smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@H]1C[C@@H]1NC(=O)c1cc(S(=O)(=O)Cl)c(F)cc1F 115020365 JWTWMXSYYIXSKB-CDUCUWFYSA-N 309.721 2.031 70 10 DEIE CCc1nc(S(=O)(=O)Cl)cn1Cc1nc(C)c(C)s1 215818617 QKWVPURHXSQYIG-UHFFFAOYSA-N 319.839 2.495 70 10 DEIE CCOCCCn1nc(CC)c(S(=O)(=O)Cl)c1CC 130460171 DGPSGJIVGYXXRL-UHFFFAOYSA-N 308.831 2.362 70 10 DEIE Cn1nnc(C(=O)N2CC[C@@](C)([B-](F)(F)F)C2)c1C(F)F 2368351367 RBAXNYGGBZYTAB-SNVBAGLBSA-N 311.043 2.206 70 10 DEIE O=C(Nc1ccc(S(=O)(=O)Cl)cc1F)[C@@H]1C[C@@H]1CF 1875728572 MAKHYEUZZHDXQV-HTRCEHHLSA-N 309.721 2.297 70 10 DEIE CCc1ncsc1C(=O)Nc1ncc(S(=O)(=O)F)s1 1131810631 VCECNXVEAAHIPX-UHFFFAOYSA-N 321.380 2.073 70 10 DEIE O=C(Nc1cccc(S(=O)(=O)F)c1)c1cnc2cc[nH]c2c1 1585438662 IDVAOPOLCGNTPK-UHFFFAOYSA-N 319.317 2.473 70 10 DEIE C[C@@H](C1CCOCC1)N(C)CCC[C@H](C)S(=O)(=O)Cl 2126232205 RTABWYUSDLBKLI-RYUDHWBXSA-N 311.875 2.471 70 10 DEIE O=C1CCCc2c1ccc(=O)n2CCCOCC(F)(F)F 161045650 AFZBMAVNOBGSKM-UHFFFAOYSA-N 303.280 2.336 70 10 DEIE CCc1cccc(CC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)c1 159860507 OHYNBRPAZCRRBE-OAHLLOKOSA-N 302.418 2.307 70 10 DEIE O=C(CSCCN1CCOCC1)c1c[nH]c2ccccc12 159880714 MAEBWQSTBGGWDR-UHFFFAOYSA-N 304.415 2.416 70 10 DEIE Cn1cc(COc2c(F)cc(F)cc2S(=O)(=O)Cl)cn1 112360213 XYXXNPRFCCDOHP-UHFFFAOYSA-N 322.720 2.205 70 10 DEIE CC(C)(C)NC(=O)[C@@H]1COc2ccc(S(=O)(=O)Cl)cc21 115787612 HCUHQNDRJMOVLI-SNVBAGLBSA-N 317.794 2.005 70 10 DEIE CC1(C)CCC[C@@H](C(=O)N2CC[C@H](S(=O)(=O)F)C2)CC1 1968235338 KOEFWNVCLIWBBD-NEPJUHHUSA-N 305.415 2.493 70 10 DEIE Nc1c(F)c(S(=O)(=O)F)cc(Cl)c1Br 1928568130 PZEUUHYQLFMQHH-UHFFFAOYSA-N 306.515 2.482 70 10 DEIE C[C@H](CS(=O)(=O)Cl)c1n[nH]cc1NC(=O)OC(C)(C)C 1953053395 NZZZPBXFZXUZOF-SSDOTTSWSA-N 323.802 2.429 70 10 DEIE Cc1ccc(C(=O)O[C@H]2CCCOC2)cc1S(=O)(=O)Cl 2152522285 OHPHXRYFBZGVRM-NSHDSACASA-N 318.778 2.258 70 10 DEIE CCN(CCCO)C(=O)c1cc(Cl)c(OC)c(OC)c1 160444554 HDFFVFKIZGRPPN-UHFFFAOYSA-N 301.770 2.202 70 10 DEIE Cc1sc(CNC(C)C)cc1S(=O)(=O)NC[C@@H]1C[C@@H]1C 160794060 QAYVZQWVUQWIDF-JQWIXIFHSA-N 316.492 2.489 70 10 DEIE C[C@H]1CN(C(=O)c2ccc(S(=O)(=O)Cl)cc2F)[C@@H]1C 706896877 GUDVDRWKOIBLQB-JGVFFNPUSA-N 305.758 2.234 70 10 DEIE Cc1ccc([N+](=O)[O-])c(S(=O)(=O)Cl)c1OC(F)F 2055191343 PAMMNPSOVMYHSK-UHFFFAOYSA-N 301.654 2.432 70 10 DEIE COc1c(OC(F)(F)F)ccc(C=O)c1S(=O)(=O)Cl 2055379085 OMSDFEDIMHJHSO-UHFFFAOYSA-N 318.656 2.334 70 10 DEIE CO[C@](C)(Cn1cc(S(=O)(=O)Cl)cn1)c1ccccc1 384823446 WSZIFVZJICXYBP-CYBMUJFWSA-N 314.794 2.372 70 10 DEIE F[B-](F)(F)c1cnc(OC[C@@H]2C[C@H]3CCCC[C@H]3O2)nc1 2172634020 HNUNPXZFVOJMST-ADEWGFFLSA-N 301.097 2.258 70 10 DEIE CC(C)CN1CC[C@H](N(C)c2ccc([B-](F)(F)F)cn2)C1 2172785711 MPYAIOCGQNLTCG-ZDUSSCGKSA-N 300.157 2.303 70 10 DEIE Cc1ccc([B-](F)(F)F)c(N2CC[C@H](CCN(C)C)C2)n1 2172765785 WPDOZOXYRGDTDO-LBPRGKRZSA-N 300.157 2.222 70 10 DEIE CN(CCN1CCCCCC1)c1ccc([B-](F)(F)F)cn1 2172780226 NNZBDGTWJKEIFU-UHFFFAOYSA-N 300.157 2.448 70 10 DEIE CN1CCC[C@@H]2[C@H]1CCN2c1ncc([B-](F)(F)F)cc1Cl 2172793636 HWCADEXZOBNYMW-VXGBXAGGSA-N 318.559 2.462 70 10 DEIE O=S(=O)(c1ncccc1F)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194172634 GPCPUSHNNNLUGW-LDYMZIIASA-N 323.100 2.223 70 10 DEIE O=C(c1cc(S(=O)(=O)Cl)c[nH]1)N1CCCCC12CCC2 2183228189 QEWHUNHUJQOLHB-UHFFFAOYSA-N 316.810 2.491 70 10 DEIE CC(C)(CC(F)F)C(=O)Nc1ccc(S(=O)(=O)F)nc1 2190260339 HMYQFONUUTYFHV-UHFFFAOYSA-N 310.297 2.360 70 10 DEIE CO[C@H]1CN(c2cc(C)c([B-](F)(F)F)cn2)CC(F)(F)C1 2185153583 GSXAZGPHZKEKCJ-SECBINFHSA-N 309.067 2.305 70 10 DEIE Cc1c(OC[C@@H]2OCC[C@@H]2F)ccc(S(=O)(=O)F)c1C 2191413438 FQHTYSVOTWRQHO-JQWIXIFHSA-N 306.330 2.467 70 10 DEIE CC1CC(COc2ccc(C(=O)O)cc2S(=O)(=O)F)C1 2191425658 GZBUGSQVJXPMAS-UHFFFAOYSA-N 302.323 2.468 70 10 DEIE C[C@H]1[C@@H](C)[C@H](N(C)c2ccc([B-](F)(F)F)cn2)CCN1C 2193653413 UJKWGWYRSGVKGD-NTZNESFSSA-N 300.157 2.301 70 10 DEIE COC[C@]12C[C@](CN3CC[C@@H]4C[C@@]4([B-](F)(F)F)C3)(CO1)C2 2206030784 SRLBJCVQBGQGGH-YIYPIFLZSA-N 304.141 2.495 70 10 DEIE O=C([C@H]1CCn2nccc2C1)N1CCC([B-](F)(F)F)CC1 2239527324 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Fc1ccc([B-](F)(F)F)cc1OC[C@@H]1C[C@H]2OCC[C@H]2O1 2163199739 OVLJPBWLIKYKFO-UFGOTCBOSA-N 305.056 2.205 70 10 DEIE C#C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cl)cc2)C1 692285716 HUOHEROGGATSBS-LLVKDONJSA-N 311.790 2.100 70 10 DEIE O=S(=O)(Cl)CCOCCO[C@H]1[C@H]2CC[C@H]3[C@@H](C2)C[C@H]31 1897493807 LPZQDNVJHTULLG-NWBUJAPZSA-N 308.827 2.023 70 10 DEIE O=C(N[C@@H]1[C@H]2C[C@H]1N(C[B-](F)(F)F)C2)OCc1ccccc1 1953264614 QXYGOELZGIYXIZ-YNEHKIRRSA-N 313.108 2.372 70 10 DEIE COC[C@@]1(F)CCN(c2ncc([B-](F)(F)F)cc2Cl)C1 2123237349 GFJJGVCBTXOOEA-LLVKDONJSA-N 311.495 2.354 70 10 DEIE Cc1oc(C(=O)N[C@@H]2CCC[C@@H]2F)cc1S(=O)(=O)Cl 2118931216 BIPJCIBYRZYDTE-JGVFFNPUSA-N 309.746 2.136 70 10 DEIE O=C(NC1(CC2CC2)CC1)c1cc(S(=O)(=O)Cl)c[nH]1 2133375534 PHJLVFDUBYYZPU-UHFFFAOYSA-N 302.783 2.005 70 10 DEIE Cc1cc(C(=O)N2CCS(=O)(=O)C(C)(C)C2)c(C)s1 159973461 DRMCYYGONWQIBH-UHFFFAOYSA-N 301.433 2.014 70 10 DEIE C#CCCCOc1cc(F)c(S(=O)(=O)Cl)cc1[N+](=O)[O-] 133808045 FUJDUDOGODQPEU-UHFFFAOYSA-N 321.713 2.454 70 10 DEIE CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1 161235100 RCDGLULTMGDLGJ-PBHICJAKSA-N 303.450 2.207 70 10 DEIE C[C@H](O)c1ccc(N2CC[C@H]3NC(=O)CC[C@@H]3C2)cc1Cl 160455789 ANVVQRCZVNDVTA-FIXISWKDSA-N 308.809 2.498 70 10 DEIE C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)CSc1nncs1 160521948 RCJVAPVSCJMYRE-JTQLQIEISA-N 323.443 2.425 70 10 DEIE Cc1nccc(NC(=O)N[C@@H]2CCC[C@H](C(N)=O)C2)c1Cl 159666763 VAXWWLCSPONZIV-VHSXEESVSA-N 310.785 2.209 70 10 DEIE COCCC[C@H](N)CN1CCN(c2cccc(Cl)c2)CC1 159508990 RDHYALIINOHSAY-HNNXBMFYSA-N 311.857 2.216 70 10 DEIE O=S(=O)(Cl)CC1(CO[C@H]2CCC[C@H]2F)CCOCC1 1888573929 IJTOVVRUASXLHW-MNOVXSKESA-N 314.806 2.259 70 10 DEIE O=C(N1CCC[C@H](S(=O)(=O)F)C1)C12CCC(CC1)CC2 1968234304 AKFAVGDTAAMQCV-LXVYMNJGSA-N 303.399 2.247 70 10 DEIE Cc1oc(C(=O)N[C@@H]2CC[C@@H]3CC[C@H]32)cc1S(=O)(=O)Cl 2144555275 BCWMORRJPRUWPJ-IVZWLZJFSA-N 317.794 2.434 70 10 DEIE Cc1ccc(C(=O)N[C@@H]2CC[C@H]3C[C@@H]32)cc1S(=O)(=O)Cl 2144558866 ZLIKALHBCDUURO-ZMLRMANQSA-N 313.806 2.451 70 10 DEIE 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Cc1c(C(=O)N[C@@H]2[C@H]3CC[C@H]32)cc(F)cc1S(=O)(=O)Cl 2159997112 CZGDHSRXDANIAO-GDGBQDQQSA-N 317.769 2.200 70 10 DEIE CC[C@@H](CCCN1CCC(N2CCC2)CC1)S(=O)(=O)Cl 2155489674 JZWYZQVQGHHXDB-AWEZNQCLSA-N 322.902 2.284 70 10 DEIE CN(C(=O)c1cc(S(=O)(=O)Cl)c[nH]1)[C@H]1CCCC12CC2 706205280 BEFHRTLEQQUXBB-NSHDSACASA-N 316.810 2.347 70 10 DEIE C[C@H]1CC(F)(F)CN1C(=O)c1ccc(S(=O)(=O)Cl)cc1 2172081812 HDPFKTXNPDMWLW-QMMMGPOBSA-N 323.748 2.484 70 10 DEIE C[C@@H](NC(=O)c1csc(S(=O)(=O)Cl)c1)C(F)(F)F 389523917 JLFDBLMVKUYDTN-SCSAIBSYSA-N 321.729 2.356 70 10 DEIE COc1nc(N2CC[C@@H](CC(F)F)C2)ncc1[B-](F)(F)F 2172768297 GZMXRPGXTBCXRS-ZETCQYMHSA-N 310.055 2.021 70 10 DEIE CCN1CCC[C@H]1CN(C)c1ncc([B-](F)(F)F)cc1F 2172797073 AHOVBOKSCSOHOK-NSHDSACASA-N 304.120 2.196 70 10 DEIE Cc1nc(N(C)[C@H]2CCN(C)C[C@@H]2C)ccc1[B-](F)(F)F 2172784026 MRFJQFDBUGBKPN-GWCFXTLKSA-N 300.157 2.221 70 10 DEIE CN(c1ncc(Cl)cc1[B-](F)(F)F)[C@H]1CCN2CC[C@H]1C2 2192745672 KTLWMXFHODDUMD-CABZTGNLSA-N 318.559 2.320 70 10 DEIE C[C@H]1C[C@H](F)CN1C(=O)c1csc(S(=O)(=O)Cl)c1 2042195118 JLXDBELKXZWEMI-XPUUQOCRSA-N 311.787 2.248 70 10 DEIE C=CCNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)F)cc1Cl 2191413059 AWLXEGSRKLKHCR-QMMMGPOBSA-N 321.757 2.068 70 10 DEIE CCCn1c([C@H]2CCCOC2(C)C)nnc1S(=O)(=O)Cl 2187188723 YLDZJQZJMPLKRD-SECBINFHSA-N 321.830 2.288 70 10 DEIE CCn1c([C@]2(C)C[C@@H]2C(F)(F)F)nnc1S(=O)(=O)Cl 2100602047 SFMSMXBWNQFRGR-YLWLKBPMSA-N 317.720 2.065 70 10 DEIE F[B-](F)(F)c1ccccc1COC[C@@H]1C[C@H]2OCC[C@@H]2O1 2200771098 HNLABXGZFKRKKG-FPMFFAJLSA-N 301.093 2.204 70 10 DEIE CCCCC#CCn1nc(OC)c(S(=O)(=O)Cl)c1OC 2203850815 AJBQAHNCOFTRMR-UHFFFAOYSA-N 320.798 2.021 70 10 DEIE CO[C@@]1(CSc2ncc([B-](F)(F)F)cc2F)CCOC1 2269939591 OGZMNGJDXSYBQH-NSHDSACASA-N 310.101 2.173 70 10 DEIE Cc1c(C(=O)O[C@H]2C=CCOC2)csc1S(=O)(=O)Cl 2270169313 SJSCZBFRPVNGSI-QMMMGPOBSA-N 322.791 2.096 70 10 DEIE O=C(O[C@@H]1[C@H]2C[C@@H]2[C@H]2C[C@@H]12)c1cccc(S(=O)(=O)Cl)c1 2208366692 NHMHRZFFLOPCFX-KVSVUVNWSA-N 312.774 2.425 70 10 DEIE CC[C@H](C)NC(=O)c1cc(S(=O)(=O)Cl)c(C)cc1OC 2233969808 MTJRXIFAHSQWNM-VIFPVBQESA-N 319.810 2.459 70 10 DEIE O=S(=O)(F)c1cc(F)ccc1OC[C@@H](F)[C@@H]1CCOC1 2238309523 GYYYVIIZPNDECY-PSASIEDQSA-N 310.293 2.237 70 10 DEIE COc1nc(S[C@@H]2C3C[C@@H]4C2[C@@H]4C3)ncc1[B-](F)(F)F 2230077569 YCFUBDBCZCNZPW-OYSVPNSUSA-N 301.122 2.286 70 10 DEIE CC1(C)[C@H]2C[C@H]2CN1C(=O)c1ccc(S(=O)(=O)Cl)cc1 2284726942 TWZJSJZZKYJOIJ-JQWIXIFHSA-N 313.806 2.485 70 10 DEIE C[C@H]1C[C@@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)Cl)c1 160302956 NTXHIMFXNPWDNX-IONNQARKSA-N 305.758 2.139 70 10 DEIE CC(C)(F)C(=O)NCCc1ccc(S(=O)(=O)Cl)cc1 382311298 OAPREHQPTOVLSL-UHFFFAOYSA-N 307.774 2.021 70 10 DEIE C[C@H]1CCC[C@@H](CNC(=O)c2cc(S(=O)(=O)Cl)c[nH]2)C1 235686790 YIDIXNWWKDBAKL-VHSXEESVSA-N 318.826 2.498 70 10 DEIE CC(C)(C(=O)Nc1ccc(S(=O)(=O)F)nc1)C(F)(F)F 2166524343 KBRLYZKBRIMULK-UHFFFAOYSA-N 314.260 2.267 70 10 DEIE CCCN1C[C@@H](c2cccc(S(=O)(=O)Cl)c2)CC1=O 585671364 IZTIYIZFMQDYSA-NSHDSACASA-N 301.795 2.340 70 10 DEIE CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)Cl)C(F)(F)F 757556231 JNBONERTUADSPV-YFKPBYRVSA-N 311.709 2.011 70 10 DEIE O=S(=O)(OCc1ccnc(C(F)(F)F)c1)C(F)(F)F 1880980449 RPYPIEYNUOZJEF-UHFFFAOYSA-N 309.187 2.467 70 10 DEIE CN(CCC1CCC1)C(=O)c1cc(S(=O)(=O)Cl)cn1C 688540585 LMAREQZVIYVFOT-UHFFFAOYSA-N 318.826 2.215 70 10 DEIE F[B-](F)(F)c1cnc(N2CC3(CC=CCO3)C2)c(Cl)c1 2116155928 MICYFDFNGHIYBM-UHFFFAOYSA-N 303.500 2.325 70 10 DEIE C[C@H](CC1CCN(S(=O)(=O)F)CC1)NC(=O)OC(C)(C)C 1902696636 WDWUFIGAAMCFNF-SNVBAGLBSA-N 324.418 2.216 70 10 DEIE N#Cc1cc(O)c(S(=O)(=O)Cl)cc1OC(F)(F)F 396153376 SORMHKRXIOUJNR-UHFFFAOYSA-N 301.629 2.090 70 10 DEIE C[C@@H](OC(=O)c1cccc(N)c1Cl)C(=O)N1CCCCC1 