smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359920 JUPNAKFOVSJGMV-DJVODIQMSA-N 478.969 5.024 70 1 JKIF CC(C)c1nc(-c2cccs2)cc(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728644 RLEKPHCEZDNCRQ-KTKRTIGZSA-N 487.489 5.389 70 1 JKIF CCCC1([C@@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3CCCCCCC(=O)O)c2)CCC1 137010333 QJVZVQODDFMWMY-YQSOIZMPSA-N 451.047 6.187 70 1 JKIF C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C1(c2ccc(Br)nc2)CCC(F)(F)CC1 217382856 XNDJMGGHPSVLDD-GFCCVEGCSA-N 492.191 6.417 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1Cl 586924986 BGCQGEWDOZQRAS-UHFFFAOYSA-N 476.513 5.505 70 1 JKIF COC(=O)c1ccc(Oc2ccc3nc(-c4ccc(S(=O)(=O)Cl)c(Cl)c4)[nH]c3c2)cc1 586928338 XRUQBRMNAYBFBR-UHFFFAOYSA-N 477.325 5.390 70 1 JKIF C[C@@]1(c2cc(S(=O)(=O)Cl)ccc2Br)CC(=O)c2ccc3c(c2O1)CCCC3 587531766 LYERWNLGQNAHLZ-FQEVSTJZSA-N 469.784 5.136 70 1 JKIF CCCCCOc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586928167 QPPSIRUCVKQWSX-UHFFFAOYSA-N 492.222 6.142 70 1 JKIF Cc1c(-c2ccccc2)nc(C2CC2)c(/C=C\P(O)(O)=CC(=O)CC(=O)O)c1-c1ccc(F)cc1 169728658 VFNSSXLZSSSVCF-YPKPFQOOSA-N 493.471 5.389 70 1 JKIF CC(C)c1nc2c(c(-c3ccc(F)cc3)c1/C=C\P(O)(O)=CC(=O)CC(=O)O)Cc1ccccc1-2 169728675 IIZZKIRFLVXSKX-QXMHVHEDSA-N 493.471 5.231 70 1 JKIF C=C1C/C(C)=C/CCc2cc(OS(=O)(=O)C(F)(F)F)ccc2-c2ccc(OC)c(OC)c21 221985557 CUEUAHQNFZJDRE-MKMNVTDBSA-N 468.493 5.895 70 3 JKIF C[C@]1(c2cc(S(=O)(=O)Cl)ccc2Br)CC(=O)c2ccc3c(c2O1)CCCC3 587531767 LYERWNLGQNAHLZ-HXUWFJFHSA-N 469.784 5.136 70 1 JKIF O=S(=O)(Oc1ccc([C@@H]2c3ccsc3CCN2Cc2cccnc2)cc1Cl)C(F)(F)F 962994462 DGIXCBWNJYSFDZ-LJQANCHMSA-N 488.940 5.173 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)-c2cc(S(=O)(=O)Cl)ccc2C3)c1 587365347 LLHWNYAFJLSCKL-UHFFFAOYSA-N 461.926 6.155 70 1 JKIF COc1cc(Cc2nc3ccc(S(F)(F)(F)(F)F)cc3[nH]2)cc(S(=O)(=O)Cl)c1OC 586924414 DGGGSPWSAHYNFD-UHFFFAOYSA-N 492.875 5.756 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 586927662 IRJCUIJBTNFLDS-UHFFFAOYSA-N 490.393 6.096 70 1 JKIF CCC/C=C\CCCCCCCCCCCC[C@H]1CC(=O)NCCCNCCCCNCCCN1 217502352 FDTSEFAHSFJXIX-JDIDTKHOSA-N 492.837 6.242 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)c1 586927308 WJXGLVXHZGRXID-UHFFFAOYSA-N 476.513 5.505 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 587849768 NQGFXQAPTXOJLS-XTZNXHDOSA-N 481.214 5.357 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)cc(F)c3[nH]2)c1 586926458 LAJGPURPMGWGLM-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)ccc1Cl 586927269 VTEGWNIYBZMQCR-UHFFFAOYSA-N 460.367 6.088 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)cc1Cl 586927554 GPAVLQDNDNDZSF-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF O=S(=O)(Cl)c1ccc(Sc2nnc(Nc3ccc(C(F)(F)F)cc3)s2)cc1 103273042 MLMUORHXICORKD-UHFFFAOYSA-N 451.904 5.379 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(Sc4ccccc4)cc3[nH]2)c1Cl 586925495 RTAOLHBYOREHJJ-UHFFFAOYSA-N 469.802 6.615 70 1 JKIF Cc1cc(Br)cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 586924923 APHZLBBVIWLPNZ-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF CCCCCOc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586928014 WEIGRYDFMQDZGK-UHFFFAOYSA-N 492.222 6.142 70 1 JKIF CCc1ccc(-c2nc3cc(OCC(C)C)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586927396 MEDHXQZCYJABSX-UHFFFAOYSA-N 471.804 5.517 70 1 JKIF CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728672 BNWXGYASSDBALW-YPKPFQOOSA-N 495.487 5.501 70 1 JKIF O=C1C[C@@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)Oc2c1ccc1c2CCCC1 587531179 IZWCVLZKTPCQLG-RUZDIDTESA-N 452.959 