smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features FC(F)C(F)(F)OCCC[SiH2]C(Cl)Cl 263590089 XGVDMGOCVWAONZ-UHFFFAOYSA-N 273.129 2.599 70 30 CFIC CC(C)(C)OC(=O)N1CC[C@H](CCN)C(F)(F)CC1 218758499 VBRJQCZFZUBNDZ-JTQLQIEISA-N 278.343 2.618 70 30 CFIC O=S(=O)(Cl)c1ccc(Cl)nc1C(F)(F)F 224098862 KKOPTKHWEDAPDP-UHFFFAOYSA-N 280.054 2.681 70 30 CFIC Cc1cc(C(F)(F)F)ccc1S(=O)(=O)Cl 228808528 KEMXARIURFTNQW-UHFFFAOYSA-N 258.648 2.941 70 30 CFIC in-vitro COc1cc2ccc(Cl)nc2cc1S(=O)(=O)Cl 100586526 UIIVYMOPZHLHJH-UHFFFAOYSA-N 292.143 2.824 70 30 CFIC in-vitro O=C(c1ccccc1)c1cccc(S(=O)(=O)Cl)c1 100868706 HUQKJUIDRNDNQY-UHFFFAOYSA-N 280.732 2.845 70 30 CFIC O=C(Cl)c1cc(Cl)cc(S(=O)(=O)Cl)c1F 146275904 NXKYWZXLLOMBIT-UHFFFAOYSA-N 291.514 2.786 70 30 CFIC COCCOCCOCCC[Si](C)(C)Cl 195751102 YQBNCFNFOQKVOO-UHFFFAOYSA-N 254.830 2.500 70 30 CFIC O=S(=O)(Cl)C1CC2(C1)CC1(CC(F)(F)C1)C2 2265384761 UQYATJBROLUTSJ-UHFFFAOYSA-N 270.728 2.913 70 30 CFIC COc1c(S(=O)(=O)Cl)ccc2ccccc12 117054947 BPDGXUXLCACGBF-UHFFFAOYSA-N 256.710 2.776 70 30 CFIC Fc1c(Br)cc2c(c1Cl)OCO2 218113314 ZCGSLXUPVVIANP-UHFFFAOYSA-N 253.454 2.970 70 30 CFIC Cc1cc(S(=O)(=O)Cl)cc(Br)c1C 100617702 SDLLLBZYQYJHMD-UHFFFAOYSA-N 283.574 2.993 70 30 CFIC O=S(=O)(Cl)C1=Cc2cc(Cl)ccc2OC1 100645351 HAOUOEPGUNIORC-UHFFFAOYSA-N 265.117 2.642 70 30 CFIC O=S(=O)(Cl)c1ccsc1C(F)(F)F 116983012 CIOIBMFZAQSHGV-UHFFFAOYSA-N 250.650 2.694 70 30 CFIC Cc1cc(S(=O)(=O)Cl)cc(C)c1Br 218958760 YPTASDADIMSQKZ-UHFFFAOYSA-N 283.574 2.993 70 30 CFIC O=S(=O)(Cl)Cc1ccc(C(F)F)cc1F 2265384653 FQMQXEWUVDOMTD-UHFFFAOYSA-N 258.648 2.832 70 30 CFIC CC(C)(COS(=O)(=O)C(F)(F)F)C1CCC1 705000126 IKAMOZKESOLQOE-UHFFFAOYSA-N 260.277 2.679 70 30 CFIC O=S(=O)(Cl)CCc1ccccc1Br 106675574 HBAWRLSTJFBDBF-UHFFFAOYSA-N 283.574 2.560 70 30 CFIC in-vitro Cc1cc(S(=O)(=O)Cl)ccc1C(F)(F)F 91301044 RPUAGOQMBBWRPE-UHFFFAOYSA-N 258.648 2.941 70 30 CFIC in-vitro CCOCCOc1ccc(Cl)cc1S(=O)(=O)Cl 88270553 UJFDEOWBQMKETE-UHFFFAOYSA-N 299.175 2.683 70 30 CFIC in-vitro COc1c(Cl)cc(Cl)cc1S(=O)(=O)Cl 105449484 RJAMONJNAIYEBI-UHFFFAOYSA-N 275.540 2.930 70 30 CFIC O=S(=O)(Cl)[C@@H]1CCC[C@H](C(F)(F)F)C1 