161355827 YCBJXYWPLZBRDN-SNVBAGLBSA-N 310.781 2.480 70 10 DEIE Cc1cc(C[C@@H](C)NC(=O)NC[C@H](C)c2c(C)noc2C)n[nH]1 160750401 LYTSSZKQSIPPJR-VHSXEESVSA-N 319.409 2.357 70 10 DEIE CC(C)CN(CC(F)(F)F)C(=O)CN(C)C[C@@H]1CCC[C@@H]1O 159613592 GORHCKQXBMYTMD-STQMWFEESA-N 324.387 2.126 70 10 DEIE CC(C)CN(CC(N)=O)C(=O)/C=C/c1cc2ccccc2o1 159752361 RNZGXGZJHAFCEA-BQYQJAHWSA-N 300.358 2.416 70 10 DEIE Cc1c(C(=O)N2CCC[C@@H]2CN)cnn1-c1ccc(F)cc1F 160197032 GGWGRKQENHBZQA-GFCCVEGCSA-N 320.343 2.022 70 10 DEIE CCS(=O)(=O)CCNc1c(F)c(F)c(F)c(F)c1F 160642170 PQAHUKPISFAWRX-UHFFFAOYSA-N 303.252 2.229 70 10 DEIE CNCc1cc(S(=O)(=O)NC[C@@H]2C[C@H]2C)cc(F)c1Cl 160853390 DZKBNIJDIXYXQY-BDAKNGLRSA-N 320.817 2.133 70 10 DEIE CC(C)(C)OC(=O)CCS(=O)(=O)c1ccc(F)c(F)c1 161479513 RDRIWCPRCZYYRJ-UHFFFAOYSA-N 306.330 2.470 70 10 DEIE C[C@H](NC(=O)c1cocn1)c1ccc(S(=O)(=O)Cl)cc1 2149163115 QWLWVEFCDPSSAZ-QMMMGPOBSA-N 314.750 2.093 70 10 DEIE O=C(NC1[C@@H]2CCC[C@@H]12)c1ccc(S(=O)(=O)Cl)cc1F 2150179667 IWDGTGLIXXZOCZ-RKDXNWHRSA-N 317.769 2.282 70 10 DEIE CN(C[C@@H]1CC[C@@H]2C[C@@H]21)C(=O)c1cc(S(=O)(=O)Cl)c[nH]1 2157911484 XOVZEQUTPZBHGT-YWVKMMECSA-N 316.810 2.060 70 10 DEIE C[C@@H](CCCN1CC[C@@H](N(C)C)CC12CC2)S(=O)(=O)Cl 2160273391 POKSGRWWIHVZKK-QWHCGFSZSA-N 322.902 2.282 70 10 DEIE COc1c(C=O)cc(Br)cc1S(=O)(=O)Cl 2054959202 ZSFRYZHVXZEXDO-UHFFFAOYSA-N 313.556 2.198 70 10 DEIE C[C@@H]1CC[C@@H]1NC(=O)c1cc(S(=O)(=O)Cl)c(F)cc1F 380038413 XZIFJUXGYYQPEC-LDWIPMOCSA-N 323.748 2.421 70 10 DEIE Cc1ncc([B-](F)(F)F)c(N(C)CC[C@H]2CC[C@@H](C)O2)n1 2172766199 CMQWDOMQLBLLKQ-MWLCHTKSSA-N 302.129 2.233 70 10 DEIE CCCN1CCCN(c2nccc(C)c2[B-](F)(F)F)CC1 2172785283 UBSBCGRKPYKGGR-UHFFFAOYSA-N 300.157 2.367 70 10 DEIE CCc1cnc(CN(C)c2ncc([B-](F)(F)F)c(C)n2)s1 2172757803 HAHAZMMGGGCBAM-UHFFFAOYSA-N 315.153 2.495 70 10 DEIE F[B-](F)(F)c1cnc(N2CCN3CCCC[C@H]3C2)c(Cl)c1 2172794270 BZZXFHMQPFYWHN-NSHDSACASA-N 318.559 2.464 70 10 DEIE CC[C@H]1COC(C)(C)CN1c1ncc([B-](F)(F)F)c(C)n1 2172758982 XRBWBONDSYGMAI-JTQLQIEISA-N 302.129 2.233 70 10 DEIE CCN(c1nccc(C)c1[B-](F)(F)F)C1CCN(C)CC1 2172772412 NELXDRYTVGKOAY-UHFFFAOYSA-N 300.157 2.365 70 10 DEIE Cc1cc(S(=O)(=O)F)c(C)cc1OC[C@H]1CCCN1C 2191420880 BTCOZOJRTJBGIY-GFCCVEGCSA-N 301.383 2.435 70 10 DEIE CC(F)(F)CS(=O)(=O)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2073787386 PKRMTHDZFMSBFZ-CBAPKCEASA-N 306.085 2.285 70 10 DEIE CCc1ccc(C(=O)NC[C@@H](C)F)cc1S(=O)(=O)Cl 2088578868 DBSPBPAOKQVNPI-MRVPVSSYSA-N 307.774 2.264 70 10 DEIE O=S(=O)(Cl)CCCN1CCCC[C@H]1[C@H]1CCCOC1 2115025160 GOVLCGMLKUXROH-STQMWFEESA-N 309.859 2.226 70 10 DEIE COC[C@@H]1CCN(c2nc(C)ncc2[B-](F)(F)F)C1(C)C 2236702571 YVUJKAFXNKENCK-JTQLQIEISA-N 302.129 2.091 70 10 DEIE Cc1nc(OCC2CC(OC(F)F)C2)ncc1[B-](F)(F)F 2238476008 XFTYEKNHBNSVJU-UHFFFAOYSA-N 311.039 2.236 70 10 DEIE CN1CCC[C@@H]1COC[C@@H](CS(=O)(=O)Cl)C(C)(C)C 2229093995 VHHXAWLZVIJBTD-NWDGAFQWSA-N 311.875 2.328 70 10 DEIE Cn1c([C@@H]2CC(F)(F)C23CCC3)nnc1S(=O)(=O)Cl 2266189699 XSNCBRKRHLRGGT-LURJTMIESA-N 311.741 2.036 70 10 DEIE C[C@H]1C[C@@H](C)CN(S(=O)(=O)N2CC[C@H]([B-](F)(F)F)C2)C1 2342483034 PVENTYJZHLIEPY-AXFHLTTASA-N 313.174 2.132 70 10 DEIE C[C@H]1CCCN(C(=O)c2ccccc2S(=O)(=O)Cl)C1 100601346 ZAAVGMIVMPRERT-JTQLQIEISA-N 301.795 2.486 70 10 DEIE Cc1oc(C(=O)N2CCC(C)CC2)cc1S(=O)(=O)Cl 115016781 SYNFYURUYNYNFH-UHFFFAOYSA-N 305.783 2.388 70 10 DEIE O=[N+]([O-])c1cc(F)c(OCC2CC2)c(S(=O)(=O)Cl)c1 59330043 VODLRYDDIDRYGF-UHFFFAOYSA-N 309.702 2.450 70 10 DEIE CC[C@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)Cl)c1 115017556 LJGVWNRRUUCCLO-QMMMGPOBSA-N 305.783 2.151 70 10 DEIE CCn1nc(C)c(Cl)c1Cn1cnc(S(=O)(=O)Cl)c1 215708339 YCHSSWOBKAMRPE-UHFFFAOYSA-N 323.205 2.037 70 10 DEIE CCOCC[C@@H](Cc1cc(F)cc(Br)c1)NN 159768848 QHCWTAVMVZYOBD-LBPRGKRZSA-N 305.191 2.389 70 10 DEIE CC(C)N1CCN(CCN2CC[C@](C)([B-](F)(F)F)C2)CC1 2368433638 GRRMJBBDODCYNJ-AWEZNQCLSA-N 306.205 2.326 70 10 DEIE NCc1c(C(F)F)cnc(C(F)(F)F)c1S(=O)(=O)Cl 514280522 ZWKLCKAOSJHLSQ-UHFFFAOYSA-N 324.658 2.424 70 10 DEIE CCc1cc(COc2ccc(S(=O)(=O)Cl)cc2)n(C)n1 91323823 VUVULJUQVZCIGX-UHFFFAOYSA-N 314.794 2.489 70 10 DEIE Cc1cc([S@@](C)(=O)=NS(=O)(=O)Cl)nc2ccccc12 521399430 NYDSLWJHXHZSEN-GOSISDBHSA-N 318.807 2.484 70 10 DEIE O=C(c1ccccc1S(=O)(=O)Cl)N1CC[C@H](CCF)C1 2165900164 KOSWNCXWTOFBMT-JTQLQIEISA-N 319.785 2.436 70 10 DEIE Fc1ccc([B-](F)(F)F)c(OC[C@@H]2C[C@H]3OCC[C@@H]3O2)c1 2163200508 QIRUZSLZQKDXDS-XHVZSJERSA-N 305.056 2.205 70 10 DEIE CCn1nc(C)c(-c2cc(CS(=O)(=O)Cl)no2)c1C 725252156 GLNVVGYKQZYSOU-UHFFFAOYSA-N 303.771 2.243 70 10 DEIE CCC[C@H](COC[C@H]1C[C@]12CCOC2)CS(=O)(=O)Cl 1896974865 NTKFLLVTLAQDGS-UPJWGTAASA-N 310.843 2.415 70 10 DEIE O=[S@@](CC[C@@H]1CCCO1)Cc1ccc(S(=O)(=O)F)cc1 857219083 WIQYJFHKNNYITM-BUXKBTBVSA-N 320.407 2.163 70 10 DEIE CCO[C@H]1C[C@@H]1C(=O)Nc1ccc(S(=O)(=O)Cl)cc1F 689940269 HEENJLZDFPRHRA-KWQFWETISA-N 321.757 2.117 70 10 DEIE CN(c1ncc([B-](F)(F)F)cn1)[C@@H]1C[C@@H]2CSC[C@@H]2C1 2116137593 AJNVVEVNKIRBMT-DOFRTFSJSA-N 302.154 2.109 70 10 DEIE O=C(Cc1ccc(S(=O)(=O)F)cc1)NCc1ccccc1 1354264659 HXYXQRVKBJDGAO-UHFFFAOYSA-N 307.346 2.204 70 10 DEIE C[C@@H](CO)S(=O)(=O)Nc1ccc(Cl)cc1C(F)(F)F 217609800 RXXKSGATXPWSSQ-LURJTMIESA-N 317.716 2.481 70 10 DEIE CCC[C@@H](COC)NC(=O)c1ccc(S(=O)(=O)Cl)cc1 112879671 DOMURCMRODVXBO-NSHDSACASA-N 319.810 2.159 70 10 DEIE CCC[C@@H](NC(=O)Cn1nc(C)cc1C)C(=O)OC(C)(C)C 161397800 VZJNLKWSGJLTKY-CYBMUJFWSA-N 309.410 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Cn1nc(Br)cc1C(C)(C)CS(=O)(=O)Cl 1953071982 YCIDXYPFJKDCEM-UHFFFAOYSA-N 315.620 2.029 70 10 DEIE CC(F)(F)CNC(=O)c1ccc(S(=O)(=O)Cl)cc1F 698017105 PTGXYNQADXSPFM-UHFFFAOYSA-N 315.700 2.138 70 10 DEIE CCN(C[C@@H]1C[C@H]1C)C(=O)c1cc(S(=O)(=O)Cl)cn1C 698322806 OVVIWAIMQBQKKT-ZJUUUORDSA-N 318.826 2.071 70 10 DEIE CCCn1c([C@H]2C[C@@]23CC3(F)F)nnc1S(=O)(=O)Cl 2115389418 IFIWMZDLOFCPJV-HZGVNTEJSA-N 311.741 2.128 70 10 DEIE CN(Cc1ncc(Cl)n1C)c1ncccc1[B-](F)(F)F 2116154810 YRUUCNMADZDLIH-UHFFFAOYSA-N 303.504 2.159 70 10 DEIE C[C@@H](CC1CC1)OC(=O)c1cc(S(=O)(=O)Cl)cn1C 1917383645 HCTVCQZUGOXJLN-QMMMGPOBSA-N 305.783 2.298 70 10 DEIE O=S(=O)(Cl)c1cn([C@@H]2CCCOC2)c(C2CCC2)n1 1922273238 UULUWXQRDWFOSG-SNVBAGLBSA-N 304.799 2.430 70 10 DEIE Cc1ccc(NC(=O)/C=C\c2ccncn2)cc1S(=O)(=O)F 1586906952 IBHRUKVASPMSNS-PLNGDYQASA-N 321.333 2.095 70 10 DEIE NC(=O)c1ccccc1COC(=O)c1cccc(N)c1Cl 161360712 WDHBEHILOOBFJH-UHFFFAOYSA-N 304.733 2.378 70 10 DEIE Cc1cc(C[C@@H](C)NC(=O)Nc2cccc([S@](C)=O)c2)n[nH]1 160227500 KCXUISMYWLAHOX-ZQJOYCHOSA-N 320.418 2.208 70 10 DEIE CC(C)[C@H](O)CNC(=O)NCCOCc1ccc(Cl)cc1 160541827 YGBWYXSXNQMZPO-CQSZACIVSA-N 314.813 2.173 70 10 DEIE CCNCc1ccc(CC)c(S(=O)(=O)NC[C@H]2C[C@H]2C)c1 160888035 UAGBAMMRSMRBEB-IUODEOHRSA-N 310.463 2.293 70 10 DEIE C[C@@H](O)C1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 159619582 YAAOYBJNYNTONE-CQSZACIVSA-N 310.482 2.364 70 10 DEIE CCc1c(C(=O)N(C)Cc2cccc(F)c2)[nH]c(C)c1C(N)=O 159421641 VCTMXMVXVMHAJE-UHFFFAOYSA-N 317.364 2.396 70 10 DEIE Cc1cccc(CNC(=O)c2cnn(C3CCOCC3)c2C)n1 159456691 GCEKNOGFDHACJZ-UHFFFAOYSA-N 314.389 2.176 70 10 DEIE O=C(c1ccccc1F)N1CCOC[C@H]1C[C@H](O)c1ccco1 159466142 OFEHWIYRMFJSRQ-DOMZBBRYSA-N 319.332 2.383 70 10 DEIE CCc1noc(C)c1CN1CCOC[C@@H]1C[C@H](O)c1ccco1 159516122 LFPPCWAOTKMPKB-BBRMVZONSA-N 320.389 2.463 70 10 DEIE CCc1noc([C@H](C)N2CCOC[C@@H]2C[C@H](O)c2ccco2)n1 159547224 HQVGQMUQFNEBRP-AVGNSLFASA-N 321.377 2.111 70 10 DEIE CNS(=O)(=O)c1ccc(N(C)[C@H]2CCC[C@H](C)C2)cc1N 159587827 SLDNPCQXVJVUNF-RYUDHWBXSA-N 311.451 2.192 70 10 DEIE O=S(=O)(F)c1cc(F)ccc1OCCOC(F)(F)F 1875878912 AYFGNLQDZMNQMW-UHFFFAOYSA-N 306.208 2.399 70 10 DEIE CC(C)(C)OC(=O)N1CCC2(CC(S(=O)(=O)Cl)C2)C1 1880814099 ZNJUQKGOYPYFQH-UHFFFAOYSA-N 309.815 2.345 70 10 DEIE O=C(N[C@H]1C[C@@H]1C1CCCC1)c1cc(S(=O)(=O)Cl)c[nH]1 2145126005 JHTKHLNWDYDHAN-MNOVXSKESA-N 316.810 2.251 70 10 DEIE CCCNCc1cc(S(=O)(=O)NC[C@@H]2C[C@@H]2C)c(C)s1 160891948 UMNIAJDJVFCALP-JQWIXIFHSA-N 316.492 2.490 70 10 DEIE C[C@]12C[C@@H]1CN(C(=O)c1cc(F)cc(S(=O)(=O)Cl)c1)C2 2152469948 RJRMZYXKANVOOT-NOZJJQNGSA-N 317.769 2.235 70 10 DEIE O=Cc1c(OC(F)(F)F)cc(F)cc1S(=O)(=O)Cl 2055085050 KHERWTZLFOBTRZ-UHFFFAOYSA-N 306.620 2.464 70 10 DEIE CN(C)CC[C@H]1CCN(c2ncc([B-](F)(F)F)cc2F)C1 2172791041 ZNSAVDDVDVGSGL-JTQLQIEISA-N 304.120 2.053 70 10 DEIE CN(C)CC[C@H]1CCCN1c1ncc(F)cc1[B-](F)(F)F 2188593126 BAMYRJROPWSYFO-LLVKDONJSA-N 304.120 2.196 70 10 DEIE Cc1cc(S(=O)(=O)F)c(C)cc1OCCN1CCCC1 2191414461 QVFFWAFYJHPOCW-UHFFFAOYSA-N 301.383 2.436 70 10 DEIE CCC#CCOc1cc(C)c(S(=O)(=O)F)cc1[N+](=O)[O-] 2191420802 AXLKOQXDXPKVSR-UHFFFAOYSA-N 301.295 2.354 70 10 DEIE CC[C@H](CCCN(C)CCOC(F)F)S(=O)(=O)Cl 2082851986 PKZVCXZRXMIURY-SECBINFHSA-N 307.790 2.285 70 10 DEIE CC[C@H](CCCN1CCO[C@H](C(C)C)C1)S(=O)(=O)Cl 2099268936 MBJHXEQZEZYJNB-OLZOCXBDSA-N 311.875 2.471 70 10 DEIE Cc1nc(N(C)[C@@H]2CC[C@@H]3[C@H]2C3(F)F)ncc1[B-](F)(F)F 2238676417 RVLGYAQNBXFRCO-SZEHBUNVSA-N 306.067 2.319 70 10 DEIE Cc1nc(C)c([B-](F)(F)F)c(N2CC(C)(C)OC[C@H]2C)n1 2284134163 ZKQZRQYFTLSVOQ-MRVPVSSYSA-N 302.129 2.152 70 10 DEIE O=[N+]([O-])c1nn(C[C@@]23CCC[C@H]2CC3)cc1S(=O)(=O)Cl 2289184516 XRZZNTGRVZWNNA-KWQFWETISA-N 319.770 2.299 70 10 DEIE Cc1c(C=CC(=O)Nc2ccc(S(=O)(=O)F)cc2)cnn1C 2310042398 LAHACDQKSGFHFN-UHFFFAOYSA-N 323.349 2.039 70 10 DEIE C[C@H]1C(C(=O)NCc2ccc(S(=O)(=O)Cl)cc2)[C@@H]1C 2331016623 KCZITYGHRGQPOP-RKDXNWHRSA-N 301.795 2.132 70 10 DEIE COc1nc(N(C)[C@H]2C[C@@H]3CCC[C@@H]32)ncc1[B-](F)(F)F 2356964461 PKAIQLLTPUMQKC-QXEWZRGKSA-N 300.113 2.164 70 10 DEIE Cc1nn(C[C@H]2OC[C@@H]3CCC[C@H]23)c(C)c1S(=O)(=O)Cl 2358501670 DCSZGYOCROXOHH-SDDRHHMPSA-N 318.826 2.243 70 10 DEIE O=[N+]([O-])c1ccc(Br)c(CCS(=O)(=O)F)c1 1951672504 DHIWJDVWEIVEMR-UHFFFAOYSA-N 312.116 2.199 70 10 DEIE C[C@H](NC(=O)C(F)F)c1ccc(S(=O)(=O)Cl)s1 235524768 BDYIJWXRQPTRLT-BYPYZUCNSA-N 303.739 2.118 70 10 DEIE CC(C)[C@@H](N)CNS(=O)(=O)/C=C\c1ccc(Cl)cc1 216997600 WSXFOCAHJUUCLM-WSROAFLRSA-N 302.827 2.213 70 10 DEIE O=S(=O)(F)c1cccc(S(=O)(=O)c2ccccc2)c1 222715593 