA-N 426.517 2.471 10 20 IECD Cc1cc(C(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 917929359 FEAMZFNRBIBBND-KRWDZBQOSA-N 445.541 2.182 10 20 IECD COC(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918294833 KKILPNPCIHCCQW-IBGZPJMESA-N 442.468 2.090 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)c3csc(S(N)(=O)=O)c3)cc2F)C[C@@H](C)O1 918703480 ZWTSQXZLZZAZIG-VXGBXAGGSA-N 427.523 2.078 10 20 IECD Cc1oc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N1CCCC1 919765925 QNYDDQYKVUAQHK-UHFFFAOYSA-N 433.530 2.139 10 20 IECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 920090340 LZCIXSIXTRCEDC-UXHICEINSA-N 430.593 2.361 10 20 IECD CCC(=O)NC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 1348228774 MYJLFLPFYPRKOE-UHFFFAOYSA-N 437.543 2.385 10 20 IECD N[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)c1ccccn1 1788426451 KBYIWTWNNYNAGH-HXUWFJFHSA-N 433.468 2.336 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2CC(O)C2)cc1 1792895359 ORUKIUJGXQFAOE-HLALYHJFSA-N 437.540 2.068 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1803128880 ZKYIVAOHZJJRQI-MHHQIZQESA-N 440.500 2.221 10 20 IECD CC(C)(C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805452549 ZPFOJDSFMGQRKG-HSTAZWAASA-N 446.544 2.455 10 20 IECD CC(C)(C)CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1806311343 FMUHGFBXRZMTDR-HNAYVOBHSA-N 448.614 2.384 10 20 IECD O=C(c1cnc(Cl)nc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810549516 SXJHPHRSOLDPJQ-UHFFFAOYSA-N 431.880 2.095 10 20 IECD C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189281 DFYSPTDMTZDYDR-VXGMRGKGSA-N 444.582 2.080 10 20 IECD O=C(Cc1cnc2ccccn12)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500422 ADIHDMHJOIDPMZ-UHFFFAOYSA-N 440.887 2.459 10 20 IECD C[C@@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847735502 RGZCGYLCZIYYOY-KBMXLJTQSA-N 449.623 2.229 10 20 IECD CCS(=O)(=O)c1ccc(CNC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)s1 471293350 STJMVGRQODSHSB-UHFFFAOYSA-N 438.552 2.176 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1C 727356385 DKQIEDWKGWQKNA-UHFFFAOYSA-N 430.479 2.483 10 20 IECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c1O 729859667 VNCUWWAVUBEPIJ-OAHLLOKOSA-N 449.485 2.026 10 20 IECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1 742952930 UTBSODGNYWXWOZ-SFHVURJKSA-N 440.500 2.039 10 20 IECD COc1ccc(N2CCN(CCNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 745866709 PNCXWUHGLONZKO-UHFFFAOYSA-N 432.452 2.060 10 20 IECD CC(=O)NC[C@@H]1CCn2ncc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2C1 753213039 XMXHWXBJCJHIAV-MJGOQNOKSA-N 426.517 2.109 10 20 IECD COc1cc(N2CCN(C[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc(OC)c1OC 759878287 LNJQERXKFQCTDC-HXUWFJFHSA-N 444.528 2.477 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCOC[C@H]1C1CC1 760821453 QQNGWGFBVGTRJO-NRFANRHFSA-N 440.523 2.263 10 20 IECD O=S(=O)(NC1=NCCCCC1)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765030214 RVZKWLQCIBHTRF-UHFFFAOYSA-N 449.514 2.274 10 20 IECD O=C(CCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)Nc1ccc2nc(O)[nH]c2n1 767171296 UDMGREMAFFMPCZ-OAHLLOKOSA-N 439.472 2.296 10 20 IECD O=C(CNC(=O)c1cccc(O)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 769692234 ZMVWQXLUMDHEPW-UHFFFAOYSA-N 437.418 2.294 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CCN(C(=O)N2CCCC2)CC1 777828938 QGYDEVCXJVTDBR-UHFFFAOYSA-N 437.924 2.475 10 20 IECD Cc1ccc2cccnc2c1S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 777988877 HUVRNJJDDQNSSE-UHFFFAOYSA-N 445.566 2.257 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCN3CCc4ccccc43)CC2)cc1 778235615 LDXWXDRNHCIZAG-QXMHVHEDSA-N 448.567 2.469 10 20 IECD C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCS(=O)(=O)CC1 779014863 YLJQQROJKOTFOY-KRWDZBQOSA-N 447.580 2.245 10 20 IECD C[C@H](NC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(N2CCOCC2)cc1 779503484 QBPAHCOZQYHRTF-VHKYSDTDSA-N 427.526 2.405 10 20 IECD COCc1noc(CN2CCN(Cc3cc(Br)cc(OC)c3O)CC2)n1 783704284 DBXSRPIUSJAVND-UHFFFAOYSA-N 427.299 2.011 10 20 IECD C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(N2CCOCC2)cc1 784244698 DJDSRQFRLJPSFL-XMSQKQJNSA-N 437.544 2.470 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cnn(-c4ccccc4)c3)cc2)CC1 786121241 WCBHUHBUXXBKLO-UHFFFAOYSA-N 439.541 2.019 10 20 IECD COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 786765245 AVLMKGPBHSSYNM-OAHLLOKOSA-N 429.492 2.289 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccc(F)cc3)N(C)C)CC2)cc1 787641607 UZFGFBNHYNMBGK-QFIPXVFZSA-N 442.535 2.292 10 20 IECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 787692392 XGKITZFBBPMSLE-UHFFFAOYSA-N 434.556 2.049 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccnc3OC(C)C)CC2)cc1 787992200 YNBGKXXYOBPFGI-UHFFFAOYSA-N 426.517 2.279 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 788318796 HNRYSYBCEGMFPL-UHFFFAOYSA-N 438.484 2.239 10 20 IECD CC(=O)N1CCc2ccc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)cc2CC1 789733989 DEJZSVQQXUUGMO-UHFFFAOYSA-N 431.543 2.292 10 20 IECD CCC[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789827728 VEUIDEDQHFDUTR-HKARXFIJSA-N 435.540 2.209 10 20 IECD C[C@@H](OC(=O)[C@H]1CCCN(C(N)=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792270560 AXPCVBMUTUQPQD-KGLIPLIRSA-N 449.463 2.123 10 20 IECD CC(C)(C)C[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793734104 PRTKOLVRYIZVHT-AZUAARDMSA-N 428.577 2.432 10 20 IECD C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451448 LDJBJYWPMOMFRP-KXBFYZLASA-N 438.519 2.172 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCOC[C@@H]3C[C@H](O)c3cccs3)ccc21 803688883 DQRFVOWHMIPKKL-ICSRJNTNSA-N 443.569 2.098 10 20 IECD CC(=O)NCC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 805825075 JHLXIOLEZRARAF-GGPKGHCWSA-N 448.583 2.294 10 20 IECD Cc1cnccc1CCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806584943 ATNPFBDTAUBWLK-KRWDZBQOSA-N 432.471 2.435 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)c3noc(COC(C)C)n3)CC2)cc1 811869579 RSUMSEQGPRFHJE-QGZVFWFLSA-N 446.552 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(Br)o4)n3)CC2)cc1 912862252 HWTKTSWWOQUYPR-UHFFFAOYSA-N 447.293 2.053 10 20 IECD CCN(CC)C(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918220638 HKLLZTBOHMNGJT-UHFFFAOYSA-N 435.544 2.076 10 20 IECD COC(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 920926469 PJFILBWMDZILIF-MRXNPFEDSA-N 425.485 2.434 10 20 IECD CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NCc1ccc(N2CCOCC2)cc1 1331905711 CJTQKJHFMRHERU-UHFFFAOYSA-N 436.509 2.033 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1)C1=NN(c2ccccc2)C(=O)C1 1798720541 MSQXUHADUZIRLW-VBUUOAMHSA-N 435.459 2.265 10 20 IECD CCOC(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)OCC 1804291141 DQDONUVMTAHNCO-NCSHHQJSSA-N 448.516 2.244 10 20 IECD CC(C)NCCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809938821 RZACLNUEGBZTDV-FNORWQNLSA-N 445.560 2.436 10 20 IECD Cc1c[nH]cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823498300 PNWQOVLMHOLBKP-AWEZNQCLSA-N 446.558 2.212 10 20 IECD COc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827428630 ZTVGSCIANYSEKW-LJQANCHMSA-N 440.500 2.444 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1cnco1 1833596845 KFCUHMZEVPTENF-UHFFFAOYSA-N 448.907 2.238 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2cc(F)ccn2)C1 1842010249 CDSUECODGYSYPB-UHFFFAOYSA-N 449.486 2.150 10 20 IECD COC(=O)[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1845500580 QYAXSWIBVIYVAU-OLZOCXBDSA-N 436.892 2.158 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2cccc(O)c2)C1 1846465708 QQJYMOZJCDLKRJ-JXMROGBWSA-N 438.480 2.358 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2)cc1 12069489 ZZTDEFKUHUMFBF-UHFFFAOYSA-N 444.963 2.293 10 20 IECD CCn1c(SCC(=O)NCc2ccc(N(C)C)cc2)nc2cc(S(N)(=O)=O)ccc21 27592785 BKCSULILVNRLJX-UHFFFAOYSA-N 447.586 2.178 10 20 IECD CCNc1nc(NCC)n2c(SCC(=O)NCc3nc4ccccc4s3)nnc2n1 105735555 NCASZVQDHOOIIV-UHFFFAOYSA-N 443.562 2.401 10 20 IECD CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727143051 ZYKSTKSONBHPSJ-SJLPKXTDSA-N 448.589 2.315 10 20 IECD NC(=O)c1cccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743975751 UTIVSBSXZZEUPJ-OAHLLOKOSA-N 432.427 2.111 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2O)ccc1Br 751306076 PVDQXGWMQFNCCA-UHFFFAOYSA-N 430.276 2.428 10 20 IECD COc1ccc(N2CCN([C@H](C)C(=O)NC[C@@H]3COc4ccccc4O3)CC2)cc1F 753860579 ITTGNRBJSKUWOW-SJLPKXTDSA-N 429.492 2.301 10 20 IECD CC(=O)Nc1ccc(OC[C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 755303250 GOTJSTFVIKLJLF-NRFANRHFSA-N 427.501 2.132 10 20 IECD O=C(COC(=O)CCSc1ccccn1)NCc1ccc(N2CCOCC2)c(F)c1 756736101 DTWUJVQODMCOTR-UHFFFAOYSA-N 433.505 2.399 10 20 IECD COC(=O)N1CCC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 756896676 PSBNKDLRDNXTNG-UHFFFAOYSA-N 428.512 2.263 10 20 IECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccc(OCC)cc3O)CC2)cc1 768159195 DAAULNJNJKHVEP-UHFFFAOYSA-N 448.541 2.474 10 20 IECD Cc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cccc1S(=O)(=O)NC1CC1 773845356 HSEKOIGALAFYGY-HNNXBMFYSA-N 444.557 2.318 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3C[C@H](C)C[C@H](C)[C@H]3C)CC2)cc1 785530854 QATATPHRFIAQIF-HSALFYBXSA-N 430.593 2.217 10 20 IECD CCC(=O)Nc1cccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 787085640 WRTYDTCYUWOHDO-UHFFFAOYSA-N 438.528 2.399 10 20 IECD CC(C)CCCNC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 787614017 RMZPRLIRGQQKQF-UHFFFAOYSA-N 442.539 2.111 10 20 IECD CCCCN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789823144 ZBZFZFWIEIQVFW-HDICACEKSA-N 448.583 2.436 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccc4c3OCO4)cc2F)C[C@@H](C)O1 789825630 NFSQLQZCWQCHCU-HUUCEWRRSA-N 443.475 2.101 10 20 IECD CCN(C)Cc1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 793867156 IGUCIWBNOYEIOP-UHFFFAOYSA-N 438.572 2.250 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCCN3Cc3ccccn3)nc12 795609082 FDCUYIIXJKHTLT-SFHVURJKSA-N 439.472 2.105 10 20 IECD O=C(Nc1cc2n(n1)CCCC2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 807008465 BJPNZUBACXOSHF-INIZCTEOSA-N 431.924 2.298 10 20 IECD Cc1cc(C(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)c(C)n1-c1ccccn1 915290775 QKXRWVUAESQEBG-UHFFFAOYSA-N 439.541 2.099 10 20 IECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920924433 AOOSMOLYAKTPAF-HNNXBMFYSA-N 440.500 2.306 10 20 IECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1319712610 OXSCSJKYKHXPPZ-HSZRJFAPSA-N 436.535 2.207 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3CNc3cccc(C)n3)CC2)cc1 1320971209 VJZGNWUABJRPKS-PKTZIBPZSA-N 439.604 2.458 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H]2C[C@@H](O)C2)CCO3)cc1 1781753290 KRVFKKHLSSRWBP-JLRUASKGSA-N 437.540 2.309 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2 1782001832 CYIYXKRDSAYGOD-NRFANRHFSA-N 447.875 2.374 10 20 IECD N=C(N)SCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715278 DHYNMVMBHMMGHT-ZSBIGDGJSA-N 426.926 2.020 10 20 IECD Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1805767245 VGYOFXYDMODGPT-KKSFZXQISA-N 433.468 2.225 10 20 IECD Cc1cc(C)n(CCC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n1 1810550436 JYXJGZVLYSDIGD-UHFFFAOYSA-N 441.532 2.241 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ncon2)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806341 KNDJVKHRMLNKFM-WBMJQRKESA-N 443.847 2.163 10 20 IECD O=C(N[C@@H]1CCc2nc(NC(=O)C(F)F)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1812648537 SGEWZIAIPKENFK-SNVBAGLBSA-N 433.440 2.113 10 20 IECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)c(F)c1)CC2)c1cc(O)nc(O)c1 1816727466 XLJFCXNHARABFR-NSHDSACASA-N 444.444 2.334 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnccc1F 1817732821 KSYJWJNLFGEDOY-OAHLLOKOSA-N 426.408 2.370 10 20 IECD Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846238 