113261807 SQPYSHIJUJDRNU-NTSWFWBYSA-N 250.669 2.676 70 30 CFIC O=S(=O)(Cl)C[C@@H]1CCCC[C@H]1C(F)(F)F 129535460 XWDHQTYXURGFHM-NKWVEPMBSA-N 264.696 2.924 70 30 CFIC O=S(=O)(Cl)c1cc2nc(Cl)ccc2s1 142185084 DDOAASFFFGZAFG-UHFFFAOYSA-N 268.146 2.877 70 30 CFIC CC1(C)CC(=O)Nc2cc(C(=O)CBr)ccc21 145119210 VOZAKXYVWXBECN-UHFFFAOYSA-N 296.164 2.884 70 30 CFIC O=S(=O)(Cl)c1c(F)ccc2cnc(Cl)cc12 714945132 IGMAHGHWXBDKKG-UHFFFAOYSA-N 280.107 2.955 70 30 CFIC COc1ccc(S(=O)(=O)Cl)c(C(F)F)c1 958678154 DKJAAYPGOPBBKC-UHFFFAOYSA-N 256.657 2.560 70 30 CFIC O=S(=O)(OB1[C@H]2CCC[C@@H]1CCC2)C(F)(F)F 2265358125 NXHUKDCGEGEZCX-OCAPTIKFSA-N 270.081 2.952 70 30 CFIC O=S(=O)(Cl)c1c(Cl)nc2cc(Cl)ccn12 105982744 YMZKANHOWICQBN-UHFFFAOYSA-N 285.539 2.569 70 30 CFIC Cc1cncc(Oc2ccc(S(=O)(=O)Cl)cc2)n1 100062602 GUJMBSPJUZJPEB-UHFFFAOYSA-N 284.724 2.505 70 30 CFIC Cc1c(Br)cccc1CS(=O)(=O)Cl 106942470 RNTNWWLEVXOQAP-UHFFFAOYSA-N 283.574 2.826 70 30 CFIC O=S(=O)(Cl)c1cncc(OCc2ccccc2)c1 103598166 UJZLFXXEIPVAIT-UHFFFAOYSA-N 283.736 2.588 70 30 CFIC O=S(=O)(Cl)c1cccc2c(Cl)ccnc12 238851099 FAHXJDSBGZMRHC-UHFFFAOYSA-N 262.117 2.816 70 30 CFIC O=S(=O)(Cl)[C@H]1CCC[C@H](C(F)(F)F)C1 113261811 SQPYSHIJUJDRNU-WDSKDSINSA-N 250.669 2.676 70 30 CFIC COc1cccc(OC(F)(F)F)c1S(=O)(=O)Cl 382635151 MTMHWORXTHEGDB-UHFFFAOYSA-N 290.646 2.521 70 30 CFIC O=S(=O)(Cl)/C=C/c1ccc(Br)cc1 100404964 QAAQAKSRVIIUEV-AATRIKPKSA-N 281.558 2.988 70 30 CFIC in-vitro O=[N+]([O-])c1cc(Cl)c(Cl)c(S(=O)(=O)Cl)c1 104698525 IDXDHRNMSXCHCW-UHFFFAOYSA-N 290.511 2.829 70 30 CFIC in-vitro O=S(=O)(Cl)c1cc(F)ccc1OC(F)(F)F 221576173 FPYDXCBBYOEDSX-UHFFFAOYSA-N 278.610 2.652 70 30 CFIC CC(C)(C)OC(=O)c1cccc(S(=O)(=O)Cl)c1 114562067 PKQUQVZTYBVWBB-UHFFFAOYSA-N 276.741 2.569 70 30 CFIC O=S(=O)(Cl)c1c(Cl)ccc2scnc12 59104274 JZAWJILQDJACID-UHFFFAOYSA-N 268.146 2.877 70 30 CFIC in-vitro Fc1cc(OCC(F)(F)F)ccc1[B-](F)(F)F 203554365 AZVCCYCJIHCJDL-UHFFFAOYSA-N 260.925 2.821 70 30 CFIC O=S(=O)(Cl)/C=C/c1ccccc1Br 59312459 NUGLZZVAFCEKFJ-AATRIKPKSA-N 281.558 2.988 70 30 CFIC in-vitro O=S(=O)(Cl)[C@@H]1C[C@H]1c1ccccc1Br 105566531 SLMQTPKUQBXQRT-IONNQARKSA-N 295.585 2.874 