MFLGJKLCTNQLDU-UHFFFAOYSA-N 300.332 2.178 70 10 DEIE O=S(=O)(Cl)c1nc(Br)cc(C(F)F)c1O 238714243 XTFRUXFUZBNHIY-UHFFFAOYSA-N 322.514 2.415 70 10 DEIE COc1ncc(OC(F)(F)F)c(F)c1S(=O)(=O)Cl 396041457 PDVSEERSNCUPTL-UHFFFAOYSA-N 309.624 2.055 70 10 DEIE CN(CCC1CCC1)C(=O)c1cc(S(=O)(=O)Cl)c[nH]1 711252237 XDHKMEYHXXCWAD-UHFFFAOYSA-N 304.799 2.204 70 10 DEIE CO[C@@H]1[C@H]2C[C@@H]3CN(c4nc([B-](F)(F)F)cs4)[C@H]1[C@H]3C2 2116128180 NVSBLWDWLKLUHM-IHFUKEFASA-N 303.138 2.057 70 10 DEIE F[B-](F)(F)c1cnc(N2CCN3CCC[C@H]3C2)c(Cl)c1 2116156695 WHKFCBFDZXDUSI-JTQLQIEISA-N 304.532 2.074 70 10 DEIE N#CC1(CS(=O)(=O)N2CCC[C@H]([B-](F)(F)F)C2)CCC1 2133921287 WEHUCNBTHYQUAV-JTQLQIEISA-N 309.142 2.323 70 10 DEIE C[C@@H](Cc1ccco1)NC(=O)c1ccc(S(=O)(=O)F)cc1 1354548716 NKOSPYUHSLNMGU-JTQLQIEISA-N 311.334 2.299 70 10 DEIE O=C(NC[C@H]1CC[C@@H]2C[C@@H]2C1)c1cc(S(=O)(=O)Cl)c[nH]1 1917421149 MGXWQDFIUDVXFY-AEJSXWLSSA-N 316.810 2.108 70 10 DEIE CC(C)NC[C@H]1CCc2nc([C@H]3CSCCO3)ncc2C1 160022596 RYXUMFJGEQJGTQ-SWLSCSKDSA-N 307.463 2.384 70 10 DEIE CC1(C)[C@@H]2OCC[C@H]2[C@]1(N)C(=O)NCc1ccccc1Cl 159995192 FCVNXTJEENWXOL-KFNAQCHYSA-N 308.809 2.099 70 10 DEIE O=C(c1cc(F)ccc1S(=O)(=O)Cl)N1CC[C@@H]1C1CC1 2144865103 RSRHNLHLAPALDO-LLVKDONJSA-N 317.769 2.378 70 10 DEIE C[C@@H]1O[C@H](C)[C@H](c2nnc(S(=O)(=O)Cl)n2C2CC2)[C@H]1C 158128366 KHIUDMMMRJGSFI-QHOPCYEYSA-N 319.814 2.067 70 10 DEIE CCN[C@@H](c1c(Cl)cnn1CCN(C)C)[C@@H](C)OCC 159919252 NZUPLPZYVJGOME-DGCLKSJQSA-N 302.850 2.174 70 10 DEIE Cc1cc(S(=O)(=O)Cl)ccc1OC[C@H]1COCCCO1 2154009601 GZDSCLMHQFZXRA-LLVKDONJSA-N 320.794 2.107 70 10 DEIE CC[C@@](C)(NC(=O)c1cc(S(=O)(=O)Cl)c[nH]1)C1CC1 691509845 MDKSGBIYANYGGT-GFCCVEGCSA-N 304.799 2.251 70 10 DEIE CC(C)[C@H]1CCC[C@H]1C(=O)N1CCC(S(=O)(=O)F)CC1 2176542746 XBVQVKLYFYWCBY-CHWSQXEVSA-N 305.415 2.349 70 10 DEIE COCC1(COc2ccc(S(=O)(=O)F)c(F)c2F)CC1 2195200698 JMNXQFSLXVOCMB-UHFFFAOYSA-N 310.293 2.428 70 10 DEIE Cc1cc(OCCO[C@H]2CC2(F)F)ccc1S(=O)(=O)F 2191422187 RCEWLMVDNRTRIF-NSHDSACASA-N 310.293 2.456 70 10 DEIE Cc1csnc1-c1nnc(S(=O)(=O)Cl)n1C(C)(C)C 2096995865 NGDNDPMALSNSPZ-UHFFFAOYSA-N 320.827 2.393 70 10 DEIE CC[C@@H](CCCN1C[C@H](OC)C(C)(C)C1)S(=O)(=O)Cl 2099274660 QCHYNCMEMVMFPX-RYUDHWBXSA-N 311.875 2.471 70 10 DEIE C[C@H](CCCN1CCCC[C@]12CCOC2)S(=O)(=O)Cl 2099262815 PDUZICPQNZQZAB-CHWSQXEVSA-N 309.859 2.369 70 10 DEIE Cc1oc(C(=O)N2C[C@H]3[C@H](C)C[C@H]3C2)cc1S(=O)(=O)Cl 2206517469 DWJWZYBESHBUSQ-JEZHCXPESA-N 317.794 2.244 70 10 DEIE Cc1oc(C(=O)NC[C@H](F)C2CCC2)cc1S(=O)(=O)Cl 2236430026 BLZSVOKIBASTHN-VIFPVBQESA-N 323.773 2.384 70 10 DEIE COC[C@@H]1CCN(c2ncnc(C)c2[B-](F)(F)F)C1(C)C 2236701138 RNPUHMMBTTZARH-JTQLQIEISA-N 302.129 2.091 70 10 DEIE COc1cc(F)c(COS(=O)(=O)C(F)(F)F)c(F)c1 2241511680 RRMJDCFBAPDSOQ-UHFFFAOYSA-N 306.208 2.340 70 10 DEIE CO[C@@H](CSc1ncccc1[B-](F)(F)F)[C@@H]1CCOC1 2274625670 XHVMPVOXVRAXSB-KOLCDFICSA-N 306.138 2.280 70 10 DEIE CCOCCOC(=O)c1cc(C)cc(S(=O)(=O)Cl)c1 115021898 HNKKIWKXFHQDEK-UHFFFAOYSA-N 306.767 2.116 70 10 DEIE CCOC(=O)Nc1ccc(S(=O)(=O)Cl)cc1[N+](=O)[O-] 137855188 YMGNEYANRPFEPV-UHFFFAOYSA-N 308.699 2.091 70 10 DEIE O=C(O)C(=CC(=O)N1CCC[C@H]([B-](F)(F)F)C1)C(F)(F)F 2360742709 SWIITQNDILRWRS-LURJTMIESA-N 318.002 2.400 70 10 DEIE C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)c1cccnc1 123075367 PEJSXPPMJOPADT-JTQLQIEISA-N 308.334 2.482 70 10 DEIE COc1cccc(CCNC(=O)Nc2ccccc2C(N)=O)c1 217427467 OTAZVWIADIPJPT-UHFFFAOYSA-N 313.357 2.158 70 10 DEIE C[C@H](O)c1ccc(S(=O)(=O)NN2[C@@H](C)CCC[C@H]2C)cc1 218604332 SNZWDOOUGCFXLI-XQQFMLRXSA-N 312.435 2.196 70 10 DEIE CC[C@@H]1C[C@@H]1NC(=O)c1cc(C)cc(S(=O)(=O)Cl)c1 233941428 UWUWHICXAMCPPH-SKDRFNHKSA-N 301.795 2.451 70 10 DEIE CCc1nn(C[C@H]2C[C@@H](OC)C2)c(CC)c1S(=O)(=O)Cl 721781955 OJBRFNYNYWICQE-AOOOYVTPSA-N 320.842 2.360 70 10 DEIE CN([C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C)S(=O)(=O)F 1955897780 LSOAHMNHPZPVFQ-MNOVXSKESA-N 324.418 2.216 70 10 DEIE FC(F)CN(CC(F)(F)F)c1ncc([B-](F)(F)F)cn1 2116148755 UPIXKYVDPCDXRZ-UHFFFAOYSA-N 307.961 2.165 70 10 DEIE Cc1nccn1CCOc1ncc([B-](F)(F)F)cc1Cl 2127984280 IAXWIJLUIGCHFY-UHFFFAOYSA-N 304.488 2.373 70 10 DEIE O=S(=O)(NCc1ccccc1Cl)c1ccc(CO)s1 217501486 NQGTYHCTVLKJFS-UHFFFAOYSA-N 317.819 2.372 70 10 DEIE O=C(CCOc1ccc(Cl)cc1)N1C[C@@H]2CCC[C@H](C1)N2 160036511 GGCCGTLQMGMVIX-OKILXGFUSA-N 308.809 2.462 70 10 DEIE CS[C@@H](C)CNC(=O)N[C@@H]1CCCn2nc(C(C)C)nc21 160144729 XPNXKUZUDXWZDQ-WDEREUQCSA-N 311.455 2.287 70 10 DEIE CC[C@@H]1C[C@@H]1NC(=O)c1cc(F)cc(S(=O)(=O)Cl)c1F 233942138 GVTDCTNMETZLPG-MUWHJKNJSA-N 323.748 2.421 70 10 DEIE CCCN(C(C)C)S(=O)(=O)c1ccc(S(=O)(=O)F)cc1 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Cc1ccnc(N(C)Cc2c(Cl)cnn2C)c1[B-](F)(F)F 2172772748 RMGHRWSNDIJOOV-UHFFFAOYSA-N 317.531 2.468 70 10 DEIE COC[C@H]1CCCCN1c1nc(C)nc(C)c1[B-](F)(F)F 2172769543 ZDVHRCINRHJUOJ-LLVKDONJSA-N 302.129 2.153 70 10 DEIE COC[C@H]1CCCCN(c2ncc([B-](F)(F)F)c(C)n2)C1 2172767451 URNRATGEDVBCPU-NSHDSACASA-N 302.129 2.092 70 10 DEIE COCc1nc(S(=O)(=O)Cl)cn1CCCC(F)F 2062002185 KUTDCOASUYMGKL-UHFFFAOYSA-N 302.730 2.002 70 10 DEIE O=C(NC[C@H]1C[C@H]1CF)c1cc(F)cc(S(=O)(=O)Cl)c1 2191396979 BMMSDMRTLKPZSF-DTWKUNHWSA-N 323.748 2.089 70 10 DEIE C=C=CCCOc1c(C)cc(C(=O)O)cc1S(=O)(=O)F 2191430109 HJVCIHLBYRNNCS-UHFFFAOYSA-N 300.307 2.461 70 10 DEIE O=C(O)c1ccc(O[C@H]2C[C@@H]3C[C@@H]3C2)c(S(=O)(=O)F)c1 2191426809 UQWNOJQLFKWXEG-ILWJIGKKSA-N 300.307 2.220 70 10 DEIE Cc1ccnc(COc2ccc(F)cc2S(=O)(=O)F)n1 2191423726 JZOUIHJBTLOTAE-UHFFFAOYSA-N 300.286 2.161 70 10 DEIE COc1c(C(=O)NCCC2CC2)csc1S(=O)(=O)Cl 2100123627 PMPGLQRDMZEACS-UHFFFAOYSA-N 323.823 2.214 70 10 DEIE CN(CCCCS(=O)(=O)Cl)C[C@H]1CC2(CCC2)CO1 2110154677 HRIYHMZKGWWRAS-GFCCVEGCSA-N 309.859 2.226 70 10 DEIE CCCn1c(-c2ccc(OC)s2)nnc1S(=O)(=O)Cl 2095801474 YWUKEJZMBROSCU-UHFFFAOYSA-N 321.811 2.353 70 10 DEIE O=S(=O)(c1cccc(F)n1)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2236810927 GHRBCDXQIXEADF-KCJUWKMLSA-N 323.100 2.223 70 10 DEIE O=C(/C=C\c1cccnc1)Nc1ccc(S(=O)(=O)F)cc1 490536357 JHVKJTHICYKILI-BAQGIRSFSA-N 306.318 2.392 70 10 DEIE C[C@H](COc1ccc(S(=O)(=O)Cl)cc1Cl)C(=O)O 2317548864 GCAYKLQIFUAFHK-ZCFIWIBFSA-N 313.158 2.367 70 10 DEIE COc1ccc(C(=O)OCC(C)C)cc1S(=O)(=O)Cl 115022000 OECSUOVYBYIJIZ-UHFFFAOYSA-N 306.767 2.436 70 10 DEIE CN(C)CC1(F)CCN(c2ccc([B-](F)(F)F)cn2)CC1 2362075414 KKAFIPDCPOJLCN-UHFFFAOYSA-N 304.120 2.006 70 10 DEIE O=[N+]([O-])c1nn([C@H]2C[C@H]3CC[C@H]2C3)cc1S(=O)(=O)Cl 302302493 FAMCSHXXLDEILR-FXQIFTODSA-N 305.743 2.080 70 10 DEIE CN(C(=O)c1cc(S(=O)(=O)Cl)c[nH]1)[C@H]1C[C@@H]2CCC[C@@H]21 2356966300 IXGRTBUYSVMGDE-PEXQALLHSA-N 316.810 2.203 70 10 DEIE C[C@H]1CN(CCN2CC[C@@H]3C[C@]3([B-](F)(F)F)C2)C[C@H](C)O1 2357336945 XVQPYINIXLQCMZ-FQUUOJAGSA-N 305.173 2.409 70 10 DEIE CC(=O)N(C(=O)NCCOc1ccccc1)c1cccc(N)c1 217303631 BAGHSKMURHHUAP-UHFFFAOYSA-N 313.357 2.410 70 10 DEIE Cn1cc(C(=O)N2CCCC[C@H](c3ccc(F)cc3)C2)nn1 217289191 KNLAGLHFZNSFSW-ZDUSSCGKSA-N 302.353 2.364 70 10 DEIE F[B-](F)(F)c1ccccc1OC[C@H]1COC2(CCC2)CO1 2363431391 HBYHMEDQFUSFKX-NSHDSACASA-N 301.093 2.458 70 10 DEIE CC(C)NC(=O)Nc1cnn(C[C@@H]2COc3ccccc3O2)c1 218290383 VYJAZIFGQKSYOV-CYBMUJFWSA-N 316.361 2.253 70 10 DEIE O=S(=O)(Cl)c1cc(C(F)F)c(O)c(Br)n1 238711920 KHDDVRWUVOYWKF-UHFFFAOYSA-N 322.514 2.415 70 10 DEIE Cn1nc(Br)c2c(CS(=O)(=O)Cl)cccc21 258857031 PFEAAPJSXSOVFZ-UHFFFAOYSA-N 323.599 2.404 70 10 DEIE O=S(=O)(Cl)Cc1ccc2[nH]nc(Br)c2c1 258786645 NCHDKRYCUYGELS-UHFFFAOYSA-N 309.572 2.394 70 10 DEIE O=S(=O)(O[C@@H]([C@@H]1CCCOC1)C(F)(F)F)C(F)(F)F 685965083 OGZOIKJYCUQKHY-RITPCOANSA-N 316.219 2.210 70 10 DEIE CC(C)n1nnnc1SCc1ccc(S(=O)(=O)F)cc1 857219047 VGPXPOWTIRPCEC-UHFFFAOYSA-N 316.383 2.205 70 10 DEIE O=[N+]([O-])c1cc(F)ccc1COS(=O)(=O)C(F)(F)F 1881081400 JWMSDNBUTPNOOP-UHFFFAOYSA-N 303.189 2.100 70 10 DEIE CN(C)c1ccnc(Cl)c1COS(=O)(=O)C(F)(F)F 1893247436 MYLHPPLXFSPIQB-UHFFFAOYSA-N 318.704 2.167 70 10 DEIE C[C@@H]1CN(C(=O)c2cc(F)ccc2S(=O)(=O)Cl)[C@@H]1C 706895122 ADRMJVXLJGINNX-HTQZYQBOSA-N 305.758 2.234 70 10 DEIE Fc1ccc(OCCOC[C@@H]2CCCO2)c([B-](F)(F)F)c1 693081869 WVXLNUZRMYJGKS-NSHDSACASA-N 307.072 2.455 70 10 DEIE CCOC(=O)NCCC(=O)O[C@@H](c1ccccn1)C(F)(F)F 160641793 RZLZPNMWGLWQKH-NSHDSACASA-N 320.267 2.364 70 10 DEIE Cn1cnc2cc(C(=O)N[C@@H]3[C@@H]4Cc5ccccc5[C@@H]43)cnc21 160853624 CNWMGWUVTUWGHG-VNQPRFMTSA-N 304.353 2.036 70 10 DEIE CC1(C)CCC(=CC(=O)NCCN2C(=O)CSC2=O)CC1 159492637 DVUQQTUOCXFKKO-UHFFFAOYSA-N 310.419 2.325 70 10 DEIE CC(C)COc1ccc([C@H](C)NC(=O)c2ccc(=O)[nH]n2)cc1 159522181 PSCYICJZGBQSGE-LBPRGKRZSA-N 315.373 2.296 70 10 DEIE O=[N+]([O-])c1cc(CCS(=O)(=O)F)cc(C(F)(F)F)c1 1951733463 JCLWWRNODUFQJP-UHFFFAOYSA-N 301.217 2.455 70 10 DEIE O=S(=O)(Cl)C[C@H](c1c[nH]nc1C(F)(F)F)C1CC1 1952939234 VUVPGQSOQMBLEQ-ZETCQYMHSA-N 302.705 2.491 70 10 DEIE CCCCOCCCNS(=O)(=O)c1cc(C)cc(N)c1 160158644 OQAFPCXFAXVNDE-UHFFFAOYSA-N 300.424 2.062 70 10 DEIE CC(C)n1cc(S(=O)(=O)Cl)cc1C(=O)N1CC2CC1C2 2151761295 WLQRAWULANCBTM-UHFFFAOYSA-N 316.810 2.231 70 10 DEIE CC[C@@H](C)[C@H](C)NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 163314626 VUCDGKKNUJHZKL-ZJUUUORDSA-N 323.411 2.058 70 10 DEIE C[C@H]1CCO[C@@H]1COC(=O)c1cccc(S(=O)(=O)Cl)c1 2152435025 FMGSUECPEYSVBM-JOYOIKCWSA-N 318.778 2.196 70 10 DEIE Cc1c(F)cc(C(=O)NC2[C@H]3CC[C@H]23)cc1S(=O)(=O)Cl 2159999094 ITNOTRFFRWBVRV-IUCAKERBSA-N 317.769 2.200 70 10 DEIE Cc1ccc(C(=O)N2CCC(F)(F)C2)cc1S(=O)(=O)Cl 313357279 PNWBBVSEYWGWTG-UHFFFAOYSA-N 323.748 2.404 70 10 DEIE CC(C)n1cc(S(=O)(=O)Cl)cc1C(=O)NC1[C@@H](C)[C@@H]1C 2161549459 FDLFRPXISMJHGW-IUCAKERBSA-N 318.826 2.381 70 10 DEIE CCOc1cc(S(=O)(=O)Cl)c(C=O)cc1OC(F)F 2055356433 MTNGSTBDMFVZBC-UHFFFAOYSA-N 314.693 2.427 70 10 DEIE CO[C@@H]1CCCC[C@@H]1N(C)c1ncc([B-](F)(F)F)c(C)n1 2172773112 WPPCSFNABIFLKF-NWDGAFQWSA-N 302.129 2.233 70 10 DEIE F[B-](F)(F)c1cnc(N2CCCCC23CCOCC3)nc1 2172776247 NASIKHKZPMAUJK-UHFFFAOYSA-N 300.113 2.071 70 10 DEIE O=C(C1C[C@@H]2CCC[C@H]2C1)N1CCC(S(=O)(=O)F)CC1 2183302746 ZTGDICAAIVUTPX-QWRGUYRKSA-N 