MIQRRGQSLSOVON-AWEZNQCLSA-N 425.449 2.176 10 20 IECD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847656 RDIFSVBQMAFGSF-MRXNPFEDSA-N 439.476 2.104 10 20 IECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)NC(=O)NCC(F)(F)F 15692237 MHLUQKZDTOZNBN-UHFFFAOYSA-N 434.326 2.007 10 20 IECD CN(CCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 16704920 QTZKHPXPHPAROK-UHFFFAOYSA-N 434.587 2.130 10 20 IECD CCC(CC)[C@H](CNC(=O)C(=O)NCc1c(C)c2ccccc2n1C)N1CCOCC1 550346591 IRSFXVNAUJRXEG-QFIPXVFZSA-N 428.577 2.356 10 20 IECD C[C@H]1CC[C@H](C)N1CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 729601071 ZPVQVNMRTCMQEN-SFTDATJTSA-N 429.609 2.223 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)CN3C(=O)CCc4ccccc43)CC2)cc1 731961940 DYIZWSMTGHIANC-UHFFFAOYSA-N 436.556 2.303 10 20 IECD C[C@H](CS(C)(=O)=O)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 733311221 PCPLZQVDBZDUOF-CQSZACIVSA-N 440.521 2.298 10 20 IECD CCn1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)cn1 736680288 FXGRTPZTPGWUNT-UHFFFAOYSA-N 445.457 2.248 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](Cc4cnn(C)c4)C3)CC2)cc1 746743361 WEAYGLUFQJSSMV-FQEVSTJZSA-N 440.592 2.215 10 20 IECD CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751945033 KDAVHXZBNJWTPR-CQSZACIVSA-N 446.529 2.162 10 20 IECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)N1CC[C@H](O)C1 754356129 NEPXYKMAGJHARV-ALFJJAPYSA-N 427.345 2.244 10 20 IECD CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)co1 755936606 LVMFKERLZGWQHI-ZDUSSCGKSA-N 429.445 2.188 10 20 IECD CC[C@@H]1CC[C@H](C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)O1 757126785 ANILRDKNEFEFEY-OXQOHEQNSA-N 434.514 2.425 10 20 IECD C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS1(=O)=O 758890329 ZKPWOHNVZWQOCV-HUUCEWRRSA-N 431.505 2.475 10 20 IECD Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1[N+](=O)[O-] 761861073 NGIGLDMLLWTDJT-UHFFFAOYSA-N 444.469 2.003 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CS(=O)(=O)c4ccccc43)cc2F)CC1 763046466 IZDIRXGVYOZPCX-IBGZPJMESA-N 446.548 2.295 10 20 IECD CC(C)C[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 768512573 QXXLINFAVIYWQZ-RKVPGOIHSA-N 434.512 2.022 10 20 IECD O=C1c2ccccc2C(=O)N1C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 769533203 PCXPYKBMWUZRMA-AWEZNQCLSA-N 431.832 2.451 10 20 IECD CCN1CCCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 769613379 XJRBPYVHBHBDAG-UHFFFAOYSA-N 441.555 2.180 10 20 IECD COC(=O)c1ccc2c(c1)CN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 771451246 ALKLWSRICYDEHQ-UHFFFAOYSA-N 441.503 2.123 10 20 IECD O=C(NCCCSc1nccs1)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 771554736 FKOAMFWNUBPZDE-AWEZNQCLSA-N 446.554 2.332 10 20 IECD O=C(Cn1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)cn1)NC1CCCC1 772429913 VTRIJNQEEPEEKM-UHFFFAOYSA-N 427.574 2.425 10 20 IECD Cc1nc(O)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1Br 778542975 NCARWFFHEWAKJB-CQSZACIVSA-N 447.333 2.490 10 20 IECD CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)NCc1ccc(N2CCOCC2)cc1 779540018 LVMSXBRFOZJPEB-RUZDIDTESA-N 438.572 2.302 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](c3ccccc3)c3nccn3C)CC2)cc1 785597834 HFXAXXZHBNXSPI-QFIPXVFZSA-N 447.539 2.373 10 20 IECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1 787736129 IQTHBURINVPSLW-JOCHJYFZSA-N 434.540 2.383 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1F 788758396 PKWHDFRGXAEPGE-OAHLLOKOSA-N 432.462 2.289 10 20 IECD Cc1cc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)on1 789840406 HALYUBOCVBZHEM-LJQANCHMSA-N 430.480 2.063 10 20 IECD CCn1cccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1=O 791012020 HQENQWSXVJSTKR-UHFFFAOYSA-N 431.404 2.482 10 20 IECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(OC)cc2O)c(Br)c1 795357465 QMKWMIYTBMRKRT-UHFFFAOYSA-N 430.276 2.428 10 20 IECD CCOc1c(OC)cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1OC 803724837 FXQXGELUHZSXDV-UHFFFAOYSA-N 439.512 2.411 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@](C)(CNC(=O)OC(C)(C)C)C1 807098490 YWKIUGPNQXYLME-QHCPKHFHSA-N 432.565 2.441 10 20 IECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807632203 QIZUUQRJHVBVAG-SFHVURJKSA-N 441.528 2.074 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN(c4ccccc4)C3=O)nc12 814607946 HOSAYPWAYNPSPH-MRXNPFEDSA-N 438.440 2.098 10 20 IECD CCOc1ccc(NC(=O)N(C)Cc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 916673220 JRWPQRBJAZYPOO-UHFFFAOYSA-N 449.529 2.476 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3c(=O)n(C)c4ccccc43)cc2F)C[C@@H](C)O1 917712138 HNJDLUMIUVHGGW-HZPDHXFCSA-N 426.492 2.409 10 20 IECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)nc2)c(C)n1-c1ccccc1 918250131 KKQKVGSBIWCIIL-UHFFFAOYSA-N 440.525 2.190 10 20 IECD CCCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918464773 ZTIVOAXBFVKYCF-SFHVURJKSA-N 438.528 2.432 10 20 IECD C[C@H](NC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 920882077 MECXVMYOWUXLEX-HNNXBMFYSA-N 435.521 2.404 10 20 IECD CC(C)NC(=O)c1cnn2c1C[C@H](CNCc1ccc(N3CCN(C)CC3)c(F)c1)CC2 1320604245 XDWSBFDAIKOJMF-LJQANCHMSA-N 442.583 2.264 10 20 IECD C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)c1ccccc1 1783281304 RRXBIPBSURPIJQ-HJPURHCSSA-N 425.485 2.130 10 20 IECD Cc1cc(C)n(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n1 1827426872 LQOGBLAWADMZLO-LJQANCHMSA-N 441.532 2.240 10 20 IECD C[C@@H]1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835505616 IISMOMQSSATQNP-DNVCBOLYSA-N 430.549 2.114 10 20 IECD O=C(c1cnccc1Cl)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441515 CWOHPUBSRONGFY-UHFFFAOYSA-N 437.887 2.345 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(NS(C)(=O)=O)c1 10362288 JUGZOGPXLKYDEK-UHFFFAOYSA-N 432.546 2.236 10 20 IECD C[C@@H](c1ccccc1)N(CCn1cnc2c1c(=O)n(C)c(=O)n2C)Cc1ccccc1O 216485103 GICFVLQRGZKYNY-KRWDZBQOSA-N 433.512 2.403 10 20 IECD CCN1CCN(c2ccc(CNC(=O)CCS(=O)(=O)C3CCCC3)cc2F)CC1 730194662 UREHTGYMQORKCW-UHFFFAOYSA-N 425.570 2.331 10 20 IECD Cc1nc2n(n1)C[C@@H](N[C@@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CC2 732918422 MEPGWOVIBOATGI-BBRMVZONSA-N 429.480 2.294 10 20 IECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3c(F)cccc3F)cc2)C1 734659902 IQQVLLFEYYUWFI-DNVCBOLYSA-N 432.471 2.199 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3ccc(OC)c(O)c3)CC2)cc1 745506874 JAHKOXHAXPCUMD-UHFFFAOYSA-N 428.485 2.234 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(C(=O)OC)cc2OC)cc1C 749011995 OPNLWAHGDUFBMA-UHFFFAOYSA-N 448.544 2.414 10 20 IECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 749633279 OZFOKCJYSZKBSA-UHFFFAOYSA-N 442.541 2.128 10 20 IECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccccc3OC(F)F)c2)CC1 751213341 RNRXXPZSOVNZDL-UHFFFAOYSA-N 432.470 2.324 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC3=Nc4ccccc4S(=O)(=O)N3)cs2)cc1 751930910 JYFMOEVNCXXPSZ-UHFFFAOYSA-N 428.495 2.495 10 20 IECD CC(C)(C)n1nnnc1COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 766165303 DVWFJLWKDWWUPO-UHFFFAOYSA-N 435.396 2.469 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(OC)c(OC)cc3OC)CC2)cc1 766366247 NMDBBXQZRJVEOZ-UHFFFAOYSA-N 443.500 2.398 10 20 IECD C[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 769710597 CFXXIISMUZZZEQ-WMZOPIPTSA-N 428.512 2.309 10 20 IECD COCCN(CCCOc1ccc(F)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769784995 SJLBELAEIGQVDY-UHFFFAOYSA-N 440.493 2.461 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C)c4ncccc43)cc2F)C[C@@H](C)O1 777714188 PJFAQHBJEZOCPS-IAGOWNOFSA-N 427.524 2.407 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(Cc4ccccn4)c3)CC2)cc1 778255101 AYORPNCNDGKUDV-KTKRTIGZSA-N 446.511 2.179 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H]3C3CCOCC3)CC2)cc1 778423276 QALPELWMSYZZPJ-UVIRAJKCSA-N 427.545 2.318 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 784025670 FZWPJTBLWXNXHI-UHFFFAOYSA-N 431.514 2.210 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@H]3c3ccccc3)CC2)cc1 785528683 QTFRWSGMNIFPIS-QHCPKHFHSA-N 436.556 2.297 10 20 IECD CSCC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2ccccn12 785599332 BFIQUNUQQTWBBX-SFHVURJKSA-N 440.573 2.364 10 20 IECD COc1ccc(CNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c(O)c1 792998957 VYZBHMWDRUYJGJ-IBGZPJMESA-N 426.517 2.098 10 20 IECD COc1ccc(CNC(=O)CCC(=O)N2CCc3cc(OC)c(OC)cc3C2)c(O)c1 794386917 AZBMBVICXKASAY-UHFFFAOYSA-N 428.485 2.399 10 20 IECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC)cc2O)c(OC)c1 795359127 YOJBDAUIJZMLPM-UHFFFAOYSA-N 444.531 2.040 10 20 IECD Cn1ncc2c1C[C@@H](C(=O)OCC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CC2 798769225 YCZFVVZCQYEVLA-AWEZNQCLSA-N 443.459 2.482 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 806463892 XFOMLRWGZSXSGR-OAQYLSRUSA-N 443.592 2.375 10 20 IECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C[C@@H]2CCOC2)CC1 807102644 SMLHCWHFDYZNPV-FQEVSTJZSA-N 430.593 2.107 10 20 IECD NC(=O)c1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)ccc1Cl 807387146 ATMMUCKMCZDSOJ-UHFFFAOYSA-N 426.654 2.162 10 20 IECD CCN(CC)c1ccc(C=c2sc(=CC(=O)C3CC3)n(Cc3ncc(C)cn3)c2=O)cc1 809170684 RNJOMHCYSAUXSC-UHFFFAOYSA-N 448.592 2.491 10 20 IECD CNC(=O)Oc1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 817021911 AGEBENFAGCEXDI-ZHACJKMWSA-N 438.484 2.257 10 20 IECD CN(C)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 864049630 MCGSNWJTEXDFRL-LCYFTJDESA-N 428.377 2.328 10 20 IECD O=C(CN1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 916150239 WWSPGMBWAUZHQG-KRWDZBQOSA-N 433.508 2.197 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)c4ccc(C)s4)CC3)CC2)cc1 917839422 KNFDSOFDCSIJML-UHFFFAOYSA-N 442.585 2.172 10 20 IECD C[C@@H](NC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1ccc(N2CCOCC2)cc1 920880280 BKXHSEVPTBQCQX-MZNJEOGPSA-N 436.512 2.168 10 20 IECD CCOC(=O)C[C@@H]1CCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1320785778 BQCFBKUFEJEORB-FQEVSTJZSA-N 432.565 2.335 10 20 IECD Cc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782007364 FYQDLEXMLXOKTH-NRFANRHFSA-N 434.876 2.339 10 20 IECD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)C1 1796600812 FTWSUBZWKPPFFI-CENPHQPOSA-N 445.516 2.114 10 20 IECD Cc1nc2ccncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601066 XLYPCUYJVBEYQI-BJWYYQGGSA-N 433.468 2.310 10 20 IECD Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816728012 FKNCYBSFUCTUQP-LBPRGKRZSA-N 428.470 2.319 10 20 IECD Cc1ncc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)s1 1816728438 PBIFYGJTQDPTCW-NSHDSACASA-N 445.526 2.183 10 20 IECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]n2)CC1 1827351947 YAYATSNJVZMKSI-OAHLLOKOSA-N 433.896 2.416 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)nn2)CC1 1829186168 LLRRBFZNDJOFGD-MRXNPFEDSA-N 445.907 2.483 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832883437 ZEKSZBICVYJZLJ-KRWDZBQOSA-N 447.532 2.315 10 20 IECD O=C(c1cc2cccnc2[nH]1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441688 MFLISTKSPRHMJG-UHFFFAOYSA-N 442.479 2.173 10 20 IECD O=C(COC(=O)CCNC(=O)c1ccco1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 45281739 XZUOUTIYRHDEFB-UHFFFAOYSA-N 446.415 2.357 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](c1cccc(F)c1)N1CCOCC1 304010685 LAUPSNOFZYQZSW-JOCHJYFZSA-N 431.483 2.491 10 20 IECD COc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc(Cl)c1OC 727177722 NEIMIUSFYQTNSC-XYOKQWHBSA-N 436.964 2.108 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1 728985301 WGIUSRSAXNEHIQ-HNNXBMFYSA-N 434.514 2.221 10 20 IECD COCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 737757023 SDDFQLPMIHHUBS-UHFFFAOYSA-N 429.476 2.092 10 20 IECD COc1ccc(N2CCN(CCNC(=O)c3cc(OC)c(OC)cc3OC)CC2)cc1 742917539 ZOXDCOBVIHSRBI-UHFFFAOYSA-N 429.517 2.273 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NCc2ccccc2O)c1 748346197 PEBCSPBWDDWHHF-UHFFFAOYSA-N 