70 30 CFIC CCCOc1ccc(S(=O)(=O)Cl)cc1CC 584883723 XBHCCDYOSOLBQV-UHFFFAOYSA-N 262.758 2.965 70 30 CFIC O=S(=O)(Cl)c1scc(Cl)c1Cl 118342666 MYNNDEMJLPNOKP-UHFFFAOYSA-N 251.543 2.982 70 30 CFIC O=S(=O)(Cl)Cc1ccc(Br)c(F)c1 106944067 PXAGWQXJZGISKM-UHFFFAOYSA-N 287.537 2.657 70 30 CFIC O=S(=O)(Cl)c1cnc2onc(-c3ccccc3)c2c1 100459877 RMENGPPTHWFIPN-UHFFFAOYSA-N 294.719 2.817 70 30 CFIC in-vitro O=S(=O)(Cl)c1csnc1-c1ccccc1 238852632 GRJJOXYMJFRZFS-UHFFFAOYSA-N 259.739 2.738 70 30 CFIC Cn1cc(S(=O)(=O)F)c2c(Br)cccc21 2265384955 KNKIFHIUHAFMOA-UHFFFAOYSA-N 292.129 2.599 70 30 CFIC O=S(=O)(Cl)c1cccnc1Oc1ccc(F)cc1 128869912 HIODABLDHXBFIF-UHFFFAOYSA-N 287.699 2.941 70 30 CFIC O=S(=O)(Cl)c1c[nH]c2ccc(Br)cc12 675050356 CYAINRUXOJMJCE-UHFFFAOYSA-N 294.557 2.858 70 30 CFIC O=S(=O)(Oc1cccc2c1CCC=C2)C(F)(F)F 146107021 VWURLCURJYQNMC-UHFFFAOYSA-N 278.251 2.874 70 30 CFIC O=S(=O)(Cl)c1c[nH]c2cc(Cl)ccc12 104849840 LSBWUVXQQOOFSB-UHFFFAOYSA-N 250.106 2.749 70 30 CFIC O=S(=O)(Cl)c1onc(-c2ccccc2)c1Cl 103582813 RGTYWFCIDADHDK-UHFFFAOYSA-N 278.116 2.923 70 30 CFIC Cc1ccc(Br)c(CS(=O)(=O)Cl)c1 106942490 HHVFQGNQWIEXBX-UHFFFAOYSA-N 283.574 2.826 70 30 CFIC CCc1cc(S(=O)(=O)Cl)ccc1Br 230547696 VFVICIOMELGYIH-UHFFFAOYSA-N 283.574 2.939 70 30 CFIC Cc1cc(OS(=O)(=O)C(F)(F)F)c2nc(C)oc2c1 2265356016 HELLCWMAVMBZRI-UHFFFAOYSA-N 295.238 2.673 70 30 CFIC C[C@@H](Br)c1cccc(S(=O)(=O)F)c1 2265381481 MLKZGXHENZIXMX-ZCFIWIBFSA-N 267.119 2.801 70 30 CFIC CC(C)(C)C(=O)c1ccc(S(=O)(=O)Cl)cc1 100652020 GERAQQCBZHYOHY-UHFFFAOYSA-N 260.742 2.843 70 30 CFIC COC(=O)c1ccc2cc(S(=O)(=O)Cl)ccc2c1 950757332 VDXXUEUZRKLPEM-UHFFFAOYSA-N 284.720 2.554 70 30 CFIC CC(C)(C)c1noc(S(=O)(=O)Cl)c1Cl 521398904 HRXDNHGIWZADAH-UHFFFAOYSA-N 258.126 2.553 70 30 CFIC CC(C)(C)c1ccc(S(=O)(=O)Cl)cc1[N+](=O)[O-] 310261076 CPLNYNWHOTWWPP-UHFFFAOYSA-N 277.729 2.820 70 30 CFIC O=S(=O)(Cl)c1cccc(OC(F)(F)F)c1F 238851211 FTLCZHMJLDXFPD-UHFFFAOYSA-N 278.610 2.652 70 30 CFIC Cc1c(Br)ccc(S(=O)(=O)Cl)c1F 229552262 OJZBTZIUENAEOK-UHFFFAOYSA-N 287.537 2.824 70 30 CFIC O=S(=O)(Cl)c1c[nH]c2cc(Br)ccc12 675050354 CTNCVZGFIBIGAR-UHFFFAOYSA-N 294.557 2.858 70 30 CFIC [N-]=[N+]=NCCC(=O)Oc1c(F)c(F)c(F)c(F)c1F 888086762 FRSRZMNVGWVIJB-UHFFFAOYSA-N 281.140 2.988 70 30 CFIC O=S(=O)(Cl)c1ccc([C@@H]2CC2(F)F)cc1 116116891 RFLPEFSXJWXSCO-QMMMGPOBSA-N 252.669 2.737 70 30 CFIC O=S(=O)(Cl)c1cc2cc(F)ccc2s1 59059900 QVQQSTZFKKONFQ-UHFFFAOYSA-N 250.703 2.968 70 30 CFIC in-vitro CC(C)(C)c1sc(C(=O)O)cc1S(=O)(=O)Cl 100505574 IWVVYDXMOVDVSK-UHFFFAOYSA-N 282.770 2.671 70 30 CFIC CC(C)c1cc(C#N)ccc1OS(=O)(=O)C(F)(F)F 584605367 LQNAJVQZGQNCAZ-UHFFFAOYSA-N 293.266 2.910 70 30 CFIC CC1(C)CCc2cccc(S(=O)(=O)Cl)c2O1 133968029 WOYJTDZEJDPCGR-UHFFFAOYSA-N 260.742 2.718 70 30 CFIC CC1=Nc2ccc(S(=O)(=O)Cl)cc2C1(C)C 97972416 VQSNLVAYNDFHID-UHFFFAOYSA-N 257.742 2.998 70 30 CFIC Cc1cc(C(F)(F)F)cc(S(=O)(=O)Cl)c1 103600200 RQFZQUVLBVRQFA-UHFFFAOYSA-N 258.648 2.941 70 30 CFIC in-vitro CNC1([C@@H]2CCCCN2C(=O)OC(C)(C)C)CC1 218163376 AARGIXJFZYNKIA-NSHDSACASA-N 254.374 2.528 70 30 CFIC Cc1cc(C)c2cccnc2c1S(=O)(=O)Cl 118865509 XKZPOMFYOCTBGT-UHFFFAOYSA-N 255.726 2.779 70 30 CFIC O=S(=O)(Cl)c1cnn(-c2ccc(Cl)c(F)c2)c1 117840279 CWBZJDISZJSQIL-UHFFFAOYSA-N 295.122 2.592 70 30 CFIC O=S(=O)(Cl)[C@@H]1C[C@H]1c1cccc(Cl)c1 402521573 OSJUKSATPIMPLU-DTWKUNHWSA-N 251.134 2.765 70 30 CFIC O=S(=O)(Cl)[C@@H](c1ccccc1)C(F)(F)F 97976184 LXRRNCPWUOABIA-ZETCQYMHSA-N 258.648 2.859 70 30 CFIC Cc1c(Br)csc1S(=O)(=O)Cl 100450426 XUFAFAISNKTEQS-UHFFFAOYSA-N 275.576 2.747 70 30 CFIC N#Cc1sc2ccccc2c1S(=O)(=O)Cl 101464060 TWXRYVUNIDNOMJ-UHFFFAOYSA-N 257.723 2.700 70 30 CFIC O=S(=O)(Cl)c1cccc(F)c1C(F)(F)F 218480113 IBPLJUDUCKFLHS-UHFFFAOYSA-N 262.611 2.772 70 30 CFIC O=S(=O)(Cl)c1ccc([C@H]2CC2(F)F)cc1 116116888 RFLPEFSXJWXSCO-MRVPVSSYSA-N 252.669 2.737 70 30 CFIC CC(C)Oc1ccc(F)cc1S(=O)(=O)Cl 88270673 CXPQORTYFWWSDZ-UHFFFAOYSA-N 252.694 2.540 70 30 CFIC CCOc1ccc(S(=O)(=O)Cl)cc1Br 59100021 FKYSPRCRSDOCJL-UHFFFAOYSA-N 299.573 2.775 70 30 CFIC in-vitro Cc1cccc(-n2nc(C)c(S(=O)(=O)Cl)c2C)c1 59312434 VYGHDWZYVZMBAK-UHFFFAOYSA-N 284.768 2.725 70 30 CFIC CC(C)(C)[Si](C)(C)OCCS(=O)(=O)Cl 238112782 DGPPHHAYSQEJLS-UHFFFAOYSA-N 258.843 2.577 70 30 CFIC O=S(=O)(Cl)c1ccc(-c2nccs2)cc1 59222009 IRQNEXIHOIGLOJ-UHFFFAOYSA-N 