303.399 2.103 70 10 DEIE O=C(NCC1CCC1)c1csc(S(=O)(=O)Cl)c1F 2055651665 UWOFRBWLLCMCMG-UHFFFAOYSA-N 311.787 2.345 70 10 DEIE Cc1cc(OC[C@H]2C[C@H]2F)c([N+](=O)[O-])cc1S(=O)(=O)F 2191421887 NXXCPOSRSWEZNK-HTQZYQBOSA-N 307.274 2.298 70 10 DEIE CCN1[C@@H](C)CN(c2ncc(C)cc2[B-](F)(F)F)C[C@@H]1C 2186930988 ZYBOSKADFSZJMS-RYUDHWBXSA-N 300.157 2.363 70 10 DEIE O=C(c1ccc(S(=O)(=O)Cl)cc1)N1CC(CCF)C1 2102864468 HZBXJGWOKIQKMC-UHFFFAOYSA-N 305.758 2.046 70 10 DEIE C[C@H]1CC[C@H]1N(C)C(=O)Cc1ccc(S(=O)(=O)Cl)s1 2105622673 XQVKVHAXXDYWNK-WCBMZHEXSA-N 321.851 2.475 70 10 DEIE CC[C@@H](CCCN1CCC[C@]12CCOC2)S(=O)(=O)Cl 2099272650 JIIDDCFLGUYJMZ-QWHCGFSZSA-N 309.859 2.369 70 10 DEIE COCC12CC(CN3CC[C@@H]4C[C@@]4([B-](F)(F)F)C3)(CO1)C2 2206024068 SRLBJCVQBGQGGH-BLYZHGLHSA-N 304.141 2.495 70 10 DEIE O=C(C[C@@H]1CC12CC2)NCc1ccc(S(=O)(=O)Cl)cc1 2207609901 RJMGBNUIINWDBV-LLVKDONJSA-N 313.806 2.421 70 10 DEIE O=S(=O)(CC1CC(F)C1)N1CCC([B-](F)(F)F)CC1 2223249645 OHECEHMPHFHKJM-UHFFFAOYSA-N 302.122 2.378 70 10 DEIE Fc1cc([B-](F)(F)F)cnc1N1CCC[C@H]1COC(F)F 2236734739 WJPZZXWHNRUJLM-QMMMGPOBSA-N 313.030 2.483 70 10 DEIE C[C@H](CCCN(C)C[C@]12COC[C@H](C1)C2)S(=O)(=O)Cl 2228130892 OMMSGDZSVUZKEG-UPJWGTAASA-N 309.859 2.082 70 10 DEIE O=C(O[C@H]1CCC(F)(F)C1)c1cc(S(=O)(=O)Cl)c[nH]1 2230062114 OTMCDDJZSZSBEE-LURJTMIESA-N 313.709 2.287 70 10 DEIE Cc1ccc(C(=O)N(C)[C@@H](C)CF)cc1S(=O)(=O)Cl 2270245810 BRBPSZGSASBHBG-VIFPVBQESA-N 307.774 2.353 70 10 DEIE COCC1(C)CC(N(C)CCC[C@@H](C)S(=O)(=O)Cl)C1 2274101112 ZLSFEPVLPLYOJP-PNESKVBLSA-N 311.875 2.471 70 10 DEIE O=S(=O)(Cl)c1nnc([C@@H]2C[C@@H]3CC[C@H]2C3)n1C1CC1 2334297280 BAMWOIZGLMTQES-KHQFGBGNSA-N 301.799 2.444 70 10 DEIE O=S(=O)(Cl)CC1(COCC2[C@@H]3COC[C@@H]23)CCCC1 2341515863 PMGORFAXFNZEKM-GHMZBOCLSA-N 308.827 2.024 70 10 DEIE CC[C@@H](CCCN(C)C[C@@H]1[C@@H]2CCCO[C@@H]21)S(=O)(=O)Cl 2355550663 MRGKIAAZTXRORB-FQUUOJAGSA-N 323.886 2.471 70 10 DEIE O=C(Nc1ccc(S(=O)(=O)Cl)cc1Cl)c1cc[nH]n1 108958327 YJYGGGKUNNFEBW-UHFFFAOYSA-N 320.157 2.243 70 10 DEIE O=C(NCC(F)(F)F)c1cc(S(=O)(=O)Cl)ccc1F 115018490 CFQKUGXPYICBHF-UHFFFAOYSA-N 319.663 2.045 70 10 DEIE O=S(=O)(F)N1CC[C@H]2CCN(Cc3ccccc3)C[C@@H]2C1 1955504339 IBKJUVJKHLCDKU-HUUCEWRRSA-N 312.410 2.045 70 10 DEIE NCc1nc(C(F)F)c(S(=O)(=O)Cl)cc1C(F)(F)F 514280437 ZGFWJZBIYYBMIG-UHFFFAOYSA-N 324.658 2.424 70 10 DEIE NCc1ncc(C(F)F)c(C(F)(F)F)c1S(=O)(=O)Cl 514280217 KPFGOXHEDLXDOR-UHFFFAOYSA-N 324.658 2.424 70 10 DEIE N#Cc1cc(S(=O)(=O)Cl)cc(C=O)c1OC(F)(F)F 575391632 YSUPAXWBNZEEGG-UHFFFAOYSA-N 313.640 2.197 70 10 DEIE COC(=O)c1cc(S(=O)(=O)F)c(Br)cc1F 675067109 YZRQVHTYRUWPQG-UHFFFAOYSA-N 315.091 2.033 70 10 DEIE CC(C)C(=O)NCCCc1ccc(S(=O)(=O)Cl)cc1 103105518 JOSQQJJTDQMYKN-UHFFFAOYSA-N 303.811 2.319 70 10 DEIE Cc1cc(OC[C@@H]2CCCS2(=O)=O)c(C)c([B-](F)(F)F)c1 686557901 HTLIMVAVGGTBAX-NSHDSACASA-N 321.149 2.314 70 10 DEIE Cc1oc(C(=O)NCCC(C)(C)F)cc1S(=O)(=O)Cl 711015159 NQSOIRUPJGZQCE-UHFFFAOYSA-N 311.762 2.384 70 10 DEIE C#C[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1Cl)C(C)C 1337579081 WMMNVTLWZYKBKO-GFCCVEGCSA-N 317.769 2.386 70 10 DEIE O=C(CCc1ccccc1)Nc1ncc(S(=O)(=O)F)s1 1623768840 NVOVHZNUWUZTJM-UHFFFAOYSA-N 314.363 2.373 70 10 DEIE COCCC1(CNC(=O)N2CCCC[C@H](N3CCCC3)C2)CC1 161046400 AHHCWZDIESYASF-INIZCTEOSA-N 323.481 2.463 70 10 DEIE CCCOc1cccc(CC(=O)N(C)CC(=O)NC(C)(C)C)c1 161213828 KIDKYSYDNDMGIK-UHFFFAOYSA-N 320.433 2.391 70 10 DEIE CCC[C@@H](C(=O)NCc1cc(OC)c(OC)c(OC)c1)N(C)C 161277364 GVUXBZHHXMZTEX-ZDUSSCGKSA-N 324.421 2.059 70 10 DEIE CCCc1noc(CN2CCC[C@H](c3nncn3CC)C2)n1 161277757 YLAIUKGIHHVQQR-LBPRGKRZSA-N 304.398 2.013 70 10 DEIE Cc1cncc(/C=C/C(=O)N[C@@H]2CCN(c3ccccn3)C2)c1 161294276 UNLIRAMDHCJZDY-SQRWCISFSA-N 308.385 2.193 70 10 DEIE 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311.068 2.143 70 10 DEIE Cc1cc(Cl)cc(C(=O)N2CC[C@@H](S(=O)(=O)F)C2)c1 1968235368 KUDRIGJAOLQBTA-LLVKDONJSA-N 305.758 2.162 70 10 DEIE CC(C)(O)CCN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1 160276845 XPGMLMHTZNXBDE-MELADBBJSA-N 312.454 2.383 70 10 DEIE C[C@H](CF)NC(=O)c1cc(S(=O)(=O)Cl)cn1C1CCC1 702653814 CYCXEVGMWMWKNG-MRVPVSSYSA-N 322.789 2.228 70 10 DEIE O=C(c1cc(F)c(F)cc1S(=O)(=O)Cl)N1CC[C@H]2C[C@H]21 706981766 FHHGCRNEWHBIFS-QUBYGPBYSA-N 321.732 2.127 70 10 DEIE COc1cc(OC)c(S(=O)(=O)Cl)c(OC(F)F)c1 2055328068 HFNIUZTZEWKARS-UHFFFAOYSA-N 302.682 2.233 70 10 DEIE Cc1cc(C(=O)N2C[C@H]3C[C@H]3C2)cc(S(=O)(=O)Cl)c1F 380720294 ACZJOTSKAVVEFW-AOOOYVTPSA-N 317.769 2.154 70 10 DEIE O=S(=O)(Cl)c1cnn(C[C@@H]2C[C@@H]3CCCC[C@H]3O2)c1 380984137 GJIZPIABJGROFC-JBLDHEPKSA-N 304.799 2.158 70 10 DEIE CO[C@@H]1CN(c2nc(C)nc(C)c2[B-](F)(F)F)CC[C@H]1C 2172765314 PFRPLESQSMDGER-LDYMZIIASA-N 302.129 2.009 70 10 DEIE CC[C@@H]1C[C@H]1C(=O)Nc1nc(C)c(S(=O)(=O)Cl)s1 387806543 KRPIHWIWTIMRFO-RNFRBKRXSA-N 308.812 2.364 70 10 DEIE C[C@H]1C[C@H]1N(C)C(=O)CCc1ccc(S(=O)(=O)Cl)cc1 2172925700 BGHPUSBJJWYXKQ-GXFFZTMASA-N 315.822 2.414 70 10 DEIE CCc1[nH]nc(C(=O)O[C@H]2CC[C@H](C)C2)c1S(=O)(=O)Cl 721571979 SCQLRYJEDMENHW-YUMQZZPRSA-N 320.798 2.245 70 10 DEIE CCCn1c([C@@H]2CCC[C@@H](OC)C2)nnc1S(=O)(=O)Cl 2182781035 VLRZXKHUWQPNJX-NXEZZACHSA-N 321.830 2.288 70 10 DEIE C[C@@H]1OC2(CN(C)c3ncc(F)cc3[B-](F)(F)F)CC1C2 2193117303 JPASAEGHJDHSMC-BVDKZHGWSA-N 303.088 2.279 70 10 DEIE Cc1nn(C[C@@]23CC[C@@](C)(CO2)C3)c(C)c1S(=O)(=O)Cl 2193706355 UGVXESAKNYRFAI-OLZOCXBDSA-N 318.826 2.387 70 10 DEIE CC(C)[C@H](COc1cnc(Cl)nc1)CS(=O)(=O)Cl 2046990184 MASGLJCVYUOADZ-MRVPVSSYSA-N 313.206 2.350 70 10 DEIE CN(CC1CC1)C(=O)c1csc(S(=O)(=O)Cl)c1F 2055650267 KJQYCPQLUQAEFP-UHFFFAOYSA-N 311.787 2.297 70 10 DEIE CO[C@@]1(CN(C)c2ncc([B-](F)(F)F)cc2F)CCSC1 2186276226 JCTGFXDROYSJHJ-GFCCVEGCSA-N 323.144 2.233 70 10 DEIE C[C@H]1C[C@@]1(C)COc1ccc(C(=O)O)cc1S(=O)(=O)F 2191428713 QRCQYSZJGMZYQX-SDBXPKJASA-N 302.323 2.468 70 10 DEIE CC1(C)OCCO[C@H]1COc1ccccc1S(=O)(=O)Cl 2186966888 GRLVPJTYBNCRKM-LBPRGKRZSA-N 320.794 2.187 70 10 DEIE COC[C@@H]1CC[C@@H](N(C)CCC[C@@H](C)S(=O)(=O)Cl)C1 2099267729 FDONPPLUZWLTRN-JHJVBQTASA-N 311.875 2.471 70 10 DEIE C[C@@H](CCCN1CCC[C@]2(CCOC2)C1)S(=O)(=O)Cl 2114749963 CIVWIXMJBVXVBV-STQMWFEESA-N 309.859 2.226 70 10 DEIE O=S(=O)(Cl)CC1(CO[C@@H]2[C@H]3C[C@H]3[C@H]3C[C@H]32)CCOCC1 2208365194 ITUVQTVSPVNFBZ-CXYFJQCHSA-N 320.838 2.023 70 10 DEIE Cc1c(S(=O)(=O)Cl)c([N+](=O)[O-])nn1[C@H](C)C(F)(F)F 2278454906 LAGMUXRHSPYHOW-SCSAIBSYSA-N 321.664 2.151 70 10 DEIE COCc1nc(S(=O)(=O)Cl)cn1C[C@H]1CCC1(F)F 2335305183 PVVKAGRRJCVKMB-SSDOTTSWSA-N 314.741 2.002 70 10 DEIE CCC=C(C)COC(=O)c1cc(S(=O)(=O)Cl)cn1C 2338452304 LGINWUKOFBMDBC-UHFFFAOYSA-N 305.783 2.466 70 10 DEIE CC#CCOC(=O)c1cc(S(=O)(=O)Cl)c(COC)s1 2342069999 UXUBESJAYQYNDY-UHFFFAOYSA-N 322.791 2.002 70 10 DEIE CCCOc1ccc([C@H]2CC(=O)N2S(=O)(=O)Cl)cc1 113496919 ZKJKUKSQMNFINE-LLVKDONJSA-N 303.767 2.232 70 10 DEIE 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AFOUXCGUGUYIEE-MRVPVSSYSA-N 317.329 2.178 70 10 DEIE Cc1ccc(C(=O)NC[C@H]2CC23CC3)cc1S(=O)(=O)Cl 697497613 KPRDGPOBXDNOIR-LLVKDONJSA-N 313.806 2.452 70 10 DEIE CCCn1c(-c2ncccc2Cl)nnc1S(=O)(=O)Cl 704229478 WPNYPEFRWGYFFS-UHFFFAOYSA-N 321.189 2.331 70 10 DEIE CCCn1c([C@@]23CCCC[C@H]2C3)nnc1S(=O)(=O)Cl 710355568 RXOUXZPRPLHDPV-JOYOIKCWSA-N 303.815 2.447 70 10 DEIE Cc1ncc([B-](F)(F)F)c(N2CCC[C@]23CCSC3)n1 2116126342 DIXXZIAFWRGRFH-GFCCVEGCSA-N 302.154 2.315 70 10 DEIE O=C(Nc1cccc(S(=O)(=O)F)c1)c1ncc(Cl)cn1 1539006559 LWXPKQMXCFEZGE-UHFFFAOYSA-N 315.713 2.041 70 10 DEIE COc1ccccc1CCC(=O)N[C@H](C)Cc1cc(C)[nH]n1 161221505 ULNOILMRSHLRPE-GFCCVEGCSA-N 301.390 2.407 70 10 DEIE O=C(N[C@H]1CCc2ncnn2C1)N1CCC[C@H]1c1cccs1 161230449 UHHSGTBJOSKYDB-RYUDHWBXSA-N 317.418 2.201 70 10 DEIE CCC[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N(C)C 161287284 LUMBLWNRVKJSSM-HNNXBMFYSA-N 303.406 2.482 70 10 DEIE CCn1cnnc1[C@@H]1CCCN(CCCN2CCCCC2)C1 161444227 RSVIFDYLOGVTCK-MRXNPFEDSA-N 305.470 2.353 70 10 DEIE CN[C@@H](CSCC(C)C)c1c(OC)cnn1CCN(C)C 160124797 RKDDWFCUGFTGRH-ZDUSSCGKSA-N 314.499 2.103 70 10 DEIE COC(=O)c1ccc2[nH]cc(C(=O)CN(C)CC3CC3)c2c1 160621174 GGDHWGBWJMWKHR-UHFFFAOYSA-N 300.358 2.479 70 10 DEIE C[C@H](Cc1ccc(O)cc1)N(C)C(=O)NCCn1cccc1 159638144 YJKOQZLJYAWEOO-CQSZACIVSA-N 301.390 2.466 70 10 DEIE COC(=O)c1cccc(CSC[C@H](C)CS(C)(=O)=O)c1 159654201 LMGYBACECMRENO-NSHDSACASA-N 316.444 2.387 70 10 DEIE COc1c(C)cnc(OC(F)(F)F)c1S(=O)(=O)Cl 382645417 WMFSUIIIOWSSKN-UHFFFAOYSA-N 305.661 2.225 70 10 DEIE C[C@H](CCO[C@@H]1[C@@H]2[C@H]3C[C@@H]4[C@@H]([C@H]32)[C@@H]41)CCS(=O)(=O)Cl 2143298668 CGQDZBSURJLMPY-TUBMUDSSSA-N 304.839 2.498 70 10 DEIE C[C@H]([C@@H]1[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)S(=O)(=O)Cl 1880813983 YAIMSYWCXLVKHQ-UTINFBMNSA-N 309.815 2.199 70 10 DEIE CCNCc1ccc(S(=O)(=O)N[C@H]2CC[C@H](C)C2)s1 159785602 RJSAYYCAZXSZHP-QWRGUYRKSA-N 302.465 2.325 70 10 DEIE CC(C)(O)CCN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 160276981 XPGMLMHTZNXBDE-IHRRRGAJSA-N 312.454 2.383 70 10 DEIE 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CCC[C@@H]1COC[C@H]1N(C)CCC[C@@H](C)S(=O)(=O)Cl 2099275551 UBDGROKTKLDFIN-JHJVBQTASA-N 311.875 2.471 70 10 DEIE CN(C[C@]12CO[C@](C)(C1)C2)c1ncc(F)cc1[B-](F)(F)F 2202875142 QEPDLBFFEVEQKW-BETUJISGSA-N 303.088 2.280 70 10 DEIE Fc1cnc(N2CCC[C@@H](OC(F)F)C2)c([B-](F)(F)F)c1 2235656593 JNSFOWXBDOCWOK-MRVPVSSYSA-N 313.030 2.483 70 10 DEIE Cn1ccnc1COCc1c(F)cc([B-](F)(F)F)cc1F 2287133513 PECPTTPNWGXJFP-UHFFFAOYSA-N 305.035 2.470 70 10 DEIE CC(C)(F)c1nnc(S(=O)(=O)Cl)n1-c1ccccc1 311872610 ZLHQNAFXNUBIIL-UHFFFAOYSA-N 303.746 2.399 70 10 DEIE Nc1nc(/C=C\c2ccc3c(c2)NC(=O)CC(=O)N3)cs1 217942362 XNDOEKRHHUAUIK-IWQZZHSRSA-N 300.343 2.176 70 10 DEIE CCOC(=O)N1CCN(C(=O)N/C=C/c2ccc(C)cc2)CC1 218131709 MGJHVIJMRNSWJW-CMDGGOBGSA-N 317.389 2.449 70 10 DEIE CC(C)(CNCc1ccccc1)COCCCS(C)(=O)=O 159753185 RAWFOQRARCQAJA-UHFFFAOYSA-N 313.463 2.254 70 10 DEIE O=C(NCc1ccc(S(=O)(=O)Cl)cc1)C1(CF)CCC1 2166515677 ZRSZWQYKYBUTHW-UHFFFAOYSA-N 319.785 2.370 70 10 DEIE N#CCOc1ccc(Br)c(S(=O)(=O)Cl)c1 575601185 