5.402 70 1 JKIF CC(C)(O)c1ccc(C2(CNC(=O)c3cccc(Cl)c3Cl)CCC(F)(F)CC2)cn1 217367615 BGUNDSQMAWDSDP-UHFFFAOYSA-N 457.348 5.493 70 1 JKIF Cc1cc(Cl)cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c12 586926776 QAMBHSNDTOZBER-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF CCCOc1cc2nc(-c3ccc(CC)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927806 RYVKJGKBWYXMKA-UHFFFAOYSA-N 457.777 5.271 70 1 JKIF COc1ccc(Cl)cc1C#Cc1cc(Br)c(S(=O)(=O)Cl)c(Br)c1 587918379 PEBLHDHKAFTVDZ-UHFFFAOYSA-N 499.007 5.201 70 1 JKIF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)N1 962938993 AZJZRBXCYOZJNN-XIKOKIGWSA-N 458.889 5.063 70 1 JKIF O=C(NC[C@H](CC1(C(F)F)CC1)c1ccc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217365916 UGWHWRGXVZKSKE-LBPRGKRZSA-N 467.265 6.356 70 1 JKIF O=C(NC[C@@H](c1ccc(F)cc1)c1cnc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217378817 IGFZEMQKBHZFBX-HNNXBMFYSA-N 458.242 5.503 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358650 DUWAIIOCDKFUEI-FYYLOGMGSA-N 495.355 5.777 70 1 JKIF O=S(=O)(Oc1ccc(C(=C2C3CCCC2CCC3)c2ccc(O)cc2)cc1)C(F)(F)F 49780708 BNPSUHZPQAFYMC-UHFFFAOYSA-N 452.494 6.023 70 1 JKIF CCCC1([C@@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3CCCCCCC(=O)OC)c2)CCC1 137012000 PAZBGXZBOAQSBR-ODXKGFOESA-N 465.074 6.276 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(Br)c(Br)cc3[nH]2)ccc1Cl 586928084 YHHKDVAFIRXNQM-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF CCCN1[C@@H](C)Cc2ccccc2[C@@]1(c1cc(S(=O)(=O)Cl)c[nH]1)C(Cl)(Cl)Cl 963244340 WCILIXZQUNTJDX-YVEFUNNKSA-N 470.249 5.213 70 1 JKIF CCOC(=O)c1cc(Br)c2[nH]c(-c3cc(S(=O)(=O)Cl)cc(C)c3Cl)nc2c1 586926160 IAXRUYVSUOLRRH-UHFFFAOYSA-N 492.178 5.058 70 1 JKIF CCCCOc1cc2[nH]c(-c3ccc(S(=O)(=O)Cl)c(C)c3)nc2cc1Br 586927829 KTCWKPWGTUQRAP-UHFFFAOYSA-N 457.777 5.407 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(Br)c(C)c(C)c2[nH]1 586925454 PPYVXVOJXYPWSQ-UHFFFAOYSA-N 464.168 5.199 70 1 JKIF CC[C@@]1(c2cccc(S(=O)(=O)Cl)c2)c2ccc3c(c2CCN1C(=O)OC(C)(C)C)NCCC3 961775058 IGCDSQGDQZPQNO-RUZDIDTESA-N 491.053 5.419 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)c1Cl 586924951 ASUJXUYBIZKZRV-UHFFFAOYSA-N 480.078 6.016 70 1 JKIF C[C@@]1(c2ccc(OS(=O)(=O)C(F)(F)F)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587329491 LCQJOTBVNPIXBM-IRLDBZIGSA-N 496.434 5.034 70 1 JKIF COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc([C@@H](O)C3CCCCC3)cc2)[C@H](O)C[C@H]1Cl 137011323 JHUZQUMJNPQVQM-ODXKGFOESA-N 451.047 5.886 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361678 YRJKQHCCMQLGQM-GGAORHGYSA-N 460.910 5.042 70 1 JKIF C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587848340 HZDUFWTXSSJANR-FPTDNZKUSA-N 494.813 5.342 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)cc1Cl 586928344 XXUGEYZOAZXRDB-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Br)cc(Cl)c3[nH]2)c1Cl 586925720 ATKHYBRYEVLDQW-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF CCc1ccc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586927380 LWLHZEICRFTNBE-UHFFFAOYSA-N 467.694 5.501 70 1 JKIF C[C@@]1(c2cc(S(=O)(=O)Cl)ccc2Cl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358369 CUXGFMSIDWUXMJ-UNMCSNQZSA-N 481.328 5.387 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c1Cl 586927469 ZFUMQKDUDVNXAX-UHFFFAOYSA-N 477.213 6.157 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@@]2(CS(=O)(=O)Cl)CC[C@H]3C2(C)C)c1 587364437 FBSSCFQPHPRMHM-DWXRJYCRSA-N 482.001 6.380 70 1 JKIF CC[C@@]1(c2cccc(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358068 ARWWQLSXGCJXNQ-GMAHTHKFSA-N 