259.739 2.738 70 30 CFIC O=S(=O)(Cl)Cc1ccc(C(F)(F)F)cc1F 218944026 USJYMUZABVRPLS-UHFFFAOYSA-N 276.638 2.913 70 30 CFIC COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)Cl 100492582 LILDLOWCJGUEPJ-ZETCQYMHSA-N 299.175 2.681 70 30 CFIC in-vitro Cn1cc(S(=O)(=O)F)c2ccc(Br)cc21 757128601 RBTDYRGQTMUDPR-UHFFFAOYSA-N 292.129 2.599 70 30 CFIC COc1ccc2c(c1)C=C(S(=O)(=O)Cl)CC2 97971328 CRHZCIOFWUZRAK-UHFFFAOYSA-N 258.726 2.551 70 30 CFIC in-vitro O=S(=O)(Cl)c1cnc(-c2ccccc2)s1 675049979 DEKPEEKDKYZSGI-UHFFFAOYSA-N 259.739 2.738 70 30 CFIC COC(=O)c1ccc(S(=O)(=O)Cl)c2ccccc12 669371749 XUTFARBRKTXYEO-UHFFFAOYSA-N 284.720 2.554 70 30 CFIC O=S(=O)(Cl)CCCC(F)(F)C(F)(F)F 148357376 HIBCLNVAFPUNEA-UHFFFAOYSA-N 260.611 2.533 70 30 CFIC O=C1c2ccc(S(=O)(=O)Cl)cc2CC1(Cl)Cl 238854538 OGIVTCWGYINMON-UHFFFAOYSA-N 299.562 2.527 70 30 CFIC Cc1cc(CS(=O)(=O)Cl)ccc1Br 106942478 IAGBSNVVYDJCRR-UHFFFAOYSA-N 283.574 2.826 70 30 CFIC O=S(=O)(Cl)c1c[nH]nc1-c1ccc(Cl)cc1 104719239 MHPCFVVFUPJAQD-UHFFFAOYSA-N 277.132 2.658 70 30 CFIC O=S(=O)(Cl)c1csc2ccc(F)cc12 100446661 PVCYFGHTRPTWBI-UHFFFAOYSA-N 250.703 2.968 70 30 CFIC in-vitro O=C(c1ccccc1)c1ccccc1S(=O)(=O)Cl 59200563 WHJGMXCAZTYNOL-UHFFFAOYSA-N 280.732 2.845 70 30 CFIC CCOc1ccc(S(=O)(=O)Cl)c2ncccc12 135266584 PHTVQIDPLVHETJ-UHFFFAOYSA-N 271.725 2.561 70 30 CFIC Cc1cc(OC(F)F)ccc1S(=O)(=O)Cl 106110985 PIWPGOHRXSPSCK-UHFFFAOYSA-N 256.657 2.524 70 30 CFIC O=S(=O)(Cl)Cc1cc(F)cc(Br)c1 106944069 YBZCSCNZKBZOMK-UHFFFAOYSA-N 287.537 2.657 70 30 CFIC C[C@H]1Cc2cc(S(=O)(=O)Cl)cc(Cl)c2O1 100631861 WKYMHGPTTUKYDH-YFKPBYRVSA-N 267.133 2.591 70 30 CFIC in-vitro O=S(=O)(Br)c1ccc(C(F)(F)F)cc1 301011117 GFDCWWAXVIYTSA-UHFFFAOYSA-N 289.072 2.789 70 30 CFIC O=S(=O)(Cl)Cc1cccc(Br)c1F 97950240 LBWJXCAOSSDVSN-UHFFFAOYSA-N 287.537 2.657 70 30 CFIC CNC1([C@H]2CCCCN2C(=O)OC(C)(C)C)CC1 218163319 AARGIXJFZYNKIA-LLVKDONJSA-N 254.374 2.528 70 30 CFIC CC(C)(C)OC(=O)c1csc(S(=O)(=O)Cl)c1 114562104 KBJAMRIOIWWUOQ-UHFFFAOYSA-N 282.770 2.631 70 30 CFIC O=S(=O)(Cl)c1cc(F)ccc1OCC1CC1 88270389 SQZLGUNNROQYQG-UHFFFAOYSA-N 264.705 2.542 70 30 CFIC in-vitro Nc1c(Cl)cc(S(=O)(=O)Cl)cc1Cl 100637540 