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COC(=O)c1cc(C)cc(S(=O)(=O)F)c1Br 1936881659 VYXUWABRTHOJGW-UHFFFAOYSA-N 311.128 2.202 70 10 DEIE O=C(c1csc(S(=O)(=O)Cl)c1F)N1C[C@H]2C[C@@H](C1)C2 1899448849 KGTJEVMTNFXEBT-KNVOCYPGSA-N 323.798 2.297 70 10 DEIE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@H]2S(=O)(=O)F)C1 1882689478 AYEUXDFXMFMAQI-GWCFXTLKSA-N 307.387 2.465 70 10 DEIE O=[N+]([O-])c1nn([C@@H]2C=CCCCC2)cc1S(=O)(=O)Cl 1885371136 XZQIALXONJSSRE-MRVPVSSYSA-N 305.743 2.390 70 10 DEIE CCn1c(-c2c(F)ccc(C)c2F)nnc1S(=O)(=O)Cl 158184181 XRORDCMYEIWTMD-UHFFFAOYSA-N 321.736 2.479 70 10 DEIE NC[C@H]1CCc2nc(-c3cncc(Br)c3)ncc2C1 159862151 KHGNEUGWTYYTIP-VIFPVBQESA-N 319.206 2.365 70 10 DEIE Cc1cc(C(=O)N2CC3CC2C3)cc(S(=O)(=O)Cl)c1C 2151759887 MGEMEKKKDIZCBV-UHFFFAOYSA-N 313.806 2.465 70 10 DEIE O=C(O[C@H]1CCCOC1)c1cc(S(=O)(=O)Cl)ccc1F 2152521631 MCTRNCXKARBGFJ-QMMMGPOBSA-N 322.741 2.089 70 10 DEIE O=S(=O)(Cl)c1cn(CCc2c(F)cccc2F)cn1 403020690 XGANZXFNPGHDIA-UHFFFAOYSA-N 306.721 2.332 70 10 DEIE CN(CC1[C@@H]2CC[C@@H]12)C(=O)c1ccc(S(=O)(=O)Cl)cc1 2160000589 MFGFKYIQXUMXHB-VXGBXAGGSA-N 313.806 2.342 70 10 DEIE CCCC1(NC(=O)c2cc(S(=O)(=O)Cl)cn2CC)CC1 379452034 MUQYJMBQRTYEPU-UHFFFAOYSA-N 318.826 2.498 70 10 DEIE O=C(c1cc(F)ccc1S(=O)(=O)Cl)N1CC[C@@H](CF)C1 711449191 ZDWHHMCSWPGNPZ-QMMMGPOBSA-N 323.748 2.185 70 10 DEIE COc1c(S(=O)(=O)Cl)ccc(C=O)c1OC(F)F 2055313117 FKCSAKKQJYNZII-UHFFFAOYSA-N 300.666 2.037 70 10 DEIE CCCN(C[C@H]1CCOC1)c1ncc([B-](F)(F)F)c(C)n1 2172764701 HDUHXWLTCVNGLE-LLVKDONJSA-N 302.129 2.092 70 10 DEIE CN1CC[C@H]2[C@H](CCN2c2ncc([B-](F)(F)F)cc2Cl)C1 2172791243 BVTPJXHPQAPCQH-SKDRFNHKSA-N 318.559 2.320 70 10 DEIE Cc1cnc(N2CCO[C@@](C)(C(F)F)C2)c([B-](F)(F)F)c1 2172798603 VNRKZBCXHNAJIW-GFCCVEGCSA-N 309.067 2.305 70 10 DEIE CCN1CC[C@H](N(CC)c2nccc(C)c2[B-](F)(F)F)C1 2172773847 HENPZXPGVPDFDF-LBPRGKRZSA-N 300.157 2.365 70 10 DEIE CN(Cc1ncoc1C(F)F)c1ncncc1[B-](F)(F)F 2172776326 OBRGBEJDJRCXRM-UHFFFAOYSA-N 307.011 2.093 70 10 DEIE COc1nn(C)cc1COc1ccc(F)cc1[B-](F)(F)F 2168064345 ROMJGKFDWXCHRB-UHFFFAOYSA-N 303.044 2.201 70 10 DEIE CO[C@@H]1CC[C@H](C(=O)Nc2ccccc2S(=O)(=O)F)C1 2174880065 HYWIOWYCNRKXLD-VHSXEESVSA-N 301.339 2.098 70 10 DEIE Cc1ncc([B-](F)(F)F)c(N(C)CC2(C)CCOCC2)n1 2175016439 FWMRUTVWIGUHFQ-UHFFFAOYSA-N 302.129 2.092 70 10 DEIE O=S(=O)(F)c1ccc(OCCO[C@@H]2CC2(F)F)c(F)c1 2191422073 PRBZTUXKVSPOMS-SNVBAGLBSA-N 314.256 2.287 70 10 DEIE Cc1ccc(C(=O)N(C)C[C@@H]2C[C@@H]2F)cc1S(=O)(=O)Cl 2188374142 PJJKYVVUKMOQBE-QWRGUYRKSA-N 319.785 2.353 70 10 DEIE F[B-](F)(F)c1cnc(O[C@H]2C[C@@H](n3cnnc3)C2)c(Cl)c1 2183693494 XOGLEFRLEPBQSE-DTORHVGOSA-N 317.487 2.163 70 10 DEIE CC1(C)CC12CC(NC(=O)c1cc(S(=O)(=O)Cl)c[nH]1)C2 2183995308 LXPBVEMOBFRDPT-UHFFFAOYSA-N 316.810 2.251 70 10 DEIE COc1nc(N(C)C[C@H]2CC23CCC3)ncc1[B-](F)(F)F 2189613464 COPAOKVQWFQQFU-SECBINFHSA-N 300.113 2.166 70 10 DEIE F[B-](F)(F)c1cccc(COC[C@@H]2OC[C@@H]3CCO[C@H]32)c1 2200772192 VLRJJFSYHVKMEP-FPMFFAJLSA-N 301.093 2.062 70 10 DEIE Cc1ncsc1[C@@H]1OC2(CS(=O)(=O)Cl)CC1(C#N)C2 2105839039 WCSZFSLJWSCXAJ-WHXUTIOJSA-N 318.807 2.134 70 10 DEIE CN(CCCCS(=O)(=O)Cl)C[C@@H]1CC2(CCC2)CO1 2110154678 HRIYHMZKGWWRAS-LBPRGKRZSA-N 309.859 2.226 70 10 DEIE C[C@]12CC[C@H]1CN(C(=O)c1ccccc1S(=O)(=O)Cl)C2 2208424288 ZXNKQBXMTVAFSK-IINYFYTJSA-N 313.806 2.486 70 10 DEIE CCN1CC[C@@H](OC[C@H](CC2CC2)CS(=O)(=O)Cl)C1 2230169915 RZCINHSVLNLOKE-QWHCGFSZSA-N 309.859 2.082 70 10 DEIE O=C([C@H]1COCCC1(F)F)N1CCC([B-](F)(F)F)CC1 2231060767 YZXFVIKOPGCIQF-SECBINFHSA-N 300.056 2.498 70 10 DEIE CCCC1(OC(=O)c2csc(S(=O)(=O)Cl)c2)COC1 2272938707 ZXEKDDKTBVVHTN-UHFFFAOYSA-N 324.807 2.402 70 10 DEIE CN1CC[C@@](C)(COc2cccc(S(=O)(=O)Cl)c2)C1 2278823648 DGIQAQLNCWIEBP-CYBMUJFWSA-N 303.811 2.335 70 10 DEIE Cc1cc(C(=O)N(C)CC2CC2)cc(S(=O)(=O)Cl)c1 115019524 WRGGTGGUEAEPDB-UHFFFAOYSA-N 301.795 2.405 70 10 DEIE CC1(C)COC[C@@H]1c1nnc(S(=O)(=O)Cl)n1C(C)(C)C 2361321856 PAKMQZNQKONAHZ-MRVPVSSYSA-N 321.830 2.101 70 10 DEIE Cc1ccc([C@H](NN)[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c(F)c1 217404289 SXNUDKWBTJASSY-YWPYICTPSA-N 314.426 2.242 70 10 DEIE CCOc1ccc(C)cc1[C@@H](C)NC(=O)Nc1ccc(=O)[nH]n1 217303812 CNMYAYCNVIQZLH-LLVKDONJSA-N 316.361 2.360 70 10 DEIE N#Cc1cccc(SCCS(=O)(=O)Cl)c1[N+](=O)[O-] 131315628 UJIUDZMTQLMIRK-UHFFFAOYSA-N 306.752 2.127 70 10 DEIE COC(C)(C)[C@H](C)NC(=O)c1cccc(S(=O)(=O)Cl)c1 720050176 MQVUQVVLQJEEOP-VIFPVBQESA-N 319.810 2.157 70 10 DEIE CCCN1C[C@@H](c2ccc(S(=O)(=O)Cl)cc2)CC1=O 585671592 ZIKPQVMDGPJABG-NSHDSACASA-N 301.795 2.340 70 10 DEIE CC(C)(C)OC(=O)Nc1ncccc1CCS(=O)(=O)F 1952968642 ULIUQHGISGFAPS-UHFFFAOYSA-N 304.343 2.270 70 10 DEIE COc1ccc(S(=O)(=O)Cl)cc1NC(=O)C1(C)CC1 389402871 JAZGPEVRAPLBNU-UHFFFAOYSA-N 303.767 2.361 70 10 DEIE CC[C@@H](CO[C@H]1C[C@H](n2cccn2)C1)CS(=O)(=O)Cl 2127415011 NOOXEGSCCUMUHK-SRVKXCTJSA-N 306.815 2.198 70 10 DEIE C[C@H]1C[C@H]1C(=O)NCCCc1ccc(S(=O)(=O)Cl)cc1 103105554 QIGYSRXPDGNWIZ-GXFFZTMASA-N 315.822 2.319 70 10 DEIE COCCN(CCNCc1ccncc1)C(=O)OC(C)(C)C 218143950 AOYPWFWAEDEETE-UHFFFAOYSA-N 309.410 2.055 70 10 DEIE COc1ccc(C)cc1NS(=O)(=O)c1ccc(CO)s1 217892210 PKBSHKHLJPAOFJ-UHFFFAOYSA-N 313.400 2.358 70 10 DEIE Cc1noc(NC(=O)Cc2ccc(S(=O)(=O)F)cc2)c1C 1354127278 HJDRXOXFQAKKCK-UHFFFAOYSA-N 312.322 2.131 70 10 DEIE NCC[C@@H]1CCN(C(=O)Cc2cccc(Br)c2)C1 217268436 RNJZNWKHUHWBMJ-LLVKDONJSA-N 311.223 2.189 70 10 DEIE Cc1ccc(S(=O)(=O)Cl)cc1C(=O)OC[C@H]1CCOC1 115811988 IJRFADLUPMDWQD-JTQLQIEISA-N 318.778 2.116 70 10 DEIE CC[C@@H](NC(=O)c1cccc(S(=O)(=O)F)c1)C(F)(F)F 1628135665 JRVFTCWCFGOXTD-SECBINFHSA-N 313.272 2.416 70 10 DEIE CCN1CCC[C@H](NC(=O)Nc2ccn(CC(F)(F)F)n2)C1 160398290 PBAAPCVUKQTCHV-JTQLQIEISA-N 319.331 2.051 70 10 DEIE CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C[C@](C)(O)CC 160519472 MDKRMXUKIMBPMC-QGZVFWFLSA-N 321.421 2.066 70 10 DEIE CC[C@@H](C(=O)N1CCN(C2CC2)C(=O)C1)c1ccc(F)cc1 160760469 ZTVJTJBOSSNAAS-OAHLLOKOSA-N 304.365 2.153 70 10 DEIE Cn1cc(S(=O)(=O)Cl)cc1C(=O)O[C@H]1CCC1(C)C 2140316693 WEFAXOKILSPKMV-JTQLQIEISA-N 305.783 2.298 70 10 DEIE COc1ccc(NC(=O)C2(Cl)CC2)cc1S(=O)(=O)Cl 1888488486 LDVBRALYTVLGTC-UHFFFAOYSA-N 324.185 2.333 70 10 DEIE Cn1cc(S(=O)(=O)Cl)cc1C(=O)NCC(C)(C)C1CC1 2144283660 DUCDPAMSBVFNLW-UHFFFAOYSA-N 318.826 2.119 70 10 DEIE CC12CC(C1)N(C(=O)c1csc(S(=O)(=O)Cl)c1)C2 2035899475 IYYYSQBSTHGZQD-UHFFFAOYSA-N 305.808 2.300 70 10 DEIE C[C@H]1[C@H](C)CCN1C(=O)c1cccc(S(=O)(=O)Cl)c1 380732620 KFCUJZONCQZMKC-ZJUUUORDSA-N 301.795 2.485 70 10 DEIE Cc1nc(N2CCO[C@H](C(F)F)CC2)ccc1[B-](F)(F)F 2172779656 GHWFZDLVCNUHNV-JTQLQIEISA-N 309.067 2.305 70 10 DEIE Cc1ncc([B-](F)(F)F)c(N(C)[C@H]2C[C@@H]3CSC[C@@H]3C2)n1 2172766052 AIOIKKPUCAKJMN-URLYPYJESA-N 316.181 2.417 70 10 DEIE CC(C)(C)[C@H]1CCN(c2ncc([B-](F)(F)F)cn2)CCO1 2172784300 BRLQJGRPLJLPKQ-LLVKDONJSA-N 302.129 2.172 70 10 DEIE CCN(C)C1CCN(c2nccc(C)c2[B-](F)(F)F)CC1 2172782719 VQKORAXBTWJVRL-UHFFFAOYSA-N 300.157 2.365 70 10 DEIE CCC1(CC)C[C@H](N(C)c2ncc([B-](F)(F)F)cn2)CO1 2189348692 RZSHOUMSOHFYJN-NSHDSACASA-N 302.129 2.315 70 10 DEIE CCN(C)C(=O)c1cc(S(=O)(=O)Cl)ccc1OCCF 2189519640 YLXHVMUYSWJCJN-UHFFFAOYSA-N 323.773 2.054 70 10 DEIE CO[C@H](C(=O)N1CCC[C@H]([B-](F)(F)F)C1)[C@@H]1CCCOC1 2190463328 XFGOTKWPVJTECZ-WOPDTQHZSA-N 308.129 2.268 70 10 DEIE O=C(c1csc(S(=O)(=O)Cl)c1F)N1CCCCC1 2055650745 NVSTZFXXIXABJG-UHFFFAOYSA-N 311.787 2.441 70 10 DEIE Cc1cc(OCCN2CC[C@H](C)C2)ccc1S(=O)(=O)F 2191421660 LFDHPZGRWHYYFR-NSHDSACASA-N 301.383 2.374 70 10 DEIE CC(C)N1C[C@@H]2C[C@H]1CN2c1ncc([B-](F)(F)F)cc1Cl 2187558093 UZKMGAIUWDPEOA-QWRGUYRKSA-N 318.559 2.461 70 10 DEIE C[C@@H](CCCN(C)C[C@H]1COC(C)(C)C1)S(=O)(=O)Cl 2103166209 VLTCBKHCFZYQMR-RYUDHWBXSA-N 311.875 2.471 70 10 DEIE CC(F)(F)[C@H]1C[C@H]1c1nnc(S(=O)(=O)Cl)n1C1CC1 2108153943 MEIPCLIZLHWVOI-RQJHMYQMSA-N 311.741 2.299 70 10 DEIE C[C@@H]1CC[C@@H](N(C)C(=O)c2cc(S(=O)(=O)Cl)c[nH]2)C1 2095195572 AZQGZRHMTIJSIV-RKDXNWHRSA-N 304.799 2.203 70 10 DEIE COCC1CC(OC(=O)c2cc(S(=O)(=O)Cl)c(C)o2)C1 2207463733 HQDFJZCLRZDIOY-UHFFFAOYSA-N 322.766 2.097 70 10 DEIE COc1ccc([B-](F)(F)F)c(N2CC[C@H]3[C@@H](C2)C3(F)F)n1 2280489911 CBIDPGPCUUWLGC-JGVFFNPUSA-N 307.051 2.236 70 10 DEIE Cc1nc(C)c([B-](F)(F)F)c(OC[C@]23C[C@](C)(CO2)C3)n1 2280955569 KQSKGYHVBYYIMN-BETUJISGSA-N 301.097 2.096 70 10 DEIE C[C@H]([C@H]1C[C@@H]2CCO[C@@H]21)N(C)c1nc([B-](F)(F)F)cs1 2333155138 DREARFQQCWUGEC-LOKLDPHHSA-N 305.154 2.447 70 10 DEIE COCc1nc(S(=O)(=O)Cl)cn1C[C@H]1C[C@@H]2CC[C@H]1C2 2359365753 HAUKXEVVGJFTTM-OUAUKWLOSA-N 318.826 2.393 70 10 DEIE COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1C(=O)C(C)C 217954034 WPJLHNUVIHJITA-WCQYABFASA-N 309.337 2.003 70 10 DEIE CCCc1ccc(OCNC(=O)N(CCOC)CCOC)cc1 217294059 JMDBPZWOOCFNKT-UHFFFAOYSA-N 324.421 2.280 70 10 DEIE O=C(N/C=C/c1ccccc1F)NCCCN1CCCC1=O 217747104 YXWWZYRLSNUKQC-CSKARUKUSA-N 305.353 2.108 70 10 DEIE COc1cccc2oc(=O)cc(OS(=O)(=O)C(F)(F)F)c12 139593238 MDSVEYVLXRKECF-UHFFFAOYSA-N 324.232 2.030 70 10 DEIE CCn1ncc(Br)c1[C@@H](Cc1ccsc1)NN 161408072 WQAKUGBECWXXCA-SNVBAGLBSA-N 315.240 2.474 70 10 DEIE Cc1cc(Cn2cc(S(=O)(=O)Cl)nc2C(C)C)n(C)n1 91324076 JINBQXOATFYVDJ-UHFFFAOYSA-N 316.814 2.024 70 10 DEIE CN(CCCCS(=O)(=O)Cl)C[C@H]1C[C@]12CCCOC2 1895497917 KXKXYCCKKLJVRG-OLZOCXBDSA-N 309.859 2.084 70 10 DEIE C[C@H](Cc1cnc(Br)s1)S(=O)(=O)Cl 1952932002 BYJQZXQHGLZXFZ-SCSAIBSYSA-N 304.618 2.405 70 10 DEIE O=S(=O)(Cl)c1cccc(OC[C@H]2C[C@@]23CCOC3)c1 1896974903 OEFYDGNYKKOTGY-ZWNOBZJWSA-N 302.779 2.420 70 10 DEIE Cc1c(S(=O)(=O)Cl)c2ccccc2n1Cc1nc[nH]n1 694689366 PCMUBOVLXHUDJD-UHFFFAOYSA-N 310.766 2.044 70 10 DEIE F[B-](F)(F)c1csc(N2CC[C@H](CN3CCCC3)C2)n1 2116132684 SOELMFXTCRCENW-SNVBAGLBSA-N 304.170 2.120 70 10 DEIE O=S(=O)(Cc1ccncc1)N1CCC[C@H]([B-](F)(F)F)C1 2133919780 MIKFETGWUFQLAR-NSHDSACASA-N 307.126 2.225 70 10 DEIE Cc1nc(C(=O)Nc2ccc(F)c(CS(=O)(=O)F)c2)co1 1462260761 FTNCRWHVTNMUMI-UHFFFAOYSA-N 316.285 2.174 70 10 DEIE CS(=O)(=O)CCCCOCc1cccc([B-](F)(F)F)c1 2136000888 LTQOMEVJJFIVKL-UHFFFAOYSA-N 309.138 2.082 