435.546 2.411 10 20 IECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2CC(=O)NCc1ccc(N(C)C)cc1 749874931 PQIMZCXSIJTYQE-UHFFFAOYSA-N 444.601 2.462 10 20 IECD CC(C)COC[C@H](O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069811 AJMIBULOJASRAK-CQSZACIVSA-N 428.532 2.018 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]3C)nc12 752068961 NBNNGMVYVRGDPS-ZIAGYGMSSA-N 433.509 2.347 10 20 IECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(CC1)CNC(=O)C2 752302926 VDWVSYPLWOOLKN-OAHLLOKOSA-N 431.492 2.391 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 753635701 HROWTICRNQQCNE-OAGGEKHMSA-N 448.541 2.257 10 20 IECD CN(C[C@@H]1CCC[C@@H]1O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755060232 XJCNDQAEWUGTCA-RXVVDRJESA-N 442.539 2.245 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)CC2)cc(OC)c1OC 759220213 FUICXLUQCLMYLM-QGZVFWFLSA-N 439.512 2.414 10 20 IECD O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1cccc(Br)c1O 765468189 WBABWMPIVFAHAB-UHFFFAOYSA-N 442.335 2.074 10 20 IECD CCCC[C@@H]1NC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 768523128 XUCREGHDABGUHV-MPGHIAIKSA-N 434.512 2.166 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NCc2ccccc2O)c1 769363866 WYVIXJPJNAONGO-UHFFFAOYSA-N 447.557 2.189 10 20 IECD Cn1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)c1=O 769827020 UACKBMITRTYLCM-UHFFFAOYSA-N 444.425 2.052 10 20 IECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 774537720 MIZVUQPRUFNPER-IRXDYDNUSA-N 443.519 2.423 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](c3ccccc3F)c3nccn3C)ccc21 785607936 XWKRCRTZANJWFE-OAQYLSRUSA-N 435.503 2.464 10 20 IECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)C[C@H](C)O4)cc2)CC1 786121317 YUYWKOSPWPVEDF-INIZCTEOSA-N 429.542 2.157 10 20 IECD CCC(=O)Nc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 787081280 KYCRRVUUDWXMBJ-QGZVFWFLSA-N 438.528 2.365 10 20 IECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 787705016 IPGANHSQYHTDHA-ZCNNSNEGSA-N 430.593 2.185 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCN(c2ccccc2)C1 788331312 JMXCQOSGBCWPCU-NRFANRHFSA-N 436.556 2.172 10 20 IECD Cc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 788415168 ZEDZBXYZCRYMID-QGZVFWFLSA-N 443.519 2.295 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 788974328 DDSRTXVEGANYFR-JOCHJYFZSA-N 436.556 2.375 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)c(O)c1 797387122 DTQATQGXWMCWJW-UHFFFAOYSA-N 443.525 2.153 10 20 IECD CC(C)Cn1c([C@H]2CCS(=O)(=O)C2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802665431 UGORAAFOWVEUQL-IBGZPJMESA-N 447.605 2.309 10 20 IECD CCOC(=O)c1sc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)nc1C 803662565 XYUISRGYBUPOEC-LBPRGKRZSA-N 436.509 2.327 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291842 PBVZJGCDWVRHIE-UHFFFAOYSA-N 434.540 2.174 10 20 IECD NC(=O)Cc1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 811585879 PMVMLQDJMUYKMY-UHFFFAOYSA-N 445.522 2.212 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(Cl)nn3)cc2F)C[C@@H](C)O1 815437298 IRJYVJBZZUYAOV-CHWSQXEVSA-N 436.871 2.356 10 20 IECD COc1ccc(N2CCN(c3ccc(C(=O)N4CCOCC4)cc3[N+](=O)[O-])CC2)cc1 912739483 JVDDFOHHLVIZSW-UHFFFAOYSA-N 426.473 2.402 10 20 IECD CCN(CC)c1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1 914720295 WSIBQMHXPRDTFP-UHFFFAOYSA-N 435.546 2.419 10 20 IECD COc1ccc(N2CCCN(CC(=O)NCCOc3ccc4c(c3)OCO4)CC2)cc1 917210169 FATBNPBXLLCWOV-UHFFFAOYSA-N 427.501 2.131 10 20 IECD Cc1cccc([C@@H](CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)NC(N)=O)c1 917834952 VECRAIXTMCDAEX-PZJWPPBQSA-N 437.544 2.113 10 20 IECD CCOC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 918670843 AVNRGBCJLYHLJZ-KRWDZBQOSA-N 426.517 2.440 10 20 IECD C[C@H](NC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 920638424 ZIBGEYCDAIBMIT-NSHDSACASA-N 426.878 2.451 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NNC(=O)C2)C3)cc1 1800513891 XDURBVZHUUVGGZ-FNLKRUPLSA-N 433.512 2.222 10 20 IECD Cn1cccc1C(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719250 FAQKUVPAQNGYKG-BTTYYORXSA-N 431.876 2.224 10 20 IECD CCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843898 GRPBSZQDFVATFZ-CQSZACIVSA-N 426.433 2.386 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(O)n2)CC1 1825943062 DPSZIRYNLDMGKU-KRWDZBQOSA-N 426.473 2.141 10 20 IECD O=C1C[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1831417897 HRLBHLNHSMOREE-RDJZCZTQSA-N 449.935 2.121 10 20 IECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cnoc2C2CC2)C1 1842581812 WWWLXSVILRKRSF-UHFFFAOYSA-N 433.468 2.162 10 20 IECD CCOc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nn1 1845501769 BFALNAXMBKXTPU-UHFFFAOYSA-N 432.864 2.071 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)c4cc5ccccc5[nH]4)CC3)nc12 110186495 CNEUDWCBJUYJAP-UHFFFAOYSA-N 448.483 2.051 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(S(C)(=O)=O)ccc3C)CC2)cc1 726726674 VBQPRPKWRWKLDQ-UHFFFAOYSA-N 445.541 2.131 10 20 IECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1ccc2c(c1)OCCO2 727249351 WAKORGFHPVDHHS-UHFFFAOYSA-N 442.482 2.358 10 20 IECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1F 731364000 GCEFTSXZDKQUIK-UHFFFAOYSA-N 443.571 2.473 10 20 IECD NS(=O)(=O)c1cccc(NC(=O)CCN(Cc2ccccc2O)C[C@H]2CCCO2)c1 731845392 ZPJDCIZBQVMPIJ-GOSISDBHSA-N 433.530 2.049 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@@H](C)C2)CC1 734687554 IJUQIFDFTLKYSW-KDURUIRLSA-N 429.609 2.393 10 20 IECD COc1ccc(N2CCN(C(=O)COc3cccc(NC(=O)c4cnn(C)c4)c3)CC2)cc1 738294477 NCMNMZQEBHCGNO-UHFFFAOYSA-N 449.511 2.409 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cc(C(F)(F)F)cnc1O 738902676 GRHVQNKIFHOIJK-UHFFFAOYSA-N 444.435 2.363 10 20 IECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN(C(=O)C(C)(C)C)C3)CC2)cc1 742917499 YIRBZAXJKPAEQQ-IBGZPJMESA-N 430.593 2.218 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Cc3cc(C(C)=O)ccc3OC)CC2)cc1 742927767 ZTRJNZYFGKMRPG-UHFFFAOYSA-N 425.529 2.387 10 20 IECD CN1CCCc2cc(CNC(=O)c3ccccc3S(=O)(=O)N3CCOCC3)ccc21 746812650 BMNGQNPLDIUHIV-UHFFFAOYSA-N 429.542 2.020 10 20 IECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(C(=O)OC)cc2OC)cc1 749011501 MFSVNPQHHFYICH-UHFFFAOYSA-N 448.544 2.496 10 20 IECD CN(C[C@H]1CCC[C@@H]1O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755060224 XJCNDQAEWUGTCA-NQIIRXRSSA-N 442.539 2.245 10 20 IECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 756483781 QEQSRZJWFXNWQY-YJBOKZPZSA-N 448.541 2.487 10 20 IECD COc1ccccc1N1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 756924733 NOWDINJPYQYBNE-GOSISDBHSA-N 442.491 2.276 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CSc3nnnn3C3CCCCC3)CC2)cc1 758196161 BTNPNXGVYHGHMN-IBGZPJMESA-N 432.594 2.462 10 20 IECD CS[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H]1N(C)C 765266619 BEZIURVGLKCLMS-GOEBONIOSA-N 441.600 2.372 10 20 IECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 765283705 XVLWFUTTZWQQAD-LJQANCHMSA-N 445.585 2.395 10 20 IECD O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c2ncccc12 766479939 ZMMZTAJAAMLSBO-UHFFFAOYSA-N 428.470 2.458 10 20 IECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CN(C)CCO1 769974197 UCWCZAKVQTYDHM-KDOFPFPSSA-N 430.471 2.060 10 20 IECD CCS(=O)(=O)C1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 770047107 VETRAKGCHKAUFJ-UHFFFAOYSA-N 440.521 2.300 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCc3nnc(O)cc3C2)c([N+](=O)[O-])c1Br 772234814 FKPATJGDSRSFBB-UHFFFAOYSA-N 426.183 2.332 10 20 IECD C[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774538239 OISMFOZHWPBMLV-WIYYLYMNSA-N 436.556 2.142 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CCN(C)C)C(C)(C)C)CC2)cc1 778284509 NWGYOQUEVBAPAU-GMGKOPGTSA-N 430.593 2.383 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)C[C@H]3C)cc2F)C[C@@H](C)O1 780312811 SMOZJQSKUSEYAH-KZNAEPCWSA-N 436.572 2.426 10 20 IECD C[C@H](OC(=O)CCCCNC(N)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785567429 SHRNYXMUELWORB-ZDUSSCGKSA-N 437.452 2.171 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CN(C)C)c(Br)c2)c1O 786329190 ADLIQWDDEXUAEL-UHFFFAOYSA-N 436.306 2.480 10 20 IECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C12CCCCC2 788321276 UKIFMWZXAYYZRI-SFTDATJTSA-N 429.561 2.384 10 20 IECD CC(C)(C)SCCNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 788364441 NVVYEDLWEWBBPD-UHFFFAOYSA-N 432.634 2.483 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCOCc3ccccc3)cc2F)C[C@@H](C)O1 789818236 JDZTXGMMRNOPJR-QZTJIDSGSA-N 443.519 2.389 10 20 IECD COc1cc(Br)cc(CNC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1O 796504684 WDLOKYLTIXBJHL-MQVJKMGUSA-N 426.355 2.337 10 20 IECD COC(=O)Cn1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)c1C 797028311 KLFIJWDHXZRWTO-UHFFFAOYSA-N 428.489 2.370 10 20 IECD COc1ccc(N2CCN(C(=O)CN(C)CC(=O)N(C)[C@@H](C)c3ccccc3)CC2)cc1 800500712 WGTGILQNZDLYJD-FQEVSTJZSA-N 438.572 2.495 10 20 IECD C[C@H](NC(=O)C(=O)N1CCC[C@H](OCC(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 803306185 SSKVLXXJUKESKT-YJBOKZPZSA-N 443.466 2.270 10 20 IECD C[C@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CN1C1CC1 803451096 DPADPPUHAFNPMK-GOEBONIOSA-N 436.503 2.114 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 803747393 QWCCAMKXKMXMOS-VAMGGRTRSA-N 428.577 2.018 10 20 IECD CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 804975705 RJIHUBNMADTRHK-CABCVRRESA-N 446.577 2.400 10 20 IECD CCOc1ccc(CN2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)cc1 806277898 ILNRPWHJBZQETM-UHFFFAOYSA-N 448.614 2.485 10 20 IECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)CN(C)C 807605856 XGVPGKWSLRUGGG-CVEARBPZSA-N 440.535 2.466 10 20 IECD C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770366 LCTLFNCSEZYDAC-JTDSTZFVSA-N 438.519 2.172 10 20 IECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@@H](C(=O)N2CCCC2)C1 807819353 WRNOHPJUQUQGMM-CQSZACIVSA-N 449.554 2.339 10 20 IECD C[C@H]1CN(c2ccc(CNC(=N)N3CCN(c4ncccn4)CC3)cc2F)C[C@H](C)O1 849070634 ZENPOFSJBCRMPD-IRXDYDNUSA-N 427.528 2.076 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](N4CCCC4)C3)CC2)cc1 916196509 JHZQUIYHZKCJTQ-QFIPXVFZSA-N 429.609 2.477 10 20 IECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 917863386 PJRIEWDTZQDJNI-UHFFFAOYSA-N 438.571 2.056 10 20 IECD C[C@@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1 920882303 WODHNHPCFZBGSE-CQSZACIVSA-N 444.513 2.500 10 20 IECD Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1780678989 MENAWRCBVGQJFG-HLZSCNFSSA-N 438.480 2.269 10 20 IECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)C3CCOCC3)CCC2)cc1 1792314098 ZIIVZERIRDBASP-UHFFFAOYSA-N 447.582 2.407 10 20 IECD Cc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n1 1793278349 JLYMNUGCVGKVMW-NUZGMZIFSA-N 445.523 2.364 10 20 IECD CC(C)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)cc1 1796140548 OWNMHJXQIOUGQV-HATOLVCRSA-N 439.512 2.208 10 20 IECD O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604203 PNVIDDGOIWATQT-QDMKHBRRSA-N 444.419 2.035 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCSCC1)CC2)c1cc(O)nc(O)c1 1816730825 BPCVLVYUINQXSH-GFCCVEGCSA-N 434.543 2.318 10 20 IECD Cc1nccn1[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848374 GLARXZOQYUJOJF-WBMJQRKESA-N 439.476 2.288 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2nccn2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821294548 IONQZRGWIMLTIM-CQSZACIVSA-N 445.867 2.072 10 20 IECD Cc1nn[nH]c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823709045 WICWTQBSFZPDTK-SECBINFHSA-N 448.892 2.174 10 20 IECD COC1(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)CCC1 1827404683 MYAVMHKWCHJUPM-GFCCVEGCSA-N 432.502 2.134 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)c2cn[nH]c2)CC1 1827801128 GPODGVRKQXMYAX-SUQGKYDKSA-N 440.500 2.473 10 20 IECD CCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433201 PDZMTRFBINEAEK-OAQYLSRUSA-N 