GMQGRTBKYOJTMW-UHFFFAOYSA-N 260.529 2.503 70 30 CFIC O=S(=O)(Cl)[C@@H]1CCC[C@@H](C(F)(F)F)C1 113261810 SQPYSHIJUJDRNU-PHDIDXHHSA-N 250.669 2.676 70 30 CFIC O=S(=O)(Cl)c1cc(Cl)c(O)cc1Cl 127506146 LHJRLFNGLLFHQN-UHFFFAOYSA-N 261.513 2.627 70 30 CFIC Cc1nc(C(F)(F)F)c(CS(=O)(=O)Cl)s1 97971565 NLACIVCDBBHNKM-UHFFFAOYSA-N 279.692 2.539 70 30 CFIC COC(=O)c1c(S(=O)(=O)Cl)ccc2ccccc12 145628780 UVDCQQQGPORSQT-UHFFFAOYSA-N 284.720 2.554 70 30 CFIC CC(C)(C)OC(=O)Nc1cccc(S(=O)(=O)Cl)c1 100137505 GLRCOVCCHBYKRR-UHFFFAOYSA-N 291.756 2.961 70 30 CFIC COC(=O)C[SiH2]C(c1ccccc1)c1ccccc1 585138963 YSVGDOKUUBALIJ-UHFFFAOYSA-N 270.404 2.536 70 30 CFIC Nc1nc(C(F)F)c(C(=O)c2ccccc2)s1 217010865 MMQOFSLVVSIAAR-UHFFFAOYSA-N 254.261 2.894 70 30 CFIC COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)Cl 100492586 LILDLOWCJGUEPJ-SSDOTTSWSA-N 299.175 2.681 70 30 CFIC in-vitro COc1ccc2c(c1)CCC(S(=O)(=O)Cl)=C2 238854747 PBVIDHLUQCDCFF-UHFFFAOYSA-N 258.726 2.551 70 30 CFIC Cc1ccc(-n2cc(S(=O)(=O)Cl)cn2)cc1Cl 59312427 OMPAMNHFULMIQT-UHFFFAOYSA-N 291.159 2.762 70 30 CFIC Cc1cc(Br)cc(F)c1S(=O)(=O)Cl 958678373 RLTFGPOYENAQGW-UHFFFAOYSA-N 287.537 2.824 70 30 CFIC CC(C)(C)OC(=O)c1ccc(S(=O)(=O)Cl)cc1 130408234 QRVULNDDGCQPNM-UHFFFAOYSA-N 276.741 2.569 70 30 CFIC O=S(=O)(Cl)c1csc(C(F)(F)F)c1 115198429 WPNKLVLVSSHXED-UHFFFAOYSA-N 250.650 2.694 70 30 CFIC O=S(=O)(Cl)c1ccc2nc(Cl)sc2c1 100300660 RLPMZVSKBOCSMU-UHFFFAOYSA-N 268.146 2.877 70 30 CFIC COc1cc(Br)c(C)cc1S(=O)(=O)Cl 105376173 WFMITGUMKPKFSU-UHFFFAOYSA-N 299.573 2.694 70 30 CFIC CC(F)(F)c1ccc(CS(=O)(=O)Cl)cc1 258265670 BJSVMBACPVCXJK-UHFFFAOYSA-N 254.685 2.867 70 30 CFIC Cc1cc(S(=O)(=O)Cl)c2cccnc2c1C 91415475 KNHPBZRFXARWDQ-UHFFFAOYSA-N 255.726 2.779 70 30 CFIC CC(=O)c1cc(S(=O)(=O)Cl)ccc1Br 59079736 PTJDETLJONCUDL-UHFFFAOYSA-N 297.557 2.579 70 30 CFIC in-vitro C[C@H](Br)c1cccc(S(=O)(=O)F)c1 2265381480 MLKZGXHENZIXMX-LURJTMIESA-N 267.119 2.801 70 30 CFIC O=S(=O)(Cl)CCc1ccc(Br)cc1 103595367 WGUYMLVRJKFPHI-UHFFFAOYSA-N 283.574 2.560 70 30 CFIC COC(=O)c1cccc2c(S(=O)(=O)Cl)cccc12 196744452 CNFVMBKEYPEFQX-UHFFFAOYSA-N 284.720 2.554 70 30 CFIC