70 10 DEIE CCn1cc(S(=O)(=O)Cl)cc1C(=O)N1CCCC[C@@H]1C 229717742 METRYVBBUIVWIN-JTQLQIEISA-N 318.826 2.450 70 10 DEIE CC(C)[C@H](O)CC(=O)NCc1nc(-c2cccc(Cl)c2)no1 160226426 BZECQWWGIWODOM-GFCCVEGCSA-N 323.780 2.413 70 10 DEIE Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NC1(CO)CC1 160239409 UBGPHDGFYHRNFD-SNAWJCMRSA-N 311.813 2.155 70 10 DEIE CCOC(=O)C1CCN(C(=O)c2cccc(N)c2Cl)CC1 160252975 APEPSTLFGDDYGO-UHFFFAOYSA-N 310.781 2.338 70 10 DEIE C[C@@H](NC(=O)NC[C@@H]1CCCO1)c1ccccc1-n1cccn1 160268982 BDNYVNLCKVSPJO-KGLIPLIRSA-N 314.389 2.412 70 10 DEIE CC(C)NC(=O)CC[S@](=O)c1ncc(C(C)(C)C)s1 160428963 AXKPZJDTHHYTOG-LJQANCHMSA-N 302.465 2.463 70 10 DEIE CC[C@H](CCN)NS(=O)(=O)c1cccc(C(F)(F)F)c1C 160886636 DAFPGZSXRKHMSZ-SNVBAGLBSA-N 324.368 2.420 70 10 DEIE O=C(O)c1cc(S(=O)(=O)Cl)cc(F)c1Br 155672281 KCMZWUNIRZJLPT-UHFFFAOYSA-N 317.519 2.214 70 10 DEIE CC(C)(C)NC(=O)CN1CCO[C@@]2(CCc3ccccc32)C1 159456965 ZVPUZPFWMDKMFV-SFHVURJKSA-N 302.418 2.075 70 10 DEIE CCC(CC)(CC)CNC(=O)N1CC[C@H](N2CCOCC2)C1 159866038 ZYBABKDHGKRYGS-HNNXBMFYSA-N 311.470 2.319 70 10 DEIE O=C1C[C@@H](C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)CCN1 159994312 SDIJGWSPHQLANW-WFASDCNBSA-N 306.793 2.434 70 10 DEIE O=S1(=O)CCCC[C@@H]1CN1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 1879772155 OKCBUIDNCXDNEF-UTUOFQBUSA-N 310.170 2.267 70 10 DEIE CC(C)(C)OC(=O)N1C[C@@H]2CC(S(=O)(=O)F)C[C@H](C2)C1 1887733864 MECBCQVZWLXRSJ-UWVGGRQHSA-N 307.387 2.321 70 10 DEIE O=C([C@@H]1C[C@@H]2CCCCCC[C@H]21)N1CC(S(=O)(=O)F)C1 1968216305 WDNXGQDHPYHYTA-CYZMBNFOSA-N 303.399 2.103 70 10 DEIE CC(C)(C)n1c(C[C@@H]2CCCCO2)nnc1S(=O)(=O)Cl 158165345 VWEZJCNKOGPJEV-VIFPVBQESA-N 321.830 2.072 70 10 DEIE CC(C)n1c(CC[C@@H]2CCCCO2)nnc1S(=O)(=O)Cl 158104802 KHSCLIDTTDPZMU-JTQLQIEISA-N 321.830 2.288 70 10 DEIE CC[C@H](NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1)C(C)C 163315323 PMIXRAPAUAUGAL-LBPRGKRZSA-N 323.411 2.058 70 10 DEIE Cn1cnc(COc2c(F)cc(F)cc2S(=O)(=O)Cl)c1 2151452048 KDZLHFWUHZUWSK-UHFFFAOYSA-N 322.720 2.205 70 10 DEIE CC[C@@H](CCCN(C)[C@H]1CCN(C2CC2)C1)S(=O)(=O)Cl 2160054333 IULXZRGQYPVTEW-KBPBESRZSA-N 322.902 2.282 70 10 DEIE CCc1nc(S(=O)(=O)Cl)cn1CC[C@@H]1CCCCO1 688100217 BYPWPMRMUDCRNQ-JTQLQIEISA-N 306.815 2.332 70 10 DEIE CC(C)Cn1c([C@@H]2CCOC[C@@H]2C)nnc1S(=O)(=O)Cl 380220924 JJCLMZQLRAESQJ-VHSXEESVSA-N 321.830 2.002 70 10 DEIE CC1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(S(=O)(=O)Cl)c[nH]1 692970984 JWDZCDSPWKANAV-PBINXNQUSA-N 316.810 2.345 70 10 DEIE CN(c1ncc(C(F)(F)F)cc1[B-](F)(F)F)[C@H]1CCOC1 2172769784 BYQBEYOXUMKFJH-QMMMGPOBSA-N 313.030 2.380 70 10 DEIE CCCOC[C@H]1CCCN1c1ncnc(C)c1[B-](F)(F)F 2172767400 UAZFNPQCXXDYNF-LLVKDONJSA-N 302.129 2.235 70 10 DEIE Cc1c(S(=O)(=O)Cl)c([N+](=O)[O-])nn1CCC1CCC1 398654953 BXWBPLJIJRHDBA-UHFFFAOYSA-N 307.759 2.217 70 10 DEIE O=C(CCOc1ccc(S(=O)(=O)Cl)cc1)N1CCCC1 2173770766 ULSYIQUIOQAGDI-UHFFFAOYSA-N 317.794 2.005 70 10 DEIE CN(c1ncc([B-](F)(F)F)cc1F)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2181332622 ALUMJBSMWVUVIL-JGPRNRPPSA-N 303.088 2.421 70 10 DEIE Cc1nc(C)c([B-](F)(F)F)c(-n2cnc(C(F)(F)F)c2)n1 2183169236 XCFLBKGBAYDSMB-UHFFFAOYSA-N 309.002 2.352 70 10 DEIE Cc1nn(CC[C@H]2CC[C@@H](C)O2)c(C)c1S(=O)(=O)Cl 2104862963 UMLZCAQSFXSGTJ-LDYMZIIASA-N 306.815 2.385 70 10 DEIE CC(C)COCc1nnc(S(=O)(=O)Cl)n1C(C)(C)C 2109257915 KKLBLIPGGNOFTD-UHFFFAOYSA-N 309.819 2.133 70 10 DEIE CCN(CC)CCCn1nc(C)c(S(=O)(=O)Cl)c1C 2089176771 FIHHGQIQXVTYIL-UHFFFAOYSA-N 307.847 2.159 70 10 DEIE CCCC#CCOc1ccc([N+](=O)[O-])cc1S(=O)(=O)F 2203846372 GUSZVDRWSMNJLM-UHFFFAOYSA-N 301.295 2.435 70 10 DEIE CCn1cc(S(=O)(=O)Cl)cc1C(=O)NC[C@H]1CC[C@H]1C 2236168122 MXYUPKXSZXFNRD-NXEZZACHSA-N 318.826 2.211 70 10 DEIE C[C@H]1CN(C[B-](F)(F)F)CC2(CN(C(=O)OC(C)(C)C)C2)O1 2242107683 GVCNBIPTOHJNPM-JTQLQIEISA-N 323.144 2.083 70 10 DEIE CCc1nc(S(=O)(=O)Cl)cn1C[C@H]1COCC1(C)C 2339046632 TZVSJCRSADAPQI-VIFPVBQESA-N 306.815 2.046 70 10 DEIE COC(=O)CCSCc1cccc(S(=O)(=O)Cl)c1 109365126 WHYPEZYVIJDDQO-UHFFFAOYSA-N 308.808 2.410 70 10 DEIE O=C(c1ccc(S(=O)(=O)Cl)cc1F)N1CCCCC1 105708997 OXVBEIBABZNXTH-UHFFFAOYSA-N 305.758 2.379 70 10 DEIE O=C(Nc1ccc(S(=O)(=O)Cl)nc1)c1ccccc1F 606579305 BFQMSHULSNLPKY-UHFFFAOYSA-N 314.725 2.401 70 10 DEIE CN1CCC[C@H](OC[C@@H](CS(=O)(=O)Cl)C2CCC2)C1 1893431641 PIHJRZUOSAYUFZ-STQMWFEESA-N 309.859 2.082 70 10 DEIE CO[C@H]1C[C@@H]1C(=O)Nc1ccc(S(=O)(=O)Cl)c(Cl)c1 689920384 BJFCCSMKXSXCDO-CBAPKCEASA-N 324.185 2.241 70 10 DEIE O=S(=O)(Cl)c1ccccc1O[C@@H]1CN2CCC1CC2 1893440832 JPRSWDATZQRGDV-GFCCVEGCSA-N 301.795 2.087 70 10 DEIE O=S(=O)(Cl)c1ccccc1OC[C@@H]1C[C@]12CCOC2 1896975640 TYZJCRBOIMUNRY-GWCFXTLKSA-N 302.779 2.420 70 10 DEIE O=C(NC[C@H]1C[C@H]1C1CC1)c1csc(S(=O)(=O)Cl)c1 698370143 TUCDTCIRIOJZBO-SCZZXKLOSA-N 319.835 2.452 70 10 DEIE O=C(NC[C@@H]1CC12CC2)c1ccc(F)c(S(=O)(=O)Cl)c1 697498126 OTTSXBARORHFFL-VIFPVBQESA-N 317.769 2.283 70 10 DEIE COc1nn(C[C@@H](C)C(C)C)c(OC)c1S(=O)(=O)Cl 2132763091 ZVRWSWMEYZPDFV-MRVPVSSYSA-N 310.803 2.120 70 10 DEIE CCS(=O)(=O)CCC[C@H](N)[C@@]1(N(C)C)CCC[C@@H](C)C1 217535115 NMXIJXKHSCHZBE-QLFBSQMISA-N 304.500 2.039 70 10 DEIE CCN1CC[C@@H](c2ccc(S(=O)(=O)Cl)cc2)CC1=O 106950311 UGEWINMBIYXELJ-LLVKDONJSA-N 301.795 2.340 70 10 DEIE O=C(c1ccc(S(=O)(=O)Cl)cc1F)N1CC[C@@H]2CC[C@@H]21 1924424133 AVFNEJBLZRZAEP-UFBFGSQYSA-N 317.769 2.378 70 10 DEIE 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2.095 70 10 DEIE O=C(CCc1ccc(S(=O)(=O)Cl)cc1)N1CC[C@@H]2C[C@H]21 706999287 JCOAJACFYOVSLY-DGCLKSJQSA-N 313.806 2.168 70 10 DEIE COc1nc(N2C[C@H](C)CC(C)(C)C2)ncc1[B-](F)(F)F 2172768367 IBHNZFRUNRBJPA-SECBINFHSA-N 302.129 2.412 70 10 DEIE Cc1cnc(N2CC[C@@H](N(C)C)[C@@H](C)C2)c([B-](F)(F)F)c1 2172793680 IHVLYSQPBXRFCA-WCQYABFASA-N 300.157 2.221 70 10 DEIE CCN(c1ncc([B-](F)(F)F)c2ccsc12)C1CN(C)C1 2172764573 FOBSIXVWMXGOGK-UHFFFAOYSA-N 314.165 2.491 70 10 DEIE CCN(C[C@@H]1CCCO1)c1nc(C)nc(C)c1[B-](F)(F)F 2172765233 OKYHYNPEJAOHCB-NSHDSACASA-N 302.129 2.153 70 10 DEIE O=C(CCc1ccc(S(=O)(=O)Cl)cc1)N1CC[C@@H](F)C1 689942002 UDXAWQPYXQIUEJ-LLVKDONJSA-N 319.785 2.117 70 10 DEIE COCC[C@@H]1CN(c2ncc(Cl)cc2[B-](F)(F)F)CCO1 2172800495 UHVWOAVSINXCIK-SNVBAGLBSA-N 323.531 2.031 70 10 DEIE O=C(NC1(C2CC2)CC1)c1ccc(S(=O)(=O)Cl)cc1F 697714057 KURBLSUAEVSXMW-UHFFFAOYSA-N 317.769 2.426 70 10 DEIE COc1nc(N(C)[C@@H](C)CCC(F)F)ncc1[B-](F)(F)F 2177893773 QJVWAFLROGRCQG-ZETCQYMHSA-N 312.071 2.410 70 10 DEIE Cn1cc(S(=O)(=O)Cl)cc1C(=O)O[C@@H]1CCC2CC1C2 2198411562 GSHKYKNKPRIQKS-SHVIVCPWSA-N 317.794 2.298 70 10 DEIE CC#CCCCCn1nc([N+](=O)[O-])c(S(=O)(=O)Cl)c1C 2196213905 QAYCRXLBSRPLDL-UHFFFAOYSA-N 319.770 2.221 70 10 DEIE O=C(Nc1ccc(S(=O)(=O)Cl)c(F)c1)C1[C@H]2CC[C@H]12 2103789653 MSQIPLZYZPRFRM-YUMQZZPRSA-N 303.742 2.348 70 10 DEIE COCC[C@H]1CCCN(CCC[C@H](C)S(=O)(=O)Cl)C1 2099264569 ZHGMAXHUOQLAMC-QWHCGFSZSA-N 311.875 2.472 70 10 DEIE COc1nn(C[C@H]2C[C@H]2C(C)C)c(OC)c1S(=O)(=O)Cl 2200580764 DZRDZYFUOWYKFL-BDAKNGLRSA-N 322.814 2.120 70 10 DEIE CO[C@H](COCc1cccc([B-](F)(F)F)c1)[C@@H]1CCOC1 2200754087 SKRMJGBQCURCAH-TZMCWYRMSA-N 303.109 2.309 70 10 DEIE CC(C)[C@H](COC[C@]12C[C@](C)(CO1)C2)CS(=O)(=O)Cl 2266205935 HEJYDKAUQHJSLK-UPJWGTAASA-N 310.843 2.413 70 10 DEIE CCCN(CC)C(=O)Cc1ccc(S(=O)(=O)Cl)s1 114560768 CEFMVVPZNROQSM-UHFFFAOYSA-N 309.840 2.477 70 10 DEIE CC1(C)OCB(c2cncc(C(F)(F)F)c2)COC1(C)C 170014270 VCPPQXKJVIFSFN-UHFFFAOYSA-N 301.117 2.485 70 10 DEIE Cc1cc(OC[C@H](C)CS(=O)(=O)Cl)ccc1[N+](=O)[O-] 112379192 XWIWUUMIZXFXDJ-QMMMGPOBSA-N 307.755 2.487 70 10 DEIE CCCOC(=O)c1ccc(N(C)C)c(S(=O)(=O)Cl)c1 115021125 SXFFANYSMOHRNS-UHFFFAOYSA-N 305.783 2.247 70 10 DEIE CCC(CC)CNC(=O)c1cc(S(=O)(=O)Cl)cn1C 125615205 VNKDXXLKHJINSD-UHFFFAOYSA-N 306.815 2.119 70 10 DEIE CCOc1ccccc1OCNC(=O)N1CCCC[C@@H]1CCO 217289836 UTNXEINUENDRDH-CQSZACIVSA-N 322.405 2.368 70 10 DEIE CC(C)=C(CN1CC[C@H](CN2CCOCC2)C1)[B-](F)(F)F 2365874278 XGMXFFRZNYBUFI-CYBMUJFWSA-N 305.173 2.364 70 10 DEIE COc1c(F)cc(S(=O)(=O)Cl)nc1OC(F)(F)F 396040086 KZMQKHHHYGPGCD-UHFFFAOYSA-N 309.624 2.055 70 10 DEIE CN(C[C@H]1CCCN(Cc2ccccc2)C1)S(=O)(=O)Cl 719964524 WUJVLAOZSQGUQT-CQSZACIVSA-N 316.854 2.314 70 10 DEIE CC[C@@H]1CN(c2ncc(Cl)cc2[B-](F)(F)F)CCN1C 2116160782 YSULUZDHAWLROO-SNVBAGLBSA-N 306.548 2.320 70 10 DEIE CC[C@H](CCCN1C[C@@H](OC)C[C@@H]1CF)S(=O)(=O)Cl 2133719189 MVYQSFOMYVLFAF-GRYCIOLGSA-N 315.838 2.173 70 10 DEIE Cc1nn(C[C@H]2C3C[C@@H]4C2[C@@H]4C3)c(C)c1S(=O)(=O)Cl 2134646300 GWUFINFPFZREDM-QHTHRSRISA-N 300.811 2.329 70 10 DEIE CCc1nc(C)ncc1C(=O)Nc1ccc(S(=O)(=O)F)cc1 1358469365 GGKGXCUVJJUUJR-UHFFFAOYSA-N 323.349 2.258 70 10 DEIE CCCCCNS(=O)(=O)c1cc(F)c(Cl)c(CO)c1 217446593 SAGVNTSRGDQGFT-UHFFFAOYSA-N 309.790 2.440 70 10 DEIE CCCn1c([C@H]2CC[C@@H](CC)O2)nnc1S(=O)(=O)Cl 2136774467 ZGWFIDWGKDIAHV-RKDXNWHRSA-N 307.803 2.246 70 10 DEIE CCc1[nH]nc(C(=O)N(CC)CC(C)C)c1S(=O)(=O)Cl 115791007 PJLHXKJSTWRIJH-UHFFFAOYSA-N 321.830 2.018 70 10 DEIE CCCOc1ccccc1NC(=O)N[C@H]1CCc2ncnn2C1 161082308 WJARZVUOIBNJGM-LBPRGKRZSA-N 315.377 2.203 70 10 DEIE CCn1cnnc1[C@@H]1CCCN(Cc2nc(CC(C)C)no2)C1 161284322 YOUYIPXNKPINBN-CYBMUJFWSA-N 318.425 2.259 70 10 DEIE Cc1cc(C(N)=S)cc(NC2C[C@@H]3CCC[C@H](C2)N3C)n1 161331320 CQRVKUUUCKZGNW-AGUYFDCRSA-N 304.463 2.451 70 10 DEIE NC(=S)c1ccc(N2CC[C@H]3NC(=O)CC[C@@H]3C2)c(Cl)c1 160301297 ITKFVJMDPVECJW-ZYHUDNBSSA-N 323.849 2.079 70 10 DEIE Cc1ccc(CNC2CC2)cc1S(=O)(=O)NC[C@H]1C[C@@H]1C 160835064 VNQXLAPERPTHCV-GXTWGEPZSA-N 308.447 2.181 70 10 DEIE CCn1cc(S(=O)(=O)N(C)[C@H](C)Cc2ccc(C)cc2)cn1 159802927 HVHOUOPRMYMYNH-CQSZACIVSA-N 321.446 2.463 70 10 DEIE Cc1ccc(C(=O)N2CCS(=O)(=O)C(C)(C)C2)cc1Cl 159896694 HHRZHDASWUPTIV-UHFFFAOYSA-N 315.822 2.298 70 10 DEIE CNS(=O)(=O)c1ccc(Nc2cc(F)cc(F)c2)cc1N 159567264 RPAWOXLQNKPWST-UHFFFAOYSA-N 313.329 2.199 70 10 DEIE CC(C)c1[nH]nc(C(=O)N(C)C2CCC2)c1S(=O)(=O)Cl 144547059 MCDFHYMUPHLYPG-UHFFFAOYSA-N 319.814 2.085 70 10 DEIE O=C([C@@H]1CCCCC(F)(F)C1)N1CC[C@H](S(=O)(=O)F)C1 1973301477 YFMYLIIYYLFINL-ZJUUUORDSA-N 313.341 2.102 70 10 DEIE