440.924 2.257 10 20 IECD COc1cccc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1842710824 PEUYABWRHCOXNL-VQHVLOKHSA-N 438.480 2.271 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)COCc2ccccc2)C1 1842817408 UJCXXBPHASOUCG-CSKARUKUSA-N 438.480 2.237 10 20 IECD O=C([C@@H](O)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502251 FEOVNFVJEPIFKQ-SFHVURJKSA-N 430.888 2.172 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1 737184728 VWWXBNZKRAJOAQ-GFCCVEGCSA-N 443.481 2.412 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2 740031976 OSANYLWFSSGUSX-LJQANCHMSA-N 447.919 2.481 10 20 IECD CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1F 740176852 HHMHANINTYJJGB-UHFFFAOYSA-N 448.520 2.030 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccn(CC(F)(F)F)n1 746365043 YCWSOHSANOSVKD-UHFFFAOYSA-N 427.452 2.254 10 20 IECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(Br)c2)cc1 747604397 KXJVKLDFXWJGRM-UHFFFAOYSA-N 449.304 2.320 10 20 IECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c(C(=O)OC)s1 751057859 JZTFLPYQKNXSRU-UHFFFAOYSA-N 430.479 2.005 10 20 IECD Nc1ccc(Cc2nc(C(=O)OCC(=O)N3CCN(Cc4ccco4)CC3)cs2)cc1 751931753 PSIHIRPONXOOOG-UHFFFAOYSA-N 440.525 2.410 10 20 IECD CN(C)C[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 752484675 WJWSPAQCLCRYLK-MDNBWPLSSA-N 427.617 2.158 10 20 IECD CC(=O)Nc1ccc(OC[C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 755303256 GOTJSTFVIKLJLF-OAQYLSRUSA-N 427.501 2.132 10 20 IECD COc1cc(N2CCN(C(=O)NC3CCN(CC4CC4)CC3)CC2)cc(OC)c1OC 759217026 UZHIXEURAYJLQD-UHFFFAOYSA-N 432.565 2.418 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1F 759253578 DDZOIIKNBDUPGD-UHFFFAOYSA-N 425.438 2.262 10 20 IECD CCCC(=O)N1CCC[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 760083143 BMCIDPVBYQJLIP-QGZVFWFLSA-N 433.549 2.400 10 20 IECD COc1cc(N2CCN(C(=O)[C@@H]3CCCN3Cc3ccccn3)CC2)cc(OC)c1OC 760084058 IYCVXZZFODOTNI-FQEVSTJZSA-N 440.544 2.421 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1 765884670 QDJTVRDMNILCFJ-QHCPKHFHSA-N 434.540 2.332 10 20 IECD Cn1ccnc1-c1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 768712448 FDHFUXCWCDAOAA-HNNXBMFYSA-N 441.513 2.396 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4nc(C(C)C)no4)n3)CC2)cc1 771054336 ACUWVJCJHYUWBF-UHFFFAOYSA-N 440.504 2.261 10 20 IECD CN1CCC(N2CC[C@@H](N(C)C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)CC1 771767590 BLIPKLHMUGIQFI-HXUWFJFHSA-N 447.599 2.097 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](CN(C)CC4CC4)C3)CC2)cc1 778299644 LOZQIBMVKAEJJR-VFCOFNOGSA-N 440.588 2.090 10 20 IECD COc1ccccc1C1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCC1 788321967 DSHLYZBZWOUZMO-UHFFFAOYSA-N 437.540 2.386 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1ccc2ncccc2c1 789696830 PNQJQJHCIPXOMU-UHFFFAOYSA-N 436.487 2.268 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCO[C@H](c2ccccc2)C1 789801211 ZPMDKXSXJVTMQL-QFIPXVFZSA-N 441.503 2.269 10 20 IECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H](O)Cc1ccccc1 793155754 ADVSEGAMIGZVTA-QFIPXVFZSA-N 435.503 2.162 10 20 IECD CNS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1C 795071488 BRRPZAZWWKCDNQ-UHFFFAOYSA-N 437.587 2.322 10 20 IECD C[C@@H]1CCN(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 795250049 XTQKTAMBEAUUPZ-QAPCUYQASA-N 426.583 2.495 10 20 IECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1OC 795852264 KHYJRHQHHFWIPN-SNVBAGLBSA-N 428.894 2.462 10 20 IECD CN(Cc1ccccc1O)C(=O)C1(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC1 797192193 YXXACHAGIGHKLE-UHFFFAOYSA-N 426.535 2.165 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1 799253808 WWJDBFXEBWXCRN-JLTOFOAXSA-N 441.484 2.135 10 20 IECD CN1CCCc2cc(CNS(=O)(=O)c3cc(Br)cc(C(N)=O)c3)ccc21 799765825 ICCTXUALJGQRKJ-UHFFFAOYSA-N 438.347 2.409 10 20 IECD CC[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803450662 NTMRSSFUGIWOJA-QGZVFWFLSA-N 425.476 2.401 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1)NCC(=O)Nc1ccc(I)cc1 803489643 AZDSJOXTIHSJDX-KRXBUXKQSA-N 438.221 2.471 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)N3CCCN(C(=O)OC(C)(C)C)CC3)ccc21 803686993 SLRYEUWZYWEQMV-UHFFFAOYSA-N 430.549 2.155 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)O[C@]4(CCCOC4)C3)cc2)CC1 805023365 GFBZGUSERPSRNC-NTKDMRAZSA-N 429.561 2.336 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3CCCN(CC(C)C)C3)CC2)cc1 808836426 MATIJKLHWYQTCH-HXUWFJFHSA-N 430.593 2.218 10 20 IECD COC(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 810173154 XNKGJRXGABLXIN-UHFFFAOYSA-N 436.917 2.291 10 20 IECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 815266684 RHZFTCYNKBUOKF-UHFFFAOYSA-N 439.516 2.077 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@H](C4CCC4)C3)CC2)cc1 817041743 KDPVDSMJSGRPFK-GDCKJWNLSA-N 427.545 2.175 10 20 IECD COc1ccc(N2CCN(CC(=O)NCc3c(OC)cc(OC)cc3OC)CC2)cc1 916984871 PBHWPZYZYQYNGS-UHFFFAOYSA-N 429.517 2.159 10 20 IECD COCCOc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918780413 IEJLUQMPDGCZCN-FQEVSTJZSA-N 440.544 2.413 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1 919809684 IRXAVCYFLYRCOH-UHFFFAOYSA-N 431.514 2.320 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(O)(Cc4ccccc4F)CC3)nc12 1320896773 XRVBQXVCICXCLK-UHFFFAOYSA-N 428.464 2.320 10 20 IECD C[C@@]1(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC=CCC1 1784760961 WQCKQHQLABQWRC-NLPUISFESA-N 442.512 2.393 10 20 IECD O=C(CC[C@@H]1CCOC1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784817549 VTHTULCUXIYIFA-SZNDQCEHSA-N 438.908 2.011 10 20 IECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3ncc[nH]3)cc2)CCC1 1787181521 OMKOMKIMADZEIS-UHFFFAOYSA-N 429.527 2.018 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccc(F)c1[N+](=O)[O-] 1796604803 OXCOKLGBQHTTAA-CLLJXQQHSA-N 430.392 2.106 10 20 IECD CCOC(=O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1804312539 KMCNSWJJDOVKRN-XFLCEESOSA-N 446.500 2.044 10 20 IECD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336421 XBUPLSREQFZAGB-IZKTWJBDSA-N 435.615 2.311 10 20 IECD CCC(C)(C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190213 UBNYEQDKWAGEPB-QAPCUYQASA-N 448.614 2.384 10 20 IECD CO/C=C(\C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1819550447 UOTODDJOZKAHMK-NKZAKNJKSA-N 445.497 2.436 10 20 IECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(N(C)C)cc3)cc2)C[C@H](C)O1 15134622 KHUVJZUUBJGNSX-IRXDYDNUSA-N 431.558 2.481 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(N4CCCC4=O)cc3)CC2)cc1 23473637 XISAXJFXVWUJPP-UHFFFAOYSA-N 437.496 2.328 10 20 IECD CCCC(=O)N1CSC[C@H]1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 727367339 LOVSWCPKESWGLL-FQEVSTJZSA-N 434.606 2.025 10 20 IECD NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(-n3cnnn3)cc2)c1 728876470 CUMKMKKPAJPWOZ-UHFFFAOYSA-N 427.468 2.407 10 20 IECD COc1cccc(CNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c1O 729861720 XATIJWMSGJANTB-UHFFFAOYSA-N 440.905 2.005 10 20 IECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 734073490 POVIAKZLKLYNRG-UHFFFAOYSA-N 427.457 2.043 10 20 IECD CC[C@@H](C)[C@@H](O)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 734269380 IWUHUOQWYMKMHZ-UZLBHIALSA-N 430.528 2.149 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(C[C@@H]2CCCO2)CC1 734275414 YONQDROMEIHQFA-QHCPKHFHSA-N 430.593 2.338 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1 734701816 JGMABZLBFHTOFK-UHFFFAOYSA-N 432.546 2.003 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nnc(-c2ccco2)s1 738905238 LIXUMRQOZFXTMM-UHFFFAOYSA-N 433.515 2.355 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3noc(-c4cccs4)n3)cc2)C1 745182506 FXHSZETVEVQROF-HNNXBMFYSA-N 440.529 2.499 10 20 IECD COC(=O)c1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751238170 YBMRKRDQNZLSHC-UHFFFAOYSA-N 440.468 2.191 10 20 IECD COC(=O)Cc1ccccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 752096940 NDNRLXUDVAOKEV-INIZCTEOSA-N 425.485 2.055 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ncn(C4CCCCC4)n3)CC2)cc1 755210464 FVRWYBOGIYSXHN-UHFFFAOYSA-N 426.521 2.469 10 20 IECD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1 758548227 QLPGOEYEGHVEEL-SNVBAGLBSA-N 442.877 2.186 10 20 IECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(C4OCCO4)c3)CC2)cc1 759827196 FZLFMOVOYRZQPT-UHFFFAOYSA-N 426.469 2.246 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(-c4ncccc4F)n3)CC2)cc1 760079938 ISGMGJZEXVRVLI-UHFFFAOYSA-N 439.495 2.359 10 20 IECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC(=O)C[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760557242 BKMZMNKPZJYXKH-BFUOFWGJSA-N 446.525 2.473 10 20 IECD COC(=O)Cc1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 764249438 PXESYEGRMAUXTK-UHFFFAOYSA-N 425.485 2.088 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOCC(F)(F)C(F)F)cc2)C1 764833593 DWKVWSCCPVHKPG-AWEZNQCLSA-N 434.434 2.105 10 20 IECD CCC[C@H]1CN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CCN1CCOC 766377278 RAKMXBVIILAIND-QHCPKHFHSA-N 433.593 2.360 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc5cc(C)nn5c4C)n3)CC2)cc1 771056670 NBWCWOFERQJXLF-UHFFFAOYSA-N 447.499 2.296 10 20 IECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4n[nH]c5ccccc45)n3)CC2)cc1 771083887 UBCTTYFUHIGBPJ-UHFFFAOYSA-N 432.484 2.437 10 20 IECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cc1 775286073 BJXYILLZPMDCKH-UHFFFAOYSA-N 442.515 2.010 10 20 IECD Cc1cccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Cl 775699565 GQFMNDOMWBPPLA-UHFFFAOYSA-N 428.963 2.362 10 20 IECD O=C(Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1)c1cccc(O)c1O 776621755 DUTBNQXCTRRSQY-UHFFFAOYSA-N 433.468 2.031 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-n4ccnn4)c3)CC2)cc1 778388199 FAJPYMFSKFPSOR-MDZDMXLPSA-N 432.484 2.119 10 20 IECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 779337111 XBVNYZABPFIKHZ-AEFFLSMTSA-N 447.580 2.491 10 20 IECD COc1ccc(N2CCN(CCNC(=O)N=c3cc[nH]cc3Br)CC2)cc1 780632778 QVNDJAZIQMOAGK-UHFFFAOYSA-N 434.338 2.218 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 785426436 YTZMHKNKMUROBS-UHFFFAOYSA-N 434.540 2.197 10 20 IECD Cc1ccc([C@H](CN2CCOCC2)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 785557086 ARZGZAJTPPAQCN-QHCPKHFHSA-N 438.572 2.209 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccc(O)c3)cc2F)C[C@@H](C)O1 789824542 IRZKXTQXQUEPKX-IYBDPMFKSA-N 429.492 2.420 10 20 IECD COC(=O)c1cn(CCNCc2cc(Br)cc(Br)c2O)nn1 793613957 ZJBVTRZNDFAEBT-UHFFFAOYSA-N 434.088 2.085 10 20 IECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)c(O)c1 797388886 DSULYSVGVRCBFW-UHFFFAOYSA-N 440.544 2.434 10 20 IECD C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450523 JULQIFGXLFBJNW-CABCVRRESA-N 425.476 2.304 10 20 IECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2=O)cc1 803688675 YOWRXIQKAAKEHF-NRFANRHFSA-N 434.540 2.305 10 20 IECD O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 804007327 FRHFILAKHLRHDU-NRFANRHFSA-N 447.491 2.431 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N3CCCC[C@@H]3C)cc2)CC1 805023783 AVTRDVIAGFAAJV-RBUKOAKNSA-N 428.577 2.445 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN3CCOC[C@H]3C)cc2Cl)C1 807955325 SZJMLCZJESYOPV-IAGOWNOFSA-N 436.984 2.029 10 20 IECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](CC)CS(=O)(=O)c1ccccc1 808816158 MENZFMLAALNJIW-SFHVURJKSA-N 432.542 2.500 10 20 IECD C[C@H](C(=O)NCCc1ccc2c(c1)OCCO2)N(C)Cc1ccc(N2CCOCC2)cc1 857758595 MEWLLUUZTYAQEM-LJQANCHMSA-N 439.556 2.474 10 20 IECD CS(=O)(=O)c1ccccc1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918030635 QNAJYNDMUPKSGI-INIZCTEOSA-N 430.530 2.114 10 20 IECD CC(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918220643 HPUCOAXIEQGBEB-UHFFFAOYSA-N 434.556 2.481 10 20 IECD CC(C)CS(=O)(=O)CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919333306 FVQWWPPJYNOLGB-UHFFFAOYSA-N 443.477 2.015 10 20 IECD