COc1cccc(C(F)(F)F)c1S(=O)(=O)Cl 135272460 NBZJAHPYJUXLQC-UHFFFAOYSA-N 274.647 2.642 70 30 CFIC Cc1c(OC(F)(F)F)cccc1S(=O)(=O)Cl 309384628 LRKBHARPECWGNT-UHFFFAOYSA-N 274.647 2.821 70 30 CFIC O=S(=O)(Cl)[C@@H]1C[C@H]1c1cccc(Br)c1 402477197 CTZKOXRMLNWDEB-DTWKUNHWSA-N 295.585 2.874 70 30 CFIC Fc1ccc(B(c2ccc(F)cc2)c2ccc(F)cc2)cc1 195792101 YPVVTWIAXFPZLS-UHFFFAOYSA-N 296.100 2.620 70 30 CFIC Cc1cc(Br)sc1S(=O)(=O)Cl 100445057 MGIVCIQNHQLTNC-UHFFFAOYSA-N 275.576 2.747 70 30 CFIC Cc1cc(Br)c(S(=O)(=O)Cl)s1 100642534 LBWGMJIULMWORY-UHFFFAOYSA-N 275.576 2.747 70 30 CFIC N#Cc1cc(Cl)c(S(=O)(=O)Cl)c(Cl)c1 130248267 DNOUBDVNRCJZSH-UHFFFAOYSA-N 270.524 2.793 70 30 CFIC O=C(Oc1c(F)c(F)c(F)c(F)c1F)C1CC1 2265356022 KHGQSGWCGKAYQT-UHFFFAOYSA-N 252.138 2.698 70 30 CFIC CC(F)(F)C(C)(C)COS(=O)(=O)C(F)(F)F 705010579 PTQXQDYHVLFTBR-UHFFFAOYSA-N 270.219 2.534 70 30 CFIC COc1cc(S(=O)(=O)Cl)c(Cl)cc1Cl 218675356 LIQSFCGREJVYJT-UHFFFAOYSA-N 275.540 2.930 70 30 CFIC O=S(=O)(Cl)c1ccc(CC(F)(F)F)cc1 100502346 PAGQPXLVRACSQQ-UHFFFAOYSA-N 258.648 2.719 70 30 CFIC O=S(=O)(Cl)c1ccc2ccnc(Cl)c2c1 100467762 LCCARSJRZMDFTN-UHFFFAOYSA-N 262.117 2.816 70 30 CFIC O=S(=O)(Cl)C1CCC(C(F)(F)F)CC1 113261452 PSBXLFVIYBPTDE-UHFFFAOYSA-N 250.669 2.676 70 30 CFIC in-vitro O=S(=O)(Cl)Cc1ccc(C(F)F)c(F)c1 258543790 ZUVONHGODXGSSL-UHFFFAOYSA-N 258.648 2.832 70 30 CFIC O=S(=O)(Cl)c1ccc(C2(C(F)(F)F)N=N2)cc1 383933493 CINGXRHPEXNFCE-UHFFFAOYSA-N 284.646 2.795 70 30 CFIC O=S(=O)(Cl)C[C@H]1[C@H](c2ccccc2)C1(F)F 669371605 JOMINIYUUYIZLT-IUCAKERBSA-N 266.696 2.604 70 30 CFIC Cc1cc(Br)ccc1CS(=O)(=O)Cl 106942472 KCPOAWGNCBKOOI-UHFFFAOYSA-N 283.574 2.826 70 30 CFIC CN(C(=O)OC(C)(C)C)c1cccc(S(=O)(=O)F)c1 2265381449 DJJZTCSKHSFBST-UHFFFAOYSA-N 289.328 2.716 70 30 CFIC O=S(=O)(OC1=CCCc2ccccc21)C(F)(F)F 142121818 VQPPJULGDKMUML-UHFFFAOYSA-N 278.251 2.840 70 30 CFIC O=S(=O)(Cl)c1cnn(Cc2ccc(Cl)cc2)c1 103115920 CWKFVCNTLNTOCK-UHFFFAOYSA-N 291.159 2.512 70 30 CFIC O=S(=O)(Cl)Cc1cc(F)ccc1Br 106944071 BJSOQKOWXQQWHL-UHFFFAOYSA-N 287.537 2.657 70 30 CFIC in-vitro O=S(=O)(Cl)[C@H]1CCC[C@@H](C(F)(F)F)C1 113261814 SQPYSHIJUJDRNU-RITPCOANSA-N 250.669 2.676 70 30 CFIC