O=C(c1ccccc1S(=O)(=O)Cl)N1C[C@@H]2CCC[C@H]2C1 158135048 HEKWRXRLRVVJEN-QWRGUYRKSA-N 313.806 2.486 70 10 DEIE CSCC[C@H](C)N(C)S(=O)(=O)c1cc(N)ccc1F 161031678 YLERLJIPJXMNEU-VIFPVBQESA-N 306.428 2.170 70 10 DEIE CO[C@@H](COc1cc(F)ccc1[B-](F)(F)F)[C@@H]1CCOC1 2150267645 AUKDXIFRMYAMSI-RNCFNFMXSA-N 307.072 2.310 70 10 DEIE CCOC(=O)C12CC(CS(=O)(=O)Cl)(C1)O[C@@H]2[C@@H](C)CC 2162147778 IRIBWVQDMPWQGY-YSARLGLZSA-N 324.826 2.082 70 10 DEIE CO[C@@H]1C[C@H](N(C)c2nc(C)ncc2[B-](F)(F)F)C1(C)C 2172765378 QEBZUEXOTOAEBK-WDEREUQCSA-N 302.129 2.089 70 10 DEIE CC[C@](C)(NC(=O)c1cc(S(=O)(=O)Cl)c[nH]1)C1CC1 691509851 MDKSGBIYANYGGT-LBPRGKRZSA-N 304.799 2.251 70 10 DEIE COc1nc(N(C)[C@H]2CCCC[C@H]2F)ncc1[B-](F)(F)F 2175601277 GNVFCUQINWKGOL-ZJUUUORDSA-N 306.092 2.257 70 10 DEIE Cc1cc(C)n(C2CN(CCC[C@@H](C)S(=O)(=O)Cl)C2)n1 2171554739 BKTJHMJSQLWMKK-GFCCVEGCSA-N 319.858 2.094 70 10 DEIE O=C(N[C@@H]1C(F)(F)C12CC2)c1ccc(S(=O)(=O)Cl)cc1 2182404309 JHGFEHDFFXUFCM-JTQLQIEISA-N 321.732 2.142 70 10 DEIE C[C@@H]1C[C@@H]1CCCN(C)C(=O)c1cc(S(=O)(=O)Cl)c[nH]1 2182868585 VCPQCNPNUOSFEN-ZJUUUORDSA-N 318.826 2.450 70 10 DEIE Cc1noc(C)c1S(=O)(=O)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194170314 DXIKHWRSVOHGIV-KOLCDFICSA-N 323.125 2.294 70 10 DEIE CCC(F)(F)COc1ccc(C(=O)O)cc1S(=O)(=O)F 2191425931 JMTNABBGHPNVES-UHFFFAOYSA-N 312.265 2.467 70 10 DEIE CC(C)(CN1CCC[C@H]([B-](F)(F)F)C1)CS(C)(=O)=O 2070263834 KTVVYONQAPQCEZ-JTQLQIEISA-N 300.175 2.371 70 10 DEIE CN(C)C[C@@H]1CN(c2ncccc2[B-](F)(F)F)C(C)(C)C1 2192932028 XCFOUPNAVZPAOV-LLVKDONJSA-N 300.157 2.303 70 10 DEIE O=C([C@H](O)Cc1ccccc1)N1CCC[C@@H]([B-](F)(F)F)C1 2205333874 LLQNCVHKAVHQTI-CHWSQXEVSA-N 300.109 2.430 70 10 DEIE Cc1cc(S(=O)(=O)Cl)ccc1C(=O)N(C)CC1(F)CC1 2206372676 WFPYNNHGJMGQJL-UHFFFAOYSA-N 319.785 2.497 70 10 DEIE COc1nc(SC[C@H]2CC[C@H]2OC)ncc1[B-](F)(F)F 2230458493 OHHOXAIJJDMJFK-VXNVDRBHSA-N 307.126 2.057 70 10 DEIE C[C@@H](COC1(c2ccccc2)COC1)CS(=O)(=O)Cl 2272884715 NBHQPSGKPYFNLM-NSHDSACASA-N 304.795 2.133 70 10 DEIE COC[C@@H](COc1nc2ccc([B-](F)(F)F)cc2s1)OC 2296510248 NKKFAZWMNDSHMU-VIFPVBQESA-N 320.121 2.391 70 10 DEIE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1C[C@@H]2S(=O)(=O)Cl 2297105132 LEAUSPPAVUOGTK-XKNYDFJKSA-N 309.815 2.247 70 10 DEIE CS[C@H]1C[C@@H](CN(C)c2nc(C)ncc2[B-](F)(F)F)C1 2335755256 ROXHMONAPPDKBA-AOOOYVTPSA-N 304.170 2.417 70 10 DEIE C[C@]1(C(=O)O)CC[C@H]1C(=O)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2359873282 KZCPEXMTZFWCQV-FIDNZITISA-N 304.097 2.327 70 10 DEIE CCCOc1ccc([C@H]2NN=C3CCN(C)C[C@H]32)cc1OC 217122653 HUKSAUBFGFNFEU-CXAGYDPISA-N 303.406 2.436 70 10 DEIE Cc1nc(C)c([B-](F)(F)F)c(OC[C@@H]2CCC[C@H](C)O2)n1 2364005722 XQQSGTXRHQSQKQ-KWQFWETISA-N 303.113 2.484 70 10 DEIE COc1ccc([B-](F)(F)F)cc1OCOC1CCOCC1 700797786 BNVBTWPNKVEXMW-UHFFFAOYSA-N 305.081 2.282 70 10 DEIE Cc1ncc([B-](F)(F)F)c(N(C)CC2CCSCC2)n1 2116137404 XVFBHTMXDOXXEA-UHFFFAOYSA-N 304.170 2.419 70 10 DEIE O=S(=O)(Cl)C[C@H](COCCOCCC1CC1)C1CC1 2127775864 NDSLVAVBFOYESR-ZDUSSCGKSA-N 310.843 2.415 70 10 DEIE COC[C@H](C)CCn1cc(S(=O)(=O)Cl)nc1C1CC1 2130981030 DBMZAWCGCTTWOO-SECBINFHSA-N 306.815 2.361 70 10 DEIE CCNCc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2C)cc1Cl 218765065 ZQXDDFSBTPNYLS-NOZJJQNGSA-N 302.827 2.136 70 10 DEIE Cc1cc(S(=O)(=O)Cl)c(C)c(C)c1OCC(=O)N(C)C 215650893 DAWCRVBOARFXHI-UHFFFAOYSA-N 319.810 2.006 70 10 DEIE COc1ccc(S(=O)(=O)Cl)cc1C(=O)N1CCC[C@H]1C 115794332 LMOXPNAGHHQOAS-SECBINFHSA-N 317.794 2.247 70 10 DEIE CC[C@@H](C)N(C)C(=O)c1n[nH]c(C(C)C)c1S(=O)(=O)Cl 115790896 UMIIFWWAIFIGCE-MRVPVSSYSA-N 321.830 2.331 70 10 DEIE C[C@@H]1Cc2ccccc2N1C(=O)CCCS(=O)(=O)Cl 103973886 ADYKIUKCKJOWFZ-SNVBAGLBSA-N 301.795 2.313 70 10 DEIE CSCCOc1ccc(S(=O)(=O)Cl)cc1C(=O)O 135259499 QGVMCOJOXSHHFN-UHFFFAOYSA-N 310.780 2.054 70 10 DEIE CCCN(CC(=O)NC)C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F 161388925 QHVXKRQELWUBPP-DGCLKSJQSA-N 310.344 2.053 70 10 DEIE CNC(=O)c1cccc(CCC(=O)N2C[C@@H](C)OC(C)(C)C2)c1 161471328 MUZPPKPVGAJHDS-CYBMUJFWSA-N 318.417 2.005 70 10 DEIE C[C@@H]1C[C@H]1CNS(=O)(=O)c1cc(CNC2CC2)ccc1F 160770661 GAOXBBNWDKZRQT-PWSUYJOCSA-N 312.410 2.012 70 10 DEIE CC(C)[C@H](O)CNC(=O)COc1ccc(Cl)c2cccnc12 159696378 QEVDXRZOOUAOGH-CYBMUJFWSA-N 322.792 2.400 70 10 DEIE CN(Cc1cnc2ccccn12)[C@@H]1CCCN(c2cccnn2)C1 159890638 WAHZABDEPXXIGI-OAHLLOKOSA-N 322.416 2.225 70 10 DEIE CCN(CC)[C@H](C)CNC(=O)NC[C@H](C)c1c(C)noc1C 159599521 QORPVTVMFQUBJN-NWDGAFQWSA-N 310.442 2.424 70 10 DEIE CCCCOCCOC[C@H](O)CN[C@@H](C)CCSCC 160094967 OKMABQRNGSBYAV-LSDHHAIUSA-N 307.500 2.302 70 10 DEIE 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2198003265 KADVPLOPKMOPLK-ZDUSSCGKSA-N 321.870 2.226 70 10 DEIE O=C(Cc1ccc(S(=O)(=O)Cl)s1)NC1[C@H]2CCC[C@H]12 2093776010 PTMZFCNENITLHP-IUCAKERBSA-N 319.835 2.133 70 10 DEIE COCC1(Cn2cc(S(=O)(=O)Cl)nc2C)CCCC1 2094229427 SELLACFJFGYEPN-UHFFFAOYSA-N 306.815 2.326 70 10 DEIE CCn1nc(C)c(COS(=O)(=O)C(F)(F)F)c1Cl 2241464300 HKDZOFHLHIEHII-UHFFFAOYSA-N 306.693 2.231 70 10 DEIE CCc1nc(S(=O)(=O)Cl)cn1C[C@H]1C[C@@]1(C)COC 2269241055 HMEBBWDRSOOHMB-SKDRFNHKSA-N 306.815 2.046 70 10 DEIE Cc1nn(C[C@@]23C[C@@H](CO2)C3(C)C)c(C)c1S(=O)(=O)Cl 2288956965 NWYHUBKQTSANFK-GXFFZTMASA-N 318.826 2.243 70 10 DEIE O=S(=O)(Cl)CCCCCCCOC[C@H]1[C@@H]2COC[C@H]12 2341850949 KJBKKHLHAXVSMS-XYYAHUGASA-N 310.843 2.415 70 10 DEIE CO[C@]1(C(F)F)C[C@H](COCCCCS(=O)(=O)Cl)C1 2343066465 HQMHKVVDUCJPDV-JGZJWPJOSA-N 320.785 2.412 70 10 DEIE O=C(OCC1=CCCOC1)c1csc(S(=O)(=O)Cl)c1 2352514795 UWMOUGPRZQBQSU-UHFFFAOYSA-N 322.791 2.179 70 10 DEIE COC[C@H](C)OC[C@H](CS(=O)(=O)Cl)c1ccccc1 114775630 JQQGLPGWSZUGTP-WCQYABFASA-N 306.811 2.390 70 10 DEIE COc1ccc([B-](F)(F)F)c(OC[C@]2(C)CCCN2C)n1 2362052450 HSWWFBYHPWPICG-ZDUSSCGKSA-N 303.113 2.008 70 10 DEIE CC[C@H](CCCN1C[C@H]2COC[C@@H](C2)C1)S(=O)(=O)Cl 2132487655 WOWDWGKEWXVTPG-RWMBFGLXSA-N 309.859 2.082 70 10 DEIE O=C(NCc1ccc2c(c1)OCO2)Nc1cc(O)cc(O)c1 217312019 QFDQOCWQOLCXLC-UHFFFAOYSA-N 302.286 2.148 70 10 DEIE CC=CCOC(=O)Cc1cc(S(=O)(=O)Cl)ccc1OC 2363808950 AKEZMPSTQGUNPN-UHFFFAOYSA-N 318.778 2.285 70 10 DEIE O=S(=O)(Cl)c1cnn(C[C@@H]2CC3(CCCCC3)O2)c1 2133029017 DGIPKVFEONJJFM-JTQLQIEISA-N 304.799 2.302 70 10 DEIE CC(C)(C)OC(=O)N[C@@H]1CN(C[B-](F)(F)F)[C@@]2(CCOC2)C1 1955895182 DGRXJKGWBRZADQ-GWCFXTLKSA-N 323.144 2.131 70 10 DEIE Cc1cc(OC[C@H]2CCCS2(=O)=O)c(C)c([B-](F)(F)F)c1 686557899 HTLIMVAVGGTBAX-LLVKDONJSA-N 321.149 2.314 70 10 DEIE O=C(NCc1ccc(S(=O)(=O)Cl)cc1)[C@]12CCC[C@H]1C2 710327381 UGUQYZXEQQWDCD-FZMZJTMJSA-N 313.806 2.421 70 10 DEIE C[C@H]1CO[C@@H](C(=O)Nc2ccc(S(=O)(=O)Cl)cc2F)C1 718514938 DGQQWDFMIICPSF-RDDDGLTNSA-N 321.757 2.117 70 10 DEIE CC(C)(C)[C@@H]1C[C@H]1CNC(=O)c1cc(S(=O)(=O)Cl)c[nH]1 699889489 WNQPFIWPUFWIHD-WCBMZHEXSA-N 318.826 2.354 70 10 DEIE Cc1cc(S(=O)(=O)F)ccc1C(=O)OC[C@@H]1CCCCO1 1348923869 PIUSGOXEPYVMPH-NSHDSACASA-N 316.350 2.379 70 10 DEIE Cc1cc(S(=O)(=O)F)ccc1C(=O)NCCc1ccncc1 1355162838 BCKJEESWLODJTC-UHFFFAOYSA-N 322.361 2.021 70 10 DEIE CC[C@@H]1N[C@H](CC(C)C)N(CCCCOCCOC)C1=O 160476934 VPVHGGIQJRYEER-GJZGRUSLSA-N 300.443 2.012 70 10 DEIE O=S(=O)(Cl)CCCN1CCC[C@@H]([C@H]2CCCCO2)C1 2115146758 SUUBUGBMXYFKRB-CHWSQXEVSA-N 309.859 2.226 70 10 DEIE CN(Cc1cc(Cl)cn1C)c1ncncc1[B-](F)(F)F 2116148576 RSVBWZLCVBYXHI-UHFFFAOYSA-N 303.504 2.159 70 10 DEIE C[C@H]1CN(c2ncc(Cl)cc2[B-](F)(F)F)C[C@@H](C)N1C 2116157121 BKLOBDCXWIITTC-DTORHVGOSA-N 306.548 2.318 70 10 DEIE CN(Cc1ncc(Cl)n1C)c1ccncc1[B-](F)(F)F 2116137754 CJXTXIQIPABCGR-UHFFFAOYSA-N 303.504 2.159 70 10 DEIE CC(C)c1nnc(NC(=O)CI)s1 5761692 NVXUZQNVNCLTNU-UHFFFAOYSA-N 311.148 2.035 70 10 DEIE CCN(C)C(=O)Cn1cc(S(=O)(=O)Cl)c2ccccc21 215902286 WDJVTEVYYJUVDV-UHFFFAOYSA-N 314.794 2.047 70 10 DEIE Cc1ncc(CNS(=O)(=O)Cc2c(F)cccc2F)s1 161169685 FMNYUJQNEXYPBQ-UHFFFAOYSA-N 318.370 2.349 70 10 DEIE COc1cc(/C=C/C(=O)N2CCOC[C@@H]2C2CC2)ccc1F 161335240 MYSWLCVEAIIRCN-NKPGBKMFSA-N 305.349 2.485 70 10 DEIE Cc1nc(NC(=O)CCNC(=O)CC(C)C)cc(C2CC2)n1 160192917 KFTKRGIMQKXJHA-UHFFFAOYSA-N 304.394 2.153 70 10 DEIE COCCOCCCCN1C[C@H](C(C)C)NC[C@@H]1C(C)C 160195996 ZDVPSKINWQGRKC-IAGOWNOFSA-N 300.487 2.384 70 10 DEIE CNC(=O)c1ccc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)nn1 160659187 ISJIGLQRRUDAKU-UKRRQHHQSA-N 312.373 2.168 70 10 DEIE COc1ccnc(CN2CCOC[C@@H]2C[C@H](O)c2ccco2)c1 159623182 JNFZGHNRSQFTOI-HOCLYGCPSA-N 318.373 2.008 70 10 DEIE C[C@H]1C[C@H]1CNC(=O)c1ccc(S(=O)(=O)Cl)cc1F 159275999 PWBRHCKUZWSPRQ-YUMQZZPRSA-N 305.758 2.139 70 10 DEIE CO[C@H]1CNC[C@H]1n1cncc1-c1cccc(Br)c1 159508331 ZPHRJFRMZYZMRL-KGLIPLIRSA-N 322.206 2.472 70 10 DEIE CCCc1c(C(=O)N2C[C@@H]3CCC[C@H](C2)N3)[nH]c(C)c1C(C)=O 159743718 BHWAQACMAVSOMW-OKILXGFUSA-N 317.433 2.445 70 10 DEIE COc1ccc(Cl)cc1CNC(=O)C1(O)CCSCC1 159781100 WUMZTPAXUQVIIV-UHFFFAOYSA-N 315.822 2.223 70 10 DEIE C[C@@H]1CC[C@H](NC(=O)c2cc(S(=O)(=O)Cl)c[nH]2)C[C@H]1C 251634321 DWUHWPHQOXJUSG-BBBLOLIVSA-N 318.826 2.497 70 10 DEIE O=C(CC1CC2(CCC2)C1)N1CCC[C@H](S(=O)(=O)F)C1 1968234388 BEUJUOZRGMSEET-LBPRGKRZSA-N 303.399 2.247 70 10 DEIE O=C(c1cc2c(s1)CCC2)N1CCC(S(=O)(=O)F)CC1 2144732807 JPBZOLDTABJALY-UHFFFAOYSA-N 317.407 2.141 70 10 DEIE C[C@@H]1CC[C@@H]1NC(=O)c1cc(S(=O)(=O)Cl)cc(F)c1F 312427761 HXUAJDAVUPVZLR-LDWIPMOCSA-N 323.748 2.421 70 10 DEIE O=[N+]([O-])c1cc(F)c(S(=O)(=O)Cl)cc1OC(F)F 2055147370 WLIUJRNRZDQMTR-UHFFFAOYSA-N 305.617 2.263 70 10 DEIE CN1CC[C@@]2(CCN(c3ncc([B-](F)(F)F)cc3Cl)C2)C1 2172796738 VWKVEWKVZOHJDG-CYBMUJFWSA-N 318.559 2.321 70 10 DEIE COC1(C)CCN(c2nc(C)nc(C)c2[B-](F)(F)F)CC1 2172764511 DTCZGCUZFCFLCN-UHFFFAOYSA-N 302.129 2.153 70 10 DEIE Fc1ccc(OCCCO[C@@H]2CCOC2)cc1[B-](F)(F)F 2172869293 OBYFNJCPTCAHBE-LLVKDONJSA-N 307.072 2.455 70 10 DEIE 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FBWXTLVVNGYDMM-UHFFFAOYSA-N 317.389 2.035 70 10 DEIE CC[C@H]1CCN([C@@H](C)C(=O)Nc2ccc(C(N)=S)cc2)C1 159907114 RYXFKYZZLHOGGT-RYUDHWBXSA-N 305.447 2.380 70 10 DEIE CNCc1ccc(S(=O)(=O)N(C)C[C@@H]2C[C@@H]2C)cc1Cl 218769564 