C[C@@H](NC(=O)c1ccoc1)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919481247 SGTJUJNHASHEDL-CYBMUJFWSA-N 446.415 2.355 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC(=O)N(Cc2ccccc2)C1 919970632 PRZRUMZSWOFDDY-LJQANCHMSA-N 425.504 2.452 10 20 IECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(N2CCOCC2)cc1 920925641 KRIXGWOFXQCVIB-CYBMUJFWSA-N 430.892 2.091 10 20 IECD Cc1cc(F)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)c1 1780888523 DAUVSASJNOCIAP-WZONZLPQSA-N 443.475 2.382 10 20 IECD CC1(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCCC1 1785503396 JIJKPDNIXDHAGJ-BVBLWJPBSA-N 430.501 2.227 10 20 IECD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c(C)o1 1785508624 HWVRBSJHZJGMKW-FIYNHDKVSA-N 442.468 2.170 10 20 IECD O=C(/C=C\C(=O)NC1CC1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1789425682 TVGDOABMXFXOCF-HJWRWDBZSA-N 436.468 2.075 10 20 IECD Cc1c[nH]cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243344 KBIOVJKXKLLJQW-QITLCBANSA-N 433.892 2.295 10 20 IECD O=C(CCc1ccccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340428 OROXJLXKFWRJAG-MUJYYYPQSA-N 449.573 2.257 10 20 IECD Cc1cc(/C=C/C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)no1 1810385667 JELKYTYWCUBXMQ-XBQZDBRBSA-N 449.467 2.217 10 20 IECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c(C)n1C 1811235641 BCAKGAJFSOEGCN-HTAPYJJXSA-N 449.511 2.477 10 20 IECD Cc1noc(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722342 YBQSWPUDTBDIGD-LBPRGKRZSA-N 443.485 2.023 10 20 IECD CC/C=C(\C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435611 SEOVYCWUMHROSW-UQTPNQFZSA-N 438.908 2.178 10 20 IECD CC(C)(C)c1ncccc1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1843151547 LTDDHFBLLCWAHN-UHFFFAOYSA-N 446.598 2.056 10 20 IECD COCCC(=O)N1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 444417141 ZEFVBLAFLPEOOK-UHFFFAOYSA-N 426.561 2.115 10 20 IECD CC(C)c1noc(-c2ccc(NC(=O)C3=S=C(CCNS(C)(=O)=O)C=C3)cc2)n1 590230234 MINFFWBCUIIYQW-UHFFFAOYSA-N 434.543 2.386 10 20 IECD C[C@@H]1CCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)C1 725803784 QBTGYGWJAMQWDL-ZLYHGVDXSA-N 433.555 2.075 10 20 IECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1 729062377 ACIVIUXDKKOQQE-BFUOFWGJSA-N 427.457 2.334 10 20 IECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)cc1 730203893 YWRWVCUIQBKBTE-UHFFFAOYSA-N 446.572 2.269 10 20 IECD COCCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)Cc1ccc2c(c1)OCO2 732410927 NSAYUOQMQMCIMR-UHFFFAOYSA-N 441.528 2.221 10 20 IECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 739079452 HOVBPJXXZSJRJD-KRWDZBQOSA-N 439.512 2.445 10 20 IECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)NC(C)(C)C 748042378 GSJDUXWSLJBFNB-LLVKDONJSA-N 425.532 2.288 10 20 IECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 748486092 MRCCPSFLSVQUKV-UHFFFAOYSA-N 437.905 2.085 10 20 IECD C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 749125489 HJAKAJSLERBTAZ-FXAWDEMLSA-N 444.601 2.489 10 20 IECD COc1ccc(O)c([C@H](C)NC(=O)CNS(=O)(=O)c2ccc(Br)s2)c1 761974733 XBPFAYIZNUXUGL-VIFPVBQESA-N 449.348 2.381 10 20 IECD COCCNS(=O)(=O)c1ccc(CNC2CCN(c3ccc(OC)cc3)CC2)cc1 765404343 DFCIVMHPDCUAAD-UHFFFAOYSA-N 433.574 2.379 10 20 IECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccn(-c2ncccc2F)n1 765902558 AQEFSBLQHCELEF-UHFFFAOYSA-N 434.225 2.129 10 20 IECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n(-c2ncccn2)n1 768112480 DWWPSWYUJVFROL-UHFFFAOYSA-N 425.468 2.246 10 20 IECD O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914062 CBQPYQRIKMQZRB-JKSUJKDBSA-N 432.995 2.047 10 20 IECD COc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 774730947 ZYCFIWSIHWKCIW-QGZVFWFLSA-N 441.528 2.077 10 20 IECD O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)NCc1ccc(N2CCOCC2)c(F)c1 776285688 TVVAVUBCDPSLMT-UHFFFAOYSA-N 440.435 2.145 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCn4c3nc3ccccc34)CC2)cc1 778230414 CLLOYWSFFHJUOA-ZHACJKMWSA-N 431.496 2.297 10 20 IECD COc1ccc([C@@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)N2CCOCC2)cc1OC 779493889 QFTDRWHSDRYVLQ-MPYGFJLXSA-N 428.485 2.318 10 20 IECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(C)c3C(F)(F)F)CC2)cc1 782103900 JUVKTSGMBIUVNT-UHFFFAOYSA-N 426.443 2.391 10 20 IECD O=C(NCCCOC1CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 785548806 XWWPJJRNMJRAJZ-UHFFFAOYSA-N 435.540 2.259 10 20 IECD COc1cc(N2CCN(CCS(=O)(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 790340261 YBQYLDYJJLVNNS-UHFFFAOYSA-N 438.521 2.447 10 20 IECD CN(C)S(=O)(=O)c1ccc(CC(=O)NCc2cccc(Br)c2O)cc1 793973128 ZGMNFJZSMBFXLT-UHFFFAOYSA-N 427.320 2.264 10 20 IECD NS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1Cl 798329685 LCUFCYHKFVRUFM-UHFFFAOYSA-N 441.912 2.018 10 20 IECD COC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803296965 JZLIOLRRDGHDAZ-WIYYLYMNSA-N 425.529 2.074 10 20 IECD CC(C)N(C)CC1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803300720 VOIPPGQOMUJSJP-IBGZPJMESA-N 430.593 2.279 10 20 IECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc(N2CCOCC2)cc1 803308161 BEPFPAHOPRXKKR-NMEJYPJZSA-N 443.569 2.096 10 20 IECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2=O)cc1 803664767 RCJXQDBLWPIQAP-IBGZPJMESA-N 426.492 2.128 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@H](C)c3ccccc3F)CC2)cc1 803747389 QTOSOUMSPNUKSW-GOSISDBHSA-N 442.535 2.292 10 20 IECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 810208393 VBEAJMLMAYFUMJ-DYESRHJHSA-N 427.549 2.197 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccc(C(=O)NC2CC2)c1 917864772 XMLBRJZMLMIDIV-UHFFFAOYSA-N 429.542 2.236 10 20 IECD C[C@H](Oc1cccc(F)c1)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919074984 KERAYWNYZZEHRD-HNNXBMFYSA-N 434.439 2.428 10 20 IECD CN(C)c1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ccn1 919698028 QTXSWHUEDQSPNC-UHFFFAOYSA-N 435.507 2.333 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cc(C(=O)OC)c2ccccc21 1116669147 HWNSSSASTWRENW-KRWDZBQOSA-N 440.452 2.130 10 20 IECD Cc1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005490 JHPPNBVSLAQDNX-NRFANRHFSA-N 431.876 2.212 10 20 IECD Cc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790936706 XHNWFFOLSGYAII-IHPCNDPISA-N 439.512 2.027 10 20 IECD COC(OC)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1803355326 NMCDAGLTUOVHDM-SUMWQHHRSA-N 449.891 2.085 10 20 IECD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994394 WCDHDUKQBLEPSI-ABAIWWIYSA-N 442.369 2.108 10 20 IECD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1(O)CCC1 1814423245 ZLVUFFYUDSSSAM-SWLSCSKDSA-N 429.477 2.073 10 20 IECD NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294240 ASSPHDOSAQYWCL-ZDUSSCGKSA-N 435.868 2.046 10 20 IECD C[C@@H](Nc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501665 NPGLHAKXHHJJKD-CYBMUJFWSA-N 430.892 2.464 10 20 IECD COc1ccc(O)c(CNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1 734068307 CLYKEQDUXBOWQU-SFHVURJKSA-N 426.517 2.098 10 20 IECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1C 735314745 SMSZYBMGCHFULD-GOSISDBHSA-N 431.558 2.492 10 20 IECD COc1cccc(CNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)c1O 737284756 RBZGNMQWOGRAHY-UHFFFAOYSA-N 446.463 2.254 10 20 IECD COc1ccc(N2CCN(CCNC(=O)NCCc3cc(OC)ccc3OC)CC2)cc1 742928650 YTLBVSBXOPKQJH-UHFFFAOYSA-N 442.560 2.376 10 20 IECD COCc1cc([N+](=O)[O-])ccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 747202714 URXHGEDMUXGQDE-UHFFFAOYSA-N 449.514 2.257 10 20 IECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(CCN2CCOCC2)cc1 749731410 OOJPRADNNCZVRL-UHFFFAOYSA-N 434.587 2.255 10 20 IECD COC(=O)CC1(CS(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 752236396 VALJXBNHTDFVLA-GASCZTMLSA-N 428.526 2.202 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(F)c(C)c3)CC2)cc(OC)c1OC 759410880 YMSKGYYEQGYUIM-UHFFFAOYSA-N 431.464 2.447 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)CC2)cc1 764391577 ZFIYZSGNNZXCHU-WMZHIEFXSA-N 429.609 2.331 10 20 IECD CNC(=O)c1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)ccc1Cl 765903738 KEZIABJNAQXUID-UHFFFAOYSA-N 440.681 2.423 10 20 IECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 770508805 PHYNOGBTKXLTNQ-GOSISDBHSA-N 435.521 2.190 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccnc(N4CCCC4)c3)CC2)cc1 778223147 INDNDSADQVBZDG-CMDGGOBGSA-N 449.555 2.212 10 20 IECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CC(=O)N(C)C)CC3)cc2F)CC1 781374503 XEDCKJQYCJKBIK-UHFFFAOYSA-N 433.572 2.368 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1 785292866 BKQFOFZSMWFNOJ-JTQLQIEISA-N 445.369 2.458 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(OC(C)C)nc3)CC2)cc1 787979886 HPZBCZKHVQQSTE-UHFFFAOYSA-N 426.517 2.233 10 20 IECD CC(C)N(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842656 FLGFNNNOEJAIFK-UHFFFAOYSA-N 428.508 2.235 10 20 IECD C[C@@H]1CSCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950801 QPZOGZPGKXQLKD-CYBMUJFWSA-N 431.480 2.122 10 20 IECD CO[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 789951619 XKXFREGPWMHEMO-HXUWFJFHSA-N 443.466 2.186 10 20 IECD CC(=O)N1CCC[C@@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 794022232 FWHSXQYFYGLVGF-AWEZNQCLSA-N 437.543 2.243 10 20 IECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)c(O)c1 794377991 RWLOUPQHZDQXDE-OAHLLOKOSA-N 449.485 2.026 10 20 IECD COc1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)c(O)c1 794382312 VFZNHWGRQMLQCJ-UHFFFAOYSA-N 443.319 2.148 10 20 IECD CCOC(=O)c1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 795761877 VBDLWVYWEANBFQ-UHFFFAOYSA-N 434.514 2.391 10 20 IECD C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@@H](O)CN3CCOCC3)cc2Cl)C1 800720380 SEBHESOSYBOLMU-IEBWSBKVSA-N 439.000 2.411 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(N2CCOCC2)cc1 803301118 ZEVZZBXNQWDWCW-HTAPYJJXSA-N 439.512 2.006 10 20 IECD CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 803774812 NBFVFPIGLMBKGV-GFCCVEGCSA-N 426.516 2.048 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](OCC4CC4)C3)cc2F)CC1 805007694 XLGWWCJNKIOGPE-FQEVSTJZSA-N 446.567 2.001 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)NCC3(C(=O)N(C)C)CCCC3)cc2)CC1 805023061 NFRFXEUPQZESQH-UHFFFAOYSA-N 428.577 2.304 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(C(=O)c2ccccc2F)CC1 807095752 QVZWNWWXEWRHFR-UHFFFAOYSA-N 440.519 2.191 10 20 IECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O 808199436 VNBXUFGEHLZOOR-QFIPXVFZSA-N 449.555 2.342 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(CC(N)=O)cc3)cc2F)C[C@H](C)O1 811864293 VELCHNXVLVMXNS-HOTGVXAUSA-N 428.508 2.467 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)sc1C(C)=O 815499791 LGIMKUGEOTZCNO-UHFFFAOYSA-N 432.502 2.152 10 20 IECD COc1ccc(N2CCN(C(=O)[C@H](Cc3cccc(OC)c3)n3nnnc3C)CC2)cc1 915807594 LFUNXIYPWUSWRD-QFIPXVFZSA-N 436.516 2.131 10 20 IECD C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1ccccc1 919911979 XXUCFUZPAYFSKZ-INIZCTEOSA-N 428.508 2.291 10 20 IECD C[C@H]1Oc2ccccc2N(CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)C1=O 928484984 CLOHQFWUDGAFKH-MRXNPFEDSA-N 425.485 2.068 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 1324173433 WEPIQUVKRGEWRR-UHFFFAOYSA-N 447.557 2.157 10 20 IECD CC(C)O[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779171247 MPGWFCZSWJVICL-RBZFPXEDSA-N 426.897 2.008 10 20 IECD Cc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1780337067 NGDCDLHBDIUPRA-WZONZLPQSA-N 425.485 2.243 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ncccc1Br 1796601559 YEWDUPYGAVZXCG-CLLJXQQHSA-N 447.289 2.216 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCC2)c1cc(O)c(O)c(Cl)c1 1798179002 RFXVIAYTESRAJV-YOWGUQMCSA-N 430.892 2.460 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)C1CC(O)C1 1803052251 NXTOBCJNPTZZFS-GVPFSNJGSA-N 445.903 2.237 10 20 IECD CCN1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1804497168 PPURGYDCFOPVNI-QGZGNFAASA-N 443.544 2.187 