O=S(=O)(Cl)c1cc(Cl)cc2cccnc12 100585931 UQYBISWHCKCPEL-UHFFFAOYSA-N 262.117 2.816 70 30 CFIC Cc1cc(Cl)c(S(=O)(=O)Cl)c(C)c1O 725343498 BKUGTRSAJSMFSC-UHFFFAOYSA-N 255.122 2.590 70 30 CFIC O=S(=O)(Cl)C1=Cc2cc(F)cc(Cl)c2OC1 100645377 KBTCXSNMKJPBEY-UHFFFAOYSA-N 283.107 2.781 70 30 CFIC Cc1coc(-c2ccc(C)c(S(=O)(=O)Cl)c2)n1 131416185 NCEMQWAWIILLRL-UHFFFAOYSA-N 271.725 2.886 70 30 CFIC O=S(=O)(Cl)c1c(F)cccc1OC(F)(F)F 142459562 ACNCKTJIYWQCCP-UHFFFAOYSA-N 278.610 2.652 70 30 CFIC O=C1CCCc2cc(Cl)c(S(=O)(=O)Cl)cc2N1 59103445 IDHPASOHURRULY-UHFFFAOYSA-N 294.159 2.542 70 30 CFIC O=S(=O)(Cl)c1cc2ccc(Cl)nc2cc1F 59530755 APJDEAYWUZDGSE-UHFFFAOYSA-N 280.107 2.955 70 30 CFIC in-vitro ClC(Cl)[SiH2]CC[Si](Cl)(Cl)Cl 201134570 XEQNIVPGXFSPLT-UHFFFAOYSA-N 276.526 2.990 70 30 CFIC CC(C)(C)OC(=O)N1CC[C@@H](CCN)C(F)(F)CC1 218758540 VBRJQCZFZUBNDZ-SNVBAGLBSA-N 278.343 2.618 70 30 CFIC COCCCOc1ccc(Cl)cc1S(=O)(=O)Cl 88270575 SWDABNNNAZWZBM-UHFFFAOYSA-N 299.175 2.683 70 30 CFIC in-vitro O=S(=O)(Cl)[C@H](c1ccccc1)C(F)(F)F 97976185 LXRRNCPWUOABIA-SSDOTTSWSA-N 258.648 2.859 70 30 CFIC O=S(=O)(Cl)Cc1ccsc1Br 307455912 DDCQITRALDHZGS-UHFFFAOYSA-N 275.576 2.579 70 30 CFIC O=S(=O)(Cl)CCc1ccc(C(F)(F)F)cc1 104673206 TVYWWRSPBWVOHJ-UHFFFAOYSA-N 272.675 2.817 70 30 CFIC O=S(=O)(Cl)Cc1cccc(F)c1Br 106944065 RRNXIQOZIZVGCN-UHFFFAOYSA-N 287.537 2.657 70 30 CFIC O=S(=O)(Cl)c1c[nH]c2c(Br)cccc12 675050407 HLVQLJCNXJLORN-UHFFFAOYSA-N 294.557 2.858 70 30 CFIC CCCCc1cccc(OC)c1S(=O)(=O)Cl 2265385056 TVUZQHFUNSFZJS-UHFFFAOYSA-N 262.758 2.965 70 30 CFIC C[C@@H]1Cc2cc(S(=O)(=O)Cl)cc(Cl)c2O1 100631858 WKYMHGPTTUKYDH-RXMQYKEDSA-N 267.133 2.591 70 30 CFIC in-vitro C[Si](Br)(c1ccccc1)c1ccccc1 195767910 MLSWRAMUWWNBQG-UHFFFAOYSA-N 277.237 2.771 70 30 CFIC CC(C)(C)OC(=O)N1CCC(CC2(O)CC2)CC1 217831122 CHJICAYFYRKOHL-UHFFFAOYSA-N 255.358 2.549 70 30 CFIC O=S(=O)(Cl)c1cscc1C(F)(F)F 307103679 AVYBGNWGLMTDIC-UHFFFAOYSA-N 250.650 2.694 70 30 CFIC O=S(=O)(Cl)c1ccc(OC(F)(F)C(F)F)cc1 100424975 BHVOWFNWLROOSU-UHFFFAOYSA-N 292.637 2.851 70 30 CFIC O=S(=O)(Cl)c1ccc(OCC(F)(F)F)cc1 100590883 CIUDMBYRPHOVNB-UHFFFAOYSA-N 274.647 2.555 70 30 CFIC