OQOICRJXLUEHII-JQWIXIFHSA-N 316.854 2.336 70 10 DEIE C[C@@H](c1cccc(B2OC(C)(C)C(C)(C)O2)c1)S(=O)(=O)F 1952123394 WHXJOETVLOBLEH-JTQLQIEISA-N 314.187 2.346 70 10 DEIE CCC[C@@H](C)CN(C)C(=O)c1cc(S(=O)(=O)Cl)cn1C 2152821684 HXAZCMKMZJVQOE-SNVBAGLBSA-N 320.842 2.461 70 10 DEIE CC[C@H](CCCN1C[C@@H]2CC[C@@H](OC)[C@H]2C1)S(=O)(=O)Cl 2155493944 CCOLFPKCFFLLQD-RFQIPJPRSA-N 323.886 2.471 70 10 DEIE COc1ccc(S(=O)(=O)Cl)cc1NC(=O)C1[C@H](C)[C@H]1C 2161569032 GBVFTUUXGZUVQA-HTQZYQBOSA-N 317.794 2.463 70 10 DEIE COc1nc(N2CC(C)(C)C(F)(F)C2)ncc1[B-](F)(F)F 2172757842 HNNOQSLALOWELD-UHFFFAOYSA-N 310.055 2.021 70 10 DEIE COc1nc(N(C)[C@@H]2CCCSCC2)ncc1[B-](F)(F)F 2172765306 PDLZRDDOUOSGGF-SECBINFHSA-N 320.169 2.262 70 10 DEIE Cc1ccc(C(=O)N[C@H]2C[C@H](CF)C2)cc1S(=O)(=O)Cl 2162897314 GIZOCBIHIZMIGM-HOMQSWHASA-N 319.785 2.400 70 10 DEIE CC1(C)[C@@H]2CN(C(=O)c3csc(S(=O)(=O)Cl)c3)C[C@H]21 380665336 BZLIYJWUZKUBPA-RKDXNWHRSA-N 319.835 2.404 70 10 DEIE COc1ccc(S(=O)(=O)Cl)c([N+](=O)[O-])c1C(F)F 2055339697 MMWPMOMPRFZVBS-UHFFFAOYSA-N 301.654 2.469 70 10 DEIE COc1ccc(S(=O)(=O)Cl)cc1C(=O)NCCCCF 383726891 HRCYQBFPTBVJTD-UHFFFAOYSA-N 323.773 2.102 70 10 DEIE O=S(=O)(Cl)c1cn(C[C@@H]2C[C@H]3CCCC[C@@H]3O2)cn1 393276367 COJLNHLQFGRGCI-VWYCJHECSA-N 304.799 2.158 70 10 DEIE CC[C@H](CCCN1CC(n2cc(C)cn2)C1)S(=O)(=O)Cl 2170286010 KCARXGJVMSFRCH-CYBMUJFWSA-N 319.858 2.176 70 10 DEIE Cc1cc(OC[C@@H]2COC(C)(C)CO2)ncc1[B-](F)(F)F 2179846717 LOXYLVGUUPGGIZ-SNVBAGLBSA-N 304.097 2.017 70 10 DEIE N#CC1(CS(=O)(=O)N2CC[C@H]3C[C@]3([B-](F)(F)F)C2)CCC1 2194187026 KCIRTIMINTZELP-JQWIXIFHSA-N 321.153 2.323 70 10 DEIE C#CCCCCOc1ccc(S(=O)(=O)F)cc1C(=O)O 2191421498 JJNJWKBNACFJHD-UHFFFAOYSA-N 300.307 2.225 70 10 DEIE C[C@@H]1C[C@H]1CNC(=O)c1csc(S(=O)(=O)Cl)c1F 2055649627 CNCUSNXXJKFYBH-RITPCOANSA-N 311.787 2.201 70 10 DEIE O=S(=O)(Cl)c1cn(CC23CCC(CC2)O3)c(C2CC2)n1 2192020970 ZQJFHGMXULSLGF-UHFFFAOYSA-N 316.810 2.400 70 10 DEIE C[C@H]1CC[C@@H](Cn2cc(S(=O)(=O)Cl)c([N+](=O)[O-])n2)C1 2101683287 CUTAXLJLRUUOAT-JGVFFNPUSA-N 307.759 2.155 70 10 DEIE CCC(C)(CC)CNC(=O)c1cc(S(=O)(=O)Cl)c[nH]1 2088736597 HNUVLKONCSGNGG-UHFFFAOYSA-N 306.815 2.498 70 10 DEIE CCn1c([C@@]2(C)CCCC2(F)F)nnc1S(=O)(=O)Cl 2111648847 XPZSEFPFXHDQCU-SECBINFHSA-N 313.757 2.302 70 10 DEIE C[C@@H](CCCN(C)C[C@H]1OCCC1(C)C)S(=O)(=O)Cl 2099268226 ZJEFZFWAUBTHLS-NWDGAFQWSA-N 311.875 2.471 70 10 DEIE CC1(C)OCCO[C@H]1COCc1cccc([B-](F)(F)F)c1 2200771105 HSJXDGYKUIGOCE-ZDUSSCGKSA-N 303.109 2.452 70 10 DEIE COC[C@](C)(COCc1cc(F)ccc1[B-](F)(F)F)OC 2206323613 XNFDZUPHGARTIN-CYBMUJFWSA-N 309.088 2.448 70 10 DEIE Cc1ccc([B-](F)(F)F)c(N(C)CC2(F)CCOCC2)n1 2238282140 NEIZAZDMQFZRID-UHFFFAOYSA-N 305.104 2.399 70 10 DEIE O=C(OCCOC(F)F)c1cccc(S(=O)(=O)Cl)c1 2265063115 FHZHHMKDABNUPV-UHFFFAOYSA-N 314.693 2.010 70 10 DEIE Cc1ncc([B-](F)(F)F)cc1OC[C@H]1COCCC1(F)F 2280027383 KZLNOSHGBGPFLD-SECBINFHSA-N 310.051 2.495 70 10 DEIE CC[C@@H]1CCN(c2nc(OC)ccc2[B-](F)(F)F)CCO1 2280490419 IUZOMNRORQGSCZ-SNVBAGLBSA-N 303.113 2.150 70 10 DEIE Cc1nc(N2CCO[C@H](P(C)(C)=O)C2)ccc1[B-](F)(F)F 2289209540 VFJWURDQABWSAZ-GFCCVEGCSA-N 321.068 2.230 70 10 DEIE CC(C)C[C@@H](COC[C@@H]1[C@H]2COC[C@H]21)CS(=O)(=O)Cl 2353826803 WNVDNJUVRWARKP-ZDEQEGDKSA-N 310.843 2.126 70 10 DEIE Cc1cc(C(=O)N(C)C2CC2)cc(S(=O)(=O)Cl)c1F 115018707 ZMEYWPNUZJECHR-UHFFFAOYSA-N 305.758 2.296 70 10 DEIE C[C@H]1CN([C@H](C)C(=O)Nc2ccc(Cl)c(N)c2)CCCO1 217482602 XHEWJWUHTVCIJP-WDEREUQCSA-N 311.813 2.360 70 10 DEIE Cc1cccc([N+](=O)[O-])c1OC[C@@H](C)CS(=O)(=O)Cl 122514017 ZCLVISLHZNXCMP-MRVPVSSYSA-N 307.755 2.487 70 10 DEIE COc1ccc([C@H](O)CNC(=O)CCC(F)(F)F)cc1OC 217358998 IEAWHKKUCOVLRG-SNVBAGLBSA-N 321.295 2.196 70 10 DEIE Cc1nccn1CCOc1ccc(S(=O)(=O)Cl)cc1 215989862 HZRCILCIEHPCOX-UHFFFAOYSA-N 300.767 2.198 70 10 DEIE COC(=O)C(C)(C)NC1CCC(NC(=O)OC(C)(C)C)CC1 218098355 LRLVAEJGNTYQAN-UHFFFAOYSA-N 314.426 2.364 70 10 DEIE CC(=O)NCCc1cccc2ccc(S(=O)(=O)Cl)cc12 145598135 VLKVMCHCWPQQBQ-UHFFFAOYSA-N 311.790 2.446 70 10 DEIE Cc1nc(COc2cc(C)c(S(=O)(=O)Cl)cc2C)n[nH]1 380988259 AUIVVGTWWOYPHH-UHFFFAOYSA-N 315.782 2.236 70 10 DEIE COCCN(Cc1ccccc1)c1ncnc(C)c1[B-](F)(F)F 1961710525 QWUNQKGGDVIJBE-UHFFFAOYSA-N 324.135 2.492 70 10 DEIE C[C@@H]1CCCCN(C(=O)c2cc(S(=O)(=O)Cl)c[nH]2)C1 703255464 OCCFDJXABFGKMX-SECBINFHSA-N 304.799 2.204 70 10 DEIE Cc1cc(C(=O)Nc2ccc(S(=O)(=O)Cl)cc2F)n[nH]1 716689268 LZINKLUJJBYBBH-UHFFFAOYSA-N 317.729 2.037 70 10 DEIE CN(Cc1cnn(C)c1Cl)c1ccc([B-](F)(F)F)cn1 2116138946 SQYVVTNVCQVVLP-UHFFFAOYSA-N 303.504 2.159 70 10 DEIE CCCCOCc1nnc(S(=O)(=O)Cl)n1CC(C)C 2118349366 POVJYMWFOBRUFE-UHFFFAOYSA-N 309.819 2.178 70 10 DEIE Cc1c(S(=O)(=O)Cl)c([N+](=O)[O-])nn1[C@H]1CCC[C@@H]1C 2118897530 UHFKLRVBSNLTGW-XPUUQOCRSA-N 307.759 2.388 70 10 DEIE C[C@H]1CCC[C@H](CC(=O)NC2CCC(C(=O)NC(N)=O)CC2)C1 160869329 IZUDECSMKYWDPD-FEPKRQSRSA-N 323.437 2.073 70 10 DEIE CN(Cc1ccc(Cl)cc1)C(=O)N[C@@H]1CCc2ncnn2C1 160991356 BPIVTMGSXSWRKK-CYBMUJFWSA-N 319.796 2.088 70 10 DEIE CCCC(=O)NCC(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 159404199 YHTYXGLTUNZUHZ-ZBFHGGJFSA-N 318.417 2.187 70 10 DEIE CCO[C@H](C)c1noc(CSC[C@@H](C)CS(C)(=O)=O)n1 159806193 NXLYJSUGODFMTF-NXEZZACHSA-N 322.452 2.081 70 10 DEIE CCc1ccc(CC)c(NC(=O)C(=O)N[C@@H]2CCC[C@H]2OC)c1 159855495 GFDZDOGHCGFRNB-GDBMZVCRSA-N 318.417 2.434 70 10 DEIE Cc1cc(S(=O)(=O)Cl)ccc1C(=O)N[C@@H]1[C@H]2CCC[C@H]21 2150178396 GGOIMRZGABLPSZ-ITGUQSILSA-N 313.806 2.451 70 10 DEIE Cc1ccnc(-c2nnc(S(=O)(=O)Cl)n2C(C)C)c1C 2145137948 YGWZARSAHVOSRB-UHFFFAOYSA-N 314.798 2.465 70 10 DEIE CC[C@@H](Nc1cc(NS(C)(=O)=O)ccc1Cl)C(=O)OC 159507408 GDRGFSNMSWNNOG-SNVBAGLBSA-N 320.798 2.075 70 10 DEIE Nc1cc(Br)ccc1N1CC[C@@H]2NC(=O)CC[C@@H]2C1 160069166 BJLFBRSGLRDWTQ-SKDRFNHKSA-N 324.222 2.136 70 10 DEIE C[C@H]1CCOC[C@@H]1OC(=O)c1cccc(S(=O)(=O)Cl)c1 2152519207 VCUHIKKDGBIWIP-CABZTGNLSA-N 318.778 2.196 70 10 DEIE CCOCCOC(=O)c1cc(S(=O)(=O)Cl)sc1C 2034526426 AAMDATBMWKNNNT-UHFFFAOYSA-N 312.796 2.177 70 10 DEIE O=S(=O)(Cl)c1ccc(OCCCO[C@@H]2CCOC2)cc1 699942678 YQHATMASVNMPJD-GFCCVEGCSA-N 320.794 2.189 70 10 DEIE C[C@@H]1CC[C@H]1NC(=O)CCc1ccc(S(=O)(=O)Cl)cc1 380565424 GZMRPIQUAIDWGQ-ZWNOBZJWSA-N 315.822 2.461 70 10 DEIE COc1cc(C=O)c(OC(F)(F)F)cc1S(=O)(=O)Cl 2055376911 RDTFLRQOPLVOFM-UHFFFAOYSA-N 318.656 2.334 70 10 DEIE Cc1nc(N2C[C@@H](C(F)(F)F)[C@@H](C)C2)ncc1[B-](F)(F)F 2172767910 ABQVCJLODADOEN-POYBYMJQSA-N 312.046 2.474 70 10 DEIE CCN1CCC(N(C)c2ncc([B-](F)(F)F)cc2F)CC1 2172797769 KPXSSRSPKIYMGM-UHFFFAOYSA-N 304.120 2.196 70 10 DEIE CO[C@H]1CN(c2ncc(F)cc2[B-](F)(F)F)CC(F)(F)C1 2188592687 VDQNXEVVQHYRRX-MRVPVSSYSA-N 313.030 2.136 70 10 DEIE CCc1nc(S(=O)(=O)Cl)cn1CCCN(C)C1CCC1 2193700080 PHEPFKQEJSTEIN-UHFFFAOYSA-N 319.858 2.247 70 10 DEIE Cc1nc(C)c([B-](F)(F)F)c(N2CCSSCC2)n1 2052604637 UUBLUIZLIOGXLS-UHFFFAOYSA-N 308.183 2.349 70 10 DEIE C#CCCCCOc1ccc(C(=O)O)cc1S(=O)(=O)F 2191426496 QBEJVRCKPUDCPX-UHFFFAOYSA-N 300.307 2.225 70 10 DEIE CCC[C@H]1C[C@H]1CNC(=O)c1cc(S(=O)(=O)Cl)cn1C 2200116713 ZZEMZHHTYUVGQU-UWVGGRQHSA-N 318.826 2.119 70 10 DEIE O=C(NCCCC(F)F)c1ccc(S(=O)(=O)Cl)cc1 2089982632 VJBIREGUFXQUGS-UHFFFAOYSA-N 311.737 2.389 70 10 DEIE Cc1cc(N(C)CC2(F)CCOCC2)ncc1[B-](F)(F)F 2238281984 LTSGSWBNHQGGLM-UHFFFAOYSA-N 305.104 2.399 70 10 DEIE CC[C@@H](COC)Oc1ccc([N+](=O)[O-])cc1S(=O)(=O)Cl 2239949054 CDDCWVIKWPTJPD-VIFPVBQESA-N 323.754 2.326 70 10 DEIE CCC1(Oc2ncc([B-](F)(F)F)cc2Br)COC1 2250815474 OBNPQYGOQPMCNP-UHFFFAOYSA-N 324.913 2.456 70 10 DEIE COc1ccc([B-](F)(F)F)c(N2C[C@@H](C)S[C@H](C)C2)n1 2265935681 CPXIURMYMOCRGB-RKDXNWHRSA-N 305.154 2.475 70 10 DEIE COC[C@](C)(COCc1ccc([B-](F)(F)F)cc1F)OC 2281313324 GYVYNKCKFYUCEW-CYBMUJFWSA-N 309.088 2.448 70 10 DEIE CC(C)=C(CN(C)CC(C)(C)S(C)(=O)=O)[B-](F)(F)F 2317838921 KACKTTLVXSXUOD-UHFFFAOYSA-N 300.175 2.464 70 10 DEIE COc1c(Br)cc(S(=O)(=O)Cl)cc1C=O 2054949930 ZDHLDYVWVYZTFO-UHFFFAOYSA-N 313.556 2.198 70 10 DEIE CCOC(=O)[C@@H]1CCOc2ccc(S(=O)(=O)Cl)cc21 115021099 UNGJVTXYCXZLJK-SECBINFHSA-N 304.751 2.043 70 10 DEIE C[C@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1S(=O)(=O)F 1954485825 PALKIZBXXCEREH-UPJWGTAASA-N 300.399 2.184 70 10 DEIE CCN1[C@H]2CC[C@H]1CN(c1ncc(Cl)cc1[B-](F)(F)F)C2 2360651319 PIECFJCGSRZLAF-QWRGUYRKSA-N 318.559 2.462 70 10 DEIE CN1CC(CN(C)c2nc3ccc([B-](F)(F)F)cc3s2)C1 2360265984 LGOAIRJUWSHMTM-UHFFFAOYSA-N 314.165 2.349 70 10 DEIE O=[N+]([O-])c1cccc(F)c1OCCCCS(=O)(=O)Cl 124442870 MXESHBVEJPKKJF-UHFFFAOYSA-N 311.718 2.462 70 10 DEIE CC(C)(C)OC(=O)N1CCC(NC(=O)NC(F)(F)F)CC1 217267263 RLEHXUGTMRTSFL-UHFFFAOYSA-N 311.304 2.205 70 10 DEIE N#Cc1ccc(S(=O)(=O)Cl)c2nc(Br)[nH]c12 396122773 XNIROOVYUGJREL-UHFFFAOYSA-N 320.555 2.125 70 10 DEIE Cc1noc(COc2ccc(S(=O)(=O)F)cc2Cl)n1 1875882104 SVFHRMZVHBKTEZ-UHFFFAOYSA-N 306.702 2.269 70 10 DEIE COc1ccc(Br)c(S(=O)(=O)Cl)c1OC 958678371 RLBHJYGTKQTCNZ-UHFFFAOYSA-N 315.572 2.394 70 10 DEIE CCN1CC[C@@H](N(C)c2ncc(Cl)cc2[B-](F)(F)F)C1 2116160868 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307.611 2.444 70 10 DEIE C[C@H](N)Cc1c(-n2cnc3c2CCCC3)nc2sccn12 216797787 UEEHIVZPWZGFTM-JTQLQIEISA-N 301.419 2.350 70 10 DEIE COc1nc2sccn2c1CN[C@H]1CCN2CCCC[C@@H]12 218122364 MRRDVMBPGGTHOU-RYUDHWBXSA-N 306.435 2.121 70 10 DEIE CC(C)(C)[C@H]1CC[C@H]1C(=O)N1CCC(S(=O)(=O)F)CC1 2369225046 CRAGUGDUPJGSAJ-NEPJUHHUSA-N 305.415 2.349 70 10 DEIE CC(C)(C)[C@H]1CC[C@H]1C(=O)N1CC(CCS(=O)(=O)F)C1 2369226463 USBSPDYCVABJMN-NEPJUHHUSA-N 305.415 2.207 70 10 DEIE CCCn1cc(S(=O)(=O)N2CC[C@H]([B-](F)(F)F)C2)nc1C 2368423990 UHSMHVFMCHJWIN-JTQLQIEISA-N 324.157 2.214 70 10 DEIE O=S(=O)(Cl)c1cc(C(F)F)nc(Br)c1O 238711838 APSROTSCLRWOGE-UHFFFAOYSA-N 322.514 2.415 70 10 DEIE O=S(=O)(Cl)c1ccc(OCc2cn[nH]c2)c(F)c1F 394090765 RAXMWYTZLJNQBK-UHFFFAOYSA-N 308.693 2.194 70 10 DEIE FC(F)CN(c1ncc([B-](F)(F)F)cc1Cl)C1COC1 1886841246 NOGPFGBGVOJALX-UHFFFAOYSA-N 315.458 2.260 70 10 DEIE Cc1ccc([B-](F)(F)F)c(OCC[C@@H]2CCS(=O)(=O)C2)c1 694118967 MRLPYMOJWJIUBX-LLVKDONJSA-N 321.149 2.253 70 10 DEIE 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