10 20 IECD Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1805767244 VGYOFXYDMODGPT-IIBYNOLFSA-N 433.468 2.225 10 20 IECD O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994032 DQYLORLSDKXZSX-IIBYNOLFSA-N 434.452 2.227 10 20 IECD CC(=O)Nc1cccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1842164532 LNXLNMDXSYSHAV-UHFFFAOYSA-N 444.875 2.235 10 20 IECD CC(C)(C)n1ncc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1Cl 1843249168 DZGPEMBPFAKMKO-UHFFFAOYSA-N 433.896 2.229 10 20 IECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1OC 507987034 RMKQQWVFTPTCEZ-UHFFFAOYSA-N 439.921 2.362 10 20 IECD COc1ccc(N2CCC(NC(=O)NCc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 726612259 ZYNNTIDANKRTAX-UHFFFAOYSA-N 446.573 2.414 10 20 IECD O=C(CN1CCO[C@H](c2ccccc2F)C1)NCc1ccc(N2CCOCC2)c(F)c1 727434747 JNLDXIRKGHFIRE-QFIPXVFZSA-N 431.483 2.491 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@H]3CN3CCCC3=O)cc2)C1 732447771 CFXSUEHXVOCNTD-FPOVZHCZSA-N 441.576 2.075 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CN(C)C(=O)C3CC3)c2C)cc1 733511771 FUWDBYLYKSUPOW-UHFFFAOYSA-N 426.469 2.475 10 20 IECD COc1c([N+](=O)[O-])cc(N2CCN([C@H]3CCC[C@@H]3O)CC2)c([N+](=O)[O-])c1Br 742254940 KNUPIEXLJHCSRX-GWCFXTLKSA-N 445.270 2.310 10 20 IECD C[C@@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ncnc2[nH]cnc12 744474079 PDAYROUEIBNVJD-LLVKDONJSA-N 441.403 2.312 10 20 IECD O=C(COC(=O)[C@H]1OCCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 750051128 HOXGCWUWGJGGGY-QFIPXVFZSA-N 428.460 2.136 10 20 IECD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 751384186 AFPGPLLIBVBJCY-PMACEKPBSA-N 430.593 2.218 10 20 IECD CCc1nnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1C[C@@H]1CCOC1 752848282 JAQXALHOSDTDRI-INIZCTEOSA-N 431.537 2.229 10 20 IECD CCNC(=O)COc1cccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753845305 MDMCGWRDVLGGNW-UHFFFAOYSA-N 444.507 2.381 10 20 IECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1F 754045069 HRFAKZZEPZOYHB-UHFFFAOYSA-N 425.438 2.262 10 20 IECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)CC2)cc1 754070489 YUZZTBHJQXRLKE-CTNGQTDRSA-N 448.608 2.119 10 20 IECD COc1ccccc1N1CC[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 757284003 BNFNBSDFFSEANJ-HXUWFJFHSA-N 438.528 2.479 10 20 IECD COc1ccc(N(C)CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1Cl 757856831 HIYCXDYMCQUJKV-CQSZACIVSA-N 426.926 2.288 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(-c2cccnc2)s1 761372786 OXVAECKGPACXCP-UHFFFAOYSA-N 428.539 2.370 10 20 IECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCS(=O)(=O)C[C@@H](C)C3)c2C)cc1 763899612 COBXRIDQISGAAJ-HNNXBMFYSA-N 432.542 2.430 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(c4nccc(C(C)C)n4)CC3)CC2)cc1 767892545 YGPPFOLTYABNNG-UHFFFAOYSA-N 438.576 2.079 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CCN(C)C)Cc3ccco3)CC2)cc1 778319277 UBJUOZYPIAEHDP-KHPPLWFESA-N 440.544 2.083 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)CC2)cc1 778408780 BZGXLANGTCXWLC-ZXPCMVIKSA-N 447.626 2.396 10 20 IECD COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)on1 781274256 FUXDMCXFHKZTFN-NSHDSACASA-N 448.387 2.421 10 20 IECD Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295864 JQCXRVAGNNFZMF-HNNXBMFYSA-N 425.485 2.328 10 20 IECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)cc1 785428382 KQEBWCHFNPHWPE-UHFFFAOYSA-N 431.496 2.333 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H](C)c3ccsc3)CC2)cc1 785527055 JGKINBBQBCOJGK-QGZVFWFLSA-N 430.574 2.262 10 20 IECD CS(=O)(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1Cl 788329119 MKWNFTXHXUDHMC-UHFFFAOYSA-N 433.917 2.375 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOCc3ccccc3)cc2F)C[C@H](C)O1 789818241 JDZTXGMMRNOPJR-ROUUACIJSA-N 443.519 2.389 10 20 IECD C[C@H](NC(=O)C(=O)N1CCO[C@](C)(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803298386 SMXNRVDIQINYPU-DFBJGRDBSA-N 437.540 2.475 10 20 IECD CC(C)(O)[C@@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450819 SAQOWHWEWWSJFC-KRWDZBQOSA-N 425.476 2.135 10 20 IECD COc1c(C)cnc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 803666827 KZQMLAJFEFHGMX-GOSISDBHSA-N 427.501 2.237 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3cccc(F)c3)N(C)C)CC2)cc1 804315838 NPIPRBKLNSKQGP-JOCHJYFZSA-N 442.535 2.338 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N(CCCCO)C1CC1 807768187 DWXITPBNCXPEJO-OAHLLOKOSA-N 425.476 2.137 10 20 IECD C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H]1C 807771170 SFZRVEFMTFFXKT-FXUDXRNXSA-N 425.476 2.397 10 20 IECD C[C@@H]1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 807972689 UCYSMIKLQXDSPN-UXHICEINSA-N 442.604 2.156 10 20 IECD CCC(=O)N1CCCC[C@@H]1c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809464386 FCXVPOCJVSFGDO-LJQANCHMSA-N 441.532 2.433 10 20 IECD CC(C)OCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)no1 811973506 XWOIKHFQWIXFNZ-RDJZCZTQSA-N 444.536 2.257 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc([C@H]2CCOC2)cc1 815356061 BBNXQZWGAUPRMR-SFHVURJKSA-N 427.476 2.421 10 20 IECD CCOC(=O)c1nc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)sc1C(C)=O 815575386 QAVXVAKUQDZCBN-LLVKDONJSA-N 432.502 2.404 10 20 IECD O=C1CC[C@@]2(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)SCCN12 916456523 GZHYJWWHSQKWKJ-SFHVURJKSA-N 429.464 2.224 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CCCN3C(=O)NC(C)(C)C3=O)cc2F)C[C@@H](C)O1 917708334 AKTCUTLUWAHAPM-GASCZTMLSA-N 434.512 2.166 10 20 IECD CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917833867 UMJDGQQBRACTGB-KRWDZBQOSA-N 429.542 2.112 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 918304458 RQPRLWAKIVDPRR-UHFFFAOYSA-N 444.557 2.280 10 20 IECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(n3c(O)nc4ccccc43)CC2)c1 919809617 BOISLJWBWAOJJQ-UHFFFAOYSA-N 430.486 2.296 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc(NC(C)=O)c3)CC2)cc1 920255145 BPFHDLDZTVZMFA-ZHACJKMWSA-N 436.512 2.175 10 20 IECD O=C(CC[C@H]1CCOC1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784817545 VTHTULCUXIYIFA-LHSJRXKWSA-N 438.908 2.011 10 20 IECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n(C)n1 1800715828 QWIOQEBCXPAEKC-CLLJXQQHSA-N 434.880 2.059 10 20 IECD O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993257 TWSUEILZUFGKDA-UGSOOPFHSA-N 432.427 2.253 10 20 IECD O=C(CCc1ccccn1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721533 MUZHRPPUOJMCIB-CQSZACIVSA-N 439.497 2.203 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnoc1C1CC1)CC2)c1cc(O)nc(O)c1 1816722812 YNPWMVUCWWWJEP-LLVKDONJSA-N 441.469 2.354 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(O)n2)CC1 1825943064 DPSZIRYNLDMGKU-QGZVFWFLSA-N 426.473 2.141 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3c(F)cc(F)cc3[nH]2)C1 1843703905 KTKLMHMUJZTTOA-UHFFFAOYSA-N 428.395 2.383 10 20 IECD COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NCc3c(C)c4ccccc4n3C)c2)nn1 463781376 LEPDEPUXEOYSEN-UHFFFAOYSA-N 446.467 2.109 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4c3ccn4C)CC2)cc1 727035984 XRLPRYYBTZBFBY-UHFFFAOYSA-N 435.528 2.064 10 20 IECD C[C@H](OC(=O)C1(C(=O)NC2CC2)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729714332 HFZYDBPVBYFLNB-ZDUSSCGKSA-N 446.459 2.391 10 20 IECD COc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCOCC3)cc2)c(OC)c1 732453049 ROSXAXHKLKJFNT-UHFFFAOYSA-N 429.517 2.245 10 20 IECD CCOC(=O)CCCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 734842507 PUFNYZJNRQMHSE-UHFFFAOYSA-N 438.468 2.305 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(-n4cccc4)c3)CC2)cc1 737158615 MTPSGXHRZBCISU-UHFFFAOYSA-N 447.539 2.363 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O 743845075 NLNSVTOVQHGURJ-UHFFFAOYSA-N 446.507 2.119 10 20 IECD CCO[C@H](C)c1noc(CN2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)n1 745786689 NKNUTDVEHLRQBK-OAHLLOKOSA-N 434.516 2.400 10 20 IECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CNC(=O)OC(C)(C)C 749872928 XSRJRJLLEYCQOV-WMZOPIPTSA-N 447.580 2.348 10 20 IECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)OCCCO4)CC2)cc1F 754209587 ASCSQZNHPMGMBV-UHFFFAOYSA-N 429.448 2.283 10 20 IECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2c(=O)nc(O)c3ccccc32)cc1 757775494 ZOCHCNRXDHUETQ-IBGZPJMESA-N 436.512 2.376 10 20 IECD COC(=O)c1cc(F)ccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 758327693 XABYHYVPGDWWOK-UHFFFAOYSA-N 436.505 2.300 10 20 IECD COc1cc(N2CCN(C(=O)C(=O)Nc3c(F)cccc3F)CC2)cc(OC)c1OC 759409623 MCRWRPYKKKJWFD-UHFFFAOYSA-N 435.427 2.278 10 20 IECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 761057462 YDHDJLLGLPTBRV-UHFFFAOYSA-N 433.505 2.474 10 20 IECD COc1cccc(C(N)=O)c1OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 768512233 PGFFBOPPDYXVHS-HUUCEWRRSA-N 445.491 2.242 10 20 IECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3ccc(N4CCCCC4)cc3)CC2)C[C@H](C)O1 768778412 OVFVNCWLPNDEMG-PMACEKPBSA-N 436.622 2.149 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc4c3CCN4C(C)=O)CC2)cc1 769261329 QUXDTPKEFJXSKK-UHFFFAOYSA-N 436.512 2.282 10 20 IECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769327781 MDWLYWCBZFWQEV-LJQANCHMSA-N 447.580 2.244 10 20 IECD CNC(=O)COc1cccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 772487227 GUYWEBVVTIZSGQ-IBGZPJMESA-N 445.947 2.494 10 20 IECD CS(=O)(=O)N1CCCc2cc(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)ccc21 772776885 SONSGZQKJIEUNP-UITAMQMPSA-N 431.466 2.249 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1 774867458 XVTVROCPHAZQNR-HSZRJFAPSA-N 438.572 2.118 10 20 IECD COc1ccc(N2CCN(C(=O)CN3CCN(C(=O)C(C)(C)C)CC3(C)C)CC2)cc1 776036240 GSVZVJBZHIPPKC-UHFFFAOYSA-N 430.593 2.313 10 20 IECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 779221549 JTWSGPOEUWEKFG-MQSCRBSSSA-N 446.636 2.195 10 20 IECD C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(N2CCOCC2)cc1 784244694 DJDSRQFRLJPSFL-PGRDOPGGSA-N 437.544 2.470 10 20 IECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCOCC2)nc1 785857377 BAZYOSUKFGTDSQ-UHFFFAOYSA-N 426.517 2.069 10 20 IECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)cc2)CC1 786660114 WBKFRDBKHLFNCM-MKXGPGLRSA-N 425.451 2.327 10 20 IECD C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 787330221 VAMRYFXMUGYNAQ-WRWLIDTKSA-N 438.528 2.037 10 20 IECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789856215 QMJGXQKOFRLNRH-FQEVSTJZSA-N 432.634 2.340 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)COc3ccccc3)cc2F)CC1 793684412 APOFZZUBUDQXJV-GOSISDBHSA-N 442.535 2.168 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](Cc3ccccc3)CN(C)C)CC2)cc1 793723845 NTCIYFDOUWPLNI-NRFANRHFSA-N 438.572 2.023 10 20 IECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCS(=O)(=O)c2ccccc21 796545785 MAJUUIGILKSOAG-NRFANRHFSA-N 428.554 2.473 10 20 IECD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800048583 FPBILLWWVIKKRE-MGPUTAFESA-N 434.968 2.320 10 20 IECD COCCCS(=O)(=O)NCC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800343244 IJKJMALURZCSKK-OAHLLOKOSA-N 431.986 2.148 10 20 IECD COc1cc(Cl)ccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 805171370 MRLSFMBCJZHONE-UHFFFAOYSA-N 431.920 2.460 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CCn4c(C5CCCC5)nnc4[C@@H]3C)nc12 805789957 OOYUXGNWDCWQIV-ZDUSSCGKSA-N 425.493 2.438 10 20 IECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCC[C@@H](N(C)C)C1 806505800 YNJYHRDHRPZPNA-HZPDHXFCSA-N 426.355 2.492 10 20 IECD COc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2n1 807657238 SRJDXWLSMBUHCB-UHFFFAOYSA-N 448.523 2.355 10 20 IECD CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)cc1 808077723 JHEJGEJGHGCXSS-UHFFFAOYSA-N 446.572 2.433 10 20 IECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)O[C@H]1CNOC1 819749258 OYEBUPILUDVCCS-KQDRGBMMSA-N 429.317 2.097 10 20 IECD COC(=O)c1ccc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917099504 GARILYAUWVISRC-UHFFFAOYSA-N 429.492 2.197 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(N4CCOCC4)cc3)CC2)cc1 918461309 RNAAYJRFWIYQKK-UHFFFAOYSA-N 438.528 2.209 10 20 IECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)C3CCN(S(N)(=O)=O)CC3)c2C)c1 919064144 MEDMGLKBPVHVIC-UHFFFAOYSA-N 433.530 2.044 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 919860357 WAYYDXNADKUKCX-LEWJYISDSA-N 443.544 2.121 10 20 IECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nnc(-c2ccccc2)o1 1325763696 ONZYJGSMPFGLBK-INIZCTEOSA-N 425.441 2.371 10 20 IECD CCOc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 1343519667 JLSPXDCMIOUXGM-IBGZPJMESA-N 448.541 2.277 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ncccn2n1)c1cc(O)c(O)c(Cl)c1 1798037006 JSPJQWJWLUUQAS-BTTYYORXSA-N 441.875 2.360 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnc(O)[nH]2)C3)cc1 1799620794 ARZAFXUCQGOYEZ-RMFSNUHRSA-N 449.511 2.040 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccn2cncc2c1 1819157935 RTQOHDYCRLOKKU-QGZVFWFLSA-N 447.455 2.483 10 20 IECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(CO)o2)CC1 1829268721 JSVIHHWEUHIZPY-QGZVFWFLSA-N 429.473 2.125 10 20 IECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c(C)n1 1843442607 PJWBBZGCWSPAJX-UHFFFAOYSA-N 431.496 2.308 10 20 IECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(N2CCCS2(=O)=O)cc1 24499712 IOPCOVMMPUOAAD-UHFFFAOYSA-N 429.542 2.335 10 20 IECD COc1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(C)C 727177134 CVAQRPCIITYCMZ-GXDHUFHOSA-N 430.573 2.233 10 20 IECD Cc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 727223873 FXVATRKNSUYEQJ-OAHLLOKOSA-N 438.454 2.256 10 20 IECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)cc2F)CC1 730194899 XQPMXQXNROVDKI-LJQANCHMSA-N 439.535 2.028 10 20 IECD FC(F)Oc1ccc(N2CCC[C@@H](NC(=S)NCCCN3CCOCC3)C2)cc1 743016575 XLZWQHXBWALOAQ-MRXNPFEDSA-N 428.549 2.443 10 20 IECD CCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1cc(Br)ccc1O 744425333 DTWJERZMBJOECS-UHFFFAOYSA-N 442.335 2.263 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNc3ccc(C(=O)Nc4nncs4)cn3)cc2)C1 746389116 CLPRIJYEDHSUEG-INIZCTEOSA-N 437.529 2.499 10 20 IECD CN1CCCc2cc(CNC(=O)c3ccc(S(=O)(=O)NC[C@H]4CCCO4)cc3)ccc21 746879731 ONYFLSQSULQEPU-HXUWFJFHSA-N 443.569 2.456 10 20 IECD C[C@H](O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752652448 FTJSVODVNKONTP-HKUYNNGSSA-N 442.539 2.387 10 20 IECD CC1(C)CN=C(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)S1 754101337 SRZLDMPYFCOCQR-UHFFFAOYSA-N 435.569 2.371 10 20 IECD COC(=O)c1cc(F)c(C)c(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758233084 UINKXLKOHSESEM-IBGZPJMESA-N 432.492 2.491 10 20 IECD COc1ccc(N2CCN(C(=O)Nc3cccc4c3CCN4S(C)(=O)=O)CC2)cc1 758296925 VUAHGAZHQVVBFV-UHFFFAOYSA-N 430.530 2.371 10 20 IECD CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)COC(=O)c1cccc(O)c1O 758557448 IWTDADUMDYUCPX-UHFFFAOYSA-N 425.397 2.256 10 20 IECD CCC[C@@H](C)N1C[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1=O 759222838 XRJAESGIQCPWPD-SJORKVTESA-N 433.549 2.398 10 20 IECD COc1ccc(OC)c(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759876786 CFCFYLQZKFEKLI-UHFFFAOYSA-N 445.516 2.490 10 20 IECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(S(C)(=O)=O)c(F)c3)CC2)cc1 760560107 HXIJZWSJCWFFMC-UHFFFAOYSA-N 442.534 2.185 10 20 IECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ccn(C4CCCC4)n3)CC2)cc1 763245590 RLJHBFVYBDTHPA-UHFFFAOYSA-N 446.573 2.270 10 20 IECD COc1ccc(N2CCC(NC(=O)N3CCC(CN4CCN(C)CC4)CC3)CC2)cc1 764369075 RFFDHDFYTDINAN-UHFFFAOYSA-N 429.609 2.333 10 20 IECD CC(C)[C@@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1CCCS1(=O)=O 772676766 GACOTOLSIDPIML-QINHECLXSA-N 441.569 2.116 10 20 IECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)s1 773086545 CQAQJZUEFHCRCG-CQSZACIVSA-N 445.632 2.335 10 20 IECD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774363342 JBTYSJWHUBXHDK-HNNXBMFYSA-N 425.485 2.410 10 20 IECD COC(=O)c1cc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1F 778223665 NVESXOHBCPCMOE-MDZDMXLPSA-N 441.459 2.464 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3nc4ccccc4[nH]3)CC2)cc1 778224722 DEJPWWPLSSJQAJ-QXMHVHEDSA-N 433.512 2.435 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](c3cccs3)N(C)C)CC2)cc1 778226460 SCWHBBXFUIVESS-CTDFXDFQSA-N 442.585 2.381 10 20 IECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(OC2CCCC2)nc1 787255917 BQBKPBLNPUOZOI-UHFFFAOYSA-N 438.528 2.172 10 20 IECD Cc1cccc(C)c1OC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323229 KMYXPHVQMJYAND-LJQANCHMSA-N 425.529 2.340 10 20 IECD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)nc1 788909211 DOBKPROPHZRRKG-FQEVSTJZSA-N 449.555 2.484 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@H](Cc2ccccc2)C1 789841468 YXCJIWITBMWVMZ-HXUWFJFHSA-N 439.531 2.494 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@H](Cc2ccccc2)C1 789843732 CAHONBWNNUQTQK-JOCHJYFZSA-N 439.581 2.326 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Br)cc2C)ccc1O 790406703 FMALYBWRZUYROL-UHFFFAOYSA-N 435.321 2.172 10 20 IECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(C)c2Br)ccc1O 790406812 HTSNMPXRDUISTH-UHFFFAOYSA-N 435.321 2.172 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](n4cc(Cl)cn4)C3)CC2)cc1 794246921 NTINITGRVPWZAP-LIXSYLKWSA-N 443.935 2.224 10 20 IECD CNC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(C)c1 796715122 YBKHIZGKPHUHLE-UHFFFAOYSA-N 438.528 2.316 10 20 IECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CN(C)C(=O)N4)cs2)cn1 799187434 SEMYCWCEVUGYPE-UHFFFAOYSA-N 448.530 2.431 10 20 IECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 799254680 CSPLTGSDERSFEY-JOCHJYFZSA-N 448.523 2.236 10 20 IECD CCN(CC)c1ccc(CNC(=O)Nc2cccc(C(=O)NCC(=O)NC)c2)cc1F 800595559 AVXSMDHZDGMQAT-UHFFFAOYSA-N 429.496 2.469 10 20 IECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOCC2(CCC2)C1 803451292 IUVSODLSFSHKJK-UHFFFAOYSA-N 437.487 2.402 10 20 IECD COc1ccc(N2CCN(CCNC(=O)C(=O)NC3CCC(C(C)C)CC3)CC2)cc1 803750416 MHQVWCOSKDKVDS-UHFFFAOYSA-N 430.593 2.264 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N(C)Cc3ccccc3)CC2)cc1 804318950 WDYUPQXARSZIFX-IBGZPJMESA-N 438.572 2.417 10 20 IECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 806866560 KSUTXVPKAHGHGD-QGZVFWFLSA-N 438.528 2.431 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 807098046 SNHAMSJUDZXYDA-UHFFFAOYSA-N 427.520 2.413 10 20 IECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 807512686 DNVDIZARDSMBCF-UHFFFAOYSA-N 429.281 2.284 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)CC2)cc1 809542188 CHZPTXPXZVFRFH-NJYVYQBISA-N 427.545 2.198 10 20 IECD COc1c(F)cc(CC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1S(N)(=O)=O 915641989 XFOOKEVZPCNLHM-UHFFFAOYSA-N 435.521 2.281 10 20 IECD CCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C[C@H]1COc2ccccc2O1 916987008 AJAKBBXGCZWJGL-IBGZPJMESA-N 443.519 2.440 10 20 IECD O=C(CN1CCCN(Cc2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917022827 KFVMJYYTOHOLBU-UHFFFAOYSA-N 440.563 2.486 10 20 IECD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 918744805 PYRGIJWNMIZOMG-CYBMUJFWSA-N 441.550 2.399 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-n4cnnc4)c3)CC2)cc1 1348241898 PJIISCRGMKXLJH-MDZDMXLPSA-N 432.484 2.119 10 20 IECD CC(C)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779171249 MPGWFCZSWJVICL-XCLFUZPHSA-N 426.897 2.008 10 20 IECD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1 1780778635 ZPTUMQILCNRMSY-RXVLNYDTSA-N 438.480 2.269 10 20 IECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H]2C=CCN2)CCO3)cc1 1781754040 QHYPPANHCAFKAF-WIOPSUGQSA-N 434.540 2.066 10 20 IECD O=C(CC1CCOCC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002656 VBUJDSQHRUTVKV-NRFANRHFSA-N 438.908 2.011 10 20 IECD Cc1[nH]ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243297 DKKJEPXLIUWDHP-QITLCBANSA-N 433.892 2.295 10 20 IECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc([N+](=O)[O-])cc1F 1796604947 XYMGOHCFJATOID-CLLJXQQHSA-N 430.392 2.106 10 20 IECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1OC 1799637383 OKBBCOCTMRNELP-MUJYYYPQSA-N 427.457 2.076 10 20 IECD CCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190214 UBNYEQDKWAGEPB-YJBOKZPZSA-N 448.614 2.384 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1cc(O)nc(O)c1 1817844237 UTIAKJPPFAWCOK-INIZCTEOSA-N 435.440 2.405 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1nccc2nc[nH]c12 1817929202 XRKVIIMPGDWDNO-CQSZACIVSA-N 448.443 2.107 10 20 IECD C[C@@H](CN)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877627 VSSMJMSGQOOALV-UCSQHBGMSA-N 431.533 2.031 10 20 IECD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccoc1Cl 1836211403 QKLXOLAQFWSNLS-UHFFFAOYSA-N 448.907 2.238 10 20 IECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3F)CC2)CC1 1837013138 FMLPCHHDNFZCHT-UNGYOBTISA-N 448.491 2.173 10 20 IECD O=C(c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433945 YVAQZXLZYQICAE-QFIPXVFZSA-N 446.887 2.135 10 20 IECD O=C([C@H]1CCC(F)(F)C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440898 RMKFPRUZHXPMPR-HNNXBMFYSA-N 430.455 2.418 10 20 IECD O=C([C@@H]1CCc2ccoc2C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034711 NUNUZKWXCHNHLD-QQOXCAACSA-N 438.480 2.418 10 20 IECD Cc1ccc(OCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847039203 SEDXNBGVZUNYPH-UXBLZVDNSA-N 438.480 2.407 10 20 IECD O=C(c1ccccc1SCC(=O)N1CCc2ccccc21)N1CCS(=O)(=O)CC1 110664192 RQLDFGFFDVYMBH-UHFFFAOYSA-N 430.551 2.239 10 20 IECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1ccc(-n2cnnn2)cc1 727243804 YKYIFMOWSRJEKM-UHFFFAOYSA-N 428.455 2.315 10 20 IECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(N4CCCC4=O)CC3)CC2)cc1 729587064 NATRQVVQINTCQX-UHFFFAOYSA-N 443.592 2.004 10 20 IECD CN(C[C@@H](O)COCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 732889779 UUWHXEZTLWFKIW-HXUWFJFHSA-N 431.508 2.381 10 20 IECD COCCS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 733632968 GMFMMGJWARJSSX-UHFFFAOYSA-N 433.530 2.265 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCO[C@@H](C(F)(F)F)C3)cc2F)C[C@@H](C)O1 739923741 XISAGWPOAZBGGQ-QWQRMKEZSA-N 433.446 2.319 10 20 IECD CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(N)=O)cn2)NC(=O)OC(C)(C)C)cc1 742754901 RNKHKFHBDKHELT-SFHVURJKSA-N 427.505 2.242 10 20 IECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)NC(=O)CC3CCCCC3)nc12 750237014 UCPGMKXHJHKVDF-ZDUSSCGKSA-N 432.477 2.130 10 20 IECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccc(OC)c(OC)c4)C3=O)CC2)cc1F 753977625 HBLXBVRBDWPIOH-GOSISDBHSA-N 443.475 2.306 10 20 IECD CCN(CC)c1ccc(CNC(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)cc1F 760803349 TVLPWIKGEVAZFY-UHFFFAOYSA-N 438.525 2.200 10 20 IECD C[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(=O)(=O)C1CCOCC1 765687630 VALBFXXDVZQDEF-LSDHHAIUSA-N 446.516 2.355 10 20 IECD COc1ccc(C(=O)NCc2cccc(Br)c2O)cc1S(=O)(=O)N(C)C 765764049 GJVPUUVZDANBNX-UHFFFAOYSA-N 443.319 2.344 10 20 IECD CN(C)C(=O)c1cc(F)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 767636941 WUARDJGYJKCFSK-UHFFFAOYSA-N 432.471 2.232 10 20 IECD CCN1CCN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c(C)c2)CC1 769615722 BQTVBHIXMLGJIY-UHFFFAOYSA-N 432.546 2.466 10 20 IECD O=C(CN1C(=O)c2ccccc2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771057322 IDKWGHSMWWLDPD-MRXNPFEDSA-N 427.888 2.422 10 20 IECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1C(=O)[C@H](C)Oc2ccccc21 777828581 LNEOOJSIOWPSHA-ZDUSSCGKSA-N 432.860 2.361 10 20 IECD CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778928774 BIGPQFYACRXBMK-DPCFLFMUSA-N 436.555 2.426 10 20 IECD CCN(CC)c1ccc(CNC(=O)N2CCN(Cc3nc(COC)no3)CC2)cc1F 780430746 QTKWCGIMTHCUQB-UHFFFAOYSA-N 434.516 2.229 10 20 IECD CC(C)CN1CCC(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 786331491 QBBVFNQDVNNMNF-HDICACEKSA-N 448.583 2.292 10 20 IECD CCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)c1 787215574 RRQMYUSQFJLAMB-UHFFFAOYSA-N 442.535 2.299 10 20 IECD CCOc1ncccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 787283481 JOTGJYZWOKQSKU-MRXNPFEDSA-N 448.470 2.483 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccccc1CN1CCCC1=O 787428940 AEQZVDDQEVOODL-UHFFFAOYSA-N 432.524 2.118 10 20 IECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 789813272 RLBTUJWLPFWHQV-KNQAVFIVSA-N 441.503 2.173 10 20 IECD CCc1noc(CC)c1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823106 CUTZJAWOOGDERB-GASCZTMLSA-N 446.523 2.485 10 20 IECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 789844368 FZKPSUURPNLNAM-KNQAVFIVSA-N 442.629 2.331 10 20 IECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cccc1[N+](=O)[O-] 789860870 NDGDIOUBSAKKPA-UHFFFAOYSA-N 428.514 2.389 10 20 IECD COC(C)(C)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950854 RLQZBLMPHIZKTP-CQSZACIVSA-N 445.482 2.478 10 20 IECD C[C@H]1COC(C)(C)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951307 VFRPOHZNJNBNGN-AWEZNQCLSA-N 443.466 2.184 10 20 IECD C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NCc1cccc(Br)c1O 792484100 JWQIKTXQIXVYDR-INIZCTEOSA-N 449.223 2.403 10 20 IECD CCC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716279 BRNLHJAZTQJGBS-SBHAEUEKSA-N 428.577 2.480 10 20 IECD O=C(NC1CCN(c2nccs2)CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 803173544 JKKTXIRLRRTFBZ-GOSISDBHSA-N 444.557 2.142 10 20 IECD Cc1csc(CCCCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 804397229 VJBZTHOBWZJYFO-UHFFFAOYSA-N 430.574 2.386 10 20 IECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCN(C)C3CCN(C)CC3)cc2)CC1 805024334 RVZXYHCVHZVCHB-UHFFFAOYSA-N 443.636 2.024 10 20 IECD CC(=O)NCC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 805825076 JHLXIOLEZRARAF-NSHGMRRFSA-N 448.583 2.294 10 20 IECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1 807025213 RBPNBHQDQVKRIU-ZDUSSCGKSA-N 432.448 2.481 10 20 IECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCc2c(ncn2-c2ccccc2)C1 807291635 GHNGGTQIFRBDDK-UHFFFAOYSA-N 427.508 2.450 10 20 IECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21 807768439 JRAKZYDLDMPDHN-FDPIWHGQSA-N 437.487 2.447 10 20 IECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 808775498 CSFVQTYVOWWJJK-GOSISDBHSA-N 438.638 2.093 10 20 IECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCOC4(CCSCC4)C3)CC2)cc1 809456822 CBUNUGLJUZWXLV-SFHVURJKSA-N 447.601 2.295 10 20 IECD CN(C)c1cc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(N(C)C)c1 810023061 SWJIAFLOCLBPSF-UHFFFAOYSA-N 430.524 2.490 10 20 IECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1 832426944 NOBXKAXPHQXCJS-UHFFFAOYSA-N 425.576 2.214 10 20 IECD COc1ccc(CNC(=N)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC 849070693 UFYVSOKXYWPEDC-SFHVURJKSA-N 425.533 2.220 10 20 IECD CCOC(=O)Cc1csc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 918000475 HQUUEOLAFSBKSI-OAHLLOKOSA-N 445.545 2.272 10 20 IECD COc1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1OC 918015757 CUPFGUJTIYNNOO-GOSISDBHSA-N 426.517 2.405 10 20 IECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3OCCO4)cc2F)C[C@@H](C)O1 918286279 GNAMFQKJAVDECH-HUUCEWRRSA-N 443.475 2.465 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(N2C(=O)CCC2=O)c1 919969668 VZATVNDQSQBLSI-UHFFFAOYSA-N 425.460 2.370 10 20 IECD COC(=O)c1cc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)oc1C 1320176075 SQRRLQYEYPCWCF-UHFFFAOYSA-N 447.488 2.432 10 20 IECD CCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1790839112 XPJOGRZNTQCSLU-QRFRQXIXSA-N 440.544 2.195 10 20 IECD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)C1=CCCC1 1806221839 QOMDVRWFFMMSHV-VQIMIIECSA-N 444.582 2.058 10 20 IECD CCn1nc(C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845027 UWLIDJGGZZGYJD-OAHLLOKOSA-N 439.476 2.360 10 20 IECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)[nH]n1)c1cc(O)nc(O)c1 1817846795 BKLIHUNQFUAVDE-WQVQDQMGSA-N 427.486 2.397 10 20 IECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ncccc1F 1819973970 QBQPFUIIAXWLIM-CQSZACIVSA-N 426.408 2.370 10 20 IECD O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)c1ccco1 1827424460 XTVQWCXCQRXTEI-MRXNPFEDSA-N 427.457 2.202 10 20 IECD Cc1ccn(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030310 MEKFIKJEAFJNPN-UHFFFAOYSA-N 442.516 2.066 10 20 IECD C[C@H](CC(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1ccccc1 1847056286 ZONNPEONDRHBQY-OAHLLOKOSA-N 431.583 2.244 10 20 IECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1 12068982 MWOMUSTWLPVUPM-UHFFFAOYSA-N 449.573 2.203 10 20 IECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)ccc2O1 533097724 FCJIZEYYHUVOST-HXUWFJFHSA-N 432.498 2.207 10 20 IECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Br)c1O 730278278 JUKXKUCFKUEQCH-UHFFFAOYSA-N 439.331 2.320 10 20 IECD COc1cc(C)cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1O 730356751 FAUKEQYGHUSBPE-UHFFFAOYSA-N 432.448 2.158 10 20 IECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nn(-c2ccc(F)cc2)ccc1=O 731808264 NNTAHBIVXREJTO-UHFFFAOYSA-N 440.450 2.402 10 20 IECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)Oc4ccccc43)cc2F)CC1 732478713 YJCPXGRPFMXYPV-KRWDZBQOSA-N 440.519 2.398 10 20 IECD O=C(CN1CCN(CC2CCOCC2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 736319330 YWGWRZMMAGYMDL-UHFFFAOYSA-N 447.535 2.445 10 20 IECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(F)c(F)c(F)c3)cc2)C1 742279917 LBZSZVFDANYVNQ-ZDUSSCGKSA-N 427.448 2.284 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)cc1F 746040482 YEKSPZHIJZDKRI-UHFFFAOYSA-N 443.523 2.427 10 20 IECD O=C(Nc1cnn(Cc2ccccn2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 746363316 RXUAVGSYKBWTQC-HXUWFJFHSA-N 435.484 2.178 10 20 IECD O=c1ccc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2[nH]1 751227047 BAEJETWQDTUHTN-UHFFFAOYSA-N 431.489 2.107 10 20 IECD CCC(=O)NCc1cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1OC 751966873 LXPSKDBWMWMUOS-UHFFFAOYSA-N 447.557 2.241 10 20 IECD O=C(CN1CCC[C@H]1C[C@@H](O)c1ccco1)NCc1ccc(N2CCOCC2)c(F)c1 758822392 HKWPYICPYXUTFS-GHTZIAJQSA-N 431.508 2.460 10 20 IECD COc1ccc(N2CCC(NCc3ccc(S(=O)(=O)N4CCOCC4)cc3)CC2)cc1 764635991 OKOWQVHUGLDMIM-UHFFFAOYSA-N 445.585 2.475 10 20 IECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@]4(CCN(C(=O)OC(C)(C)C)C4)C3)nc12 765037385 YDSKWMNCISCAKH-JOCHJYFZSA-N 445.520 2.445 10 20 IECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc([S@](C)=O)c(F)c3)CC2)cc1 774210049 QDCWDEIFGMRNQD-PMERELPUSA-N 433.505 2.295 10 20 IECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(Cl)ccnc3Cl)CC2)cc1 777995494 PYGCWAIFCUHKJZ-UHFFFAOYSA-N 445.372 2.498 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CC(=O)c3ccco3)CC2)cc1 778326862 ZETUQIAXQYUBGK-IBSYWUHOSA-N 425.485 2.271 10 20 IECD CSCC[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 782187648 RMLXYEMHNKIJAU-RBSFLKMASA-N 435.498 2.121 10 20 IECD COc1ccc(N2CCC(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)CC2)cc1 784392522 IDKDARLQTAAXLF-VXKWHMMOSA-N 427.545 2.221 10 20 IECD CCC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786122322 RUFPZGPWQOSYLC-UHFFFAOYSA-N 444.557 2.182 10 20 IECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(N2CCNC2=O)cc1 786842070 WSQATCDMZHJZHE-QGZVFWFLSA-N 428.558 2.302 10 20 IECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C)c(C(=O)N2CCOCC2)c1 787494151 MVUZTOYDTGWCFL-UHFFFAOYSA-N 438.528 2.097 10 20 IECD C[C@@H]1CCCCN1C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321093 SKRUPCWVPWTJDB-IRLDBZIGSA-N 442.604 2.252 10 20 IECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789801201 ZJKVJUIBWXEBHP-HXUWFJFHSA-N 445.491 2.034 10 20 IECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOCc3ccccc3)cc2F)C[C@@H](C)O1 789818232 JDZTXGMMRNOPJR-HDICACEKSA-N 443.519 2.389 10 20 IECD COc1ccc(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc1 789903953 FPPDTIIXIOSGGT-UHFFFAOYSA-N 436.491 2.205 10 20 IECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccccc1S(=O)(=O)C(F)F 794591162 YMMWAFGJYYLPTG-UHFFFAOYSA-N 432.470 2.337 10 20 IECD C[C@@H]1C[C@H](N2CCOCC2)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 796377393 LGTHNIOPINPKCF-SJORKVTESA-N 433.508 2.196 10 20 IECD NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 798334122 OAUZAMBWQAENEC-CQSZACIVSA-N 441.912 2.227 10 20 IECD CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1 799520664 IVUKNYDKAXTGTK-UHFFFAOYSA-N 431.923 2.214 10 20 IECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(N2CCOCC2)cc1 803298335 BLQFEVXLZMJYFU-HNNXBMFYSA-N 434.587 2.456 10 20 IECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC[C@@H]1NC(=O)OC(C)(C)C 803662548 CXJDHIAVZRRMFA-YOEHRIQHSA-N 436.528 2.270 10 20 IECD CN1CCCc2cc(CNC(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C3CC3)ccc21 803686180 YLMQFXNQUNIRLK-UHFFFAOYSA-N 430.549 2.201 10 20 IECD CNS(=O)(=O)N1CCC(C(=O)OCC(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 803938002 BSKYKYSFRJTCOJ-UHFFFAOYSA-N 447.557 2.305 10 20 IECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3csc(C)n3)CC2)cc1F 804852546 BOUYGDAPACUVKN-UHFFFAOYSA-N 447.580 2.397 10 20 IECD CC(C)(C)OC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292328 WMRKNVYVNZJAKI-UHFFFAOYSA-N 428.533 2.148 10 20 IECD Cc1ccccc1O[C@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807636523 XONMGFJIQRRPJX-LJQANCHMSA-N 425.529 2.374 10 20 IECD O=C(O)[C@@H]1CC(=O)N(c2ccc(S(=O)(=O)Nc3cc(Cl)c(O)cc3F)cc2)C1 808115232 UGGSKHFMEHDUIV-SECBINFHSA-N 428.825 2.423 10 20 IECD Cc1cc(N2CCC[C@H](NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2)n(C)n1 809871076 DFAHWWQYELTHAJ-IBGZPJMESA-N 438.576 2.071 10 20 IECD CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H]2C[C@H]21 814338624 RKJDAYSHMHYJHG-LFGUQSLTSA-N 442.560 2.402 10 20 IECD C[C@H](c1ccc(F)cc1)N1CC[C@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 815197868 SNNBEZKUZKIDDE-XIKOKIGWSA-N 436.461 2.422 10 20 IECD COC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 913660763 FXSUWQHZOWIPPP-UHFFFAOYSA-N 435.458 2.352 10 20 IECD COc1ccc(N2CCN(C(=O)[C@@H](Cc3cccc(OC)c3)n3nnnc3C)CC2)cc1 915807593 LFUNXIYPWUSWRD-JOCHJYFZSA-N 436.516 2.131 10 20 IECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 918287102 OBBGVHNZOMMNNM-HUUCEWRRSA-N 443.475 2.481 10 20 IECD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2=O 919969943 JTARIWUAFWXPHL-XDHUDOTRSA-N 442.560 2.012 10 20 IECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1 920253158 SBYPPQCXVJOFBB-OUKQBFOZSA-N 436.512 2.241 10 20 IECD CNC(=O)Cc1ccccc1NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1322904762 KFKFHFMXCIRQAI-UHFFFAOYSA-N 439.560 2.318 10 20 IECD Cc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785507320 NMCYHFZOTFJCEB-UMESLIDUSA-N 438.480 2.269 10 20 IECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc[nH]3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243308 GKHYEZBAHZUVKC-AXHNFQJDSA-N 447.919 2.305 10 20 IECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)nc1 1796934244 FWKPVEMOOXXFKW-VBUUOAMHSA-N 447.495 2.135 10 20 IECD C[C@@H](Cc1ccco1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770322 MSPQIFXWRULXPZ-FIIQBIKZSA-N 448.903 2.426 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccncc1F)CC2)c1cc(O)nc(O)c1 1816724711 BRMOPQZDIKBSSW-SNVBAGLBSA-N 429.433 2.023 10 20 IECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCSC1)CC2)c1cc(O)nc(O)c1 1816729238 YGDXBMQFWAAPCD-CMPLNLGQSA-N 434.543 2.318 10 20 IECD CC(C)(C)OC(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843432 OARPKGANGAAARC-CQSZACIVSA-N 445.476 2.254 10 20 IECD COc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)c1 1822093785 YCTRFPMJFJGSDA-ZDUSSCGKSA-N 440.481 2.498 10 20 IECD O=C1C[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CN1 1831417895 HRLBHLNHSMOREE-NVXWUHKLSA-N 449.935 2.121 10 20 IECD