460.910 5.123 70 1 JKIF CCCc1c(O)ccc2c1O[C@@H](C(C)=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587487047 MSBWZDGCCNXBNV-WJOKGBTCSA-N 494.571 5.865 70 1 JKIF CCc1nc(-c2ccccc2)c(C)c(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728629 GVINGYGKIBHQDN-BUHFOSPRSA-N 481.460 5.074 70 1 JKIF O=C1c2ccccc2-c2cc(-c3cc(S(=O)(=O)Cl)ccc3Br)nc3cccc1c23 587209166 LRDIZOINQZOCFX-UHFFFAOYSA-N 484.758 5.803 70 1 JKIF O=C(NCC1(c2ccc(C(F)(F)F)nc2)CCC(F)(F)CC1)c1cccc(Cl)c1Cl 217361217 CNMOPASQNNLTSB-UHFFFAOYSA-N 467.265 6.284 70 1 JKIF CCCCCOc1cc2[nH]c(-c3ccc(S(=O)(=O)Cl)c(C)c3)nc2cc1Br 586927685 JAAGBYWPZFIJPU-UHFFFAOYSA-N 471.804 5.797 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)cc1Cl 586928379 YVSHKZIBGDMCBD-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF CC(C)OC(=O)CCC/C=C\C[C@@H]1[C@@H](c2ccc([C@H](O)C3CCCCC3)cc2)[C@H](O)C[C@H]1Cl 137009999 MJSOWZQIYLGSHR-GECPJVSBSA-N 477.085 6.440 70 1 JKIF CC(C)(Br)[C@H](Br)CC/C(=C/CBr)CBr 1635420 NCKWUVDGCBCHTE-BZJXQOFCSA-N 455.854 5.420 70 1 JKIF O=C(NC[C@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1c(F)cccc1Cl 217380427 BBABFHCUJHALBA-ZDUSSCGKSA-N 465.825 5.627 70 1 JKIF CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359941 JUPNAKFOVSJGMV-SOPLCPCWSA-N 478.969 5.024 70 1 JKIF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587849424 LLXJGFXGNYLBBA-PEBXRYMYSA-N 494.813 5.342 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)c1 587177814 ASYAIEARNKTUDS-UHFFFAOYSA-N 473.629 5.203 70 1 JKIF COc1ccc(-c2nnc(-c3ccc4nc(-c5cc(S(=O)(=O)F)ccc5Cl)[nH]c4c3)o2)cc1 587181388 YHSCPOYAKYEZHV-UHFFFAOYSA-N 484.896 5.267 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361679 YRJKQHCCMQLGQM-GMAHTHKFSA-N 460.910 5.042 70 1 JKIF COc1cccc(-c2c(C)c(-c3cccc(S(=O)(=O)Cl)c3)nc3c2oc2ccccc23)c1 587365824 NRGRJNHEEDGBOW-UHFFFAOYSA-N 463.942 6.560 70 1 JKIF [C-]#[N+]c1ccc(N2C(=O)C(C)(C)N(c3ccc(OC(=O)CCl)cc3)C2=S)cc1C(F)(F)F 167636772 FAGNHMBDKVBEPH-UHFFFAOYSA-N 481.883 5.317 70 1 JKIF C[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361664 YFSAUPZLMSCQGG-UNMCSNQZSA-N 481.328 5.387 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358660 DUWAIIOCDKFUEI-JTHBVZDNSA-N 495.355 5.777 70 1 JKIF CCCc1c(O)ccc2c1O[C@H](C(C)=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587487046 MSBWZDGCCNXBNV-HKBQPEDESA-N 494.571 5.865 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(SC(F)(F)F)cc3[nH]2)c1Cl 586925276 DMAQCDQDJZJADL-UHFFFAOYSA-N 461.701 6.076 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(F)c(Br)c3[nH]2)c1Cl 586927490 YVTOCVJRXKYLQW-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(Br)c(F)c3[nH]2)c1Cl 586926054 KZZRNRYJNNIHOL-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 586925898 YHSDXQWHVUITQZ-UHFFFAOYSA-N 493.212 5.857 70 1 JKIF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)-c1cc(S(=O)(=O)Cl)c(Cl)cc1C3 586993892 LBAJCTLJSDHLJP-UHFFFAOYSA-N 468.317 5.304 70 1 JKIF O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(F)cc2F)cc1 73316432 YWKBQJDRPHVPBC-UHFFFAOYSA-N 492.505 6.611 70 1 JKIF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)O2 587408272 LITGBLLNNIVDRQ-PMERELPUSA-N 465.533 5.097 70 1 JKIF Cc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2cc1Br 586926100 GQTYIZGPIWRZPZ-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)cc1Cl 586926812 AIVWXVZHMRUFSN-UHFFFAOYSA-N 463.186 5.848 70 1 JKIF Cc1c(Br)ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c12 586925766 AYFHHQOPVVJQPZ-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF O=C(NCC1(c2ccc(C(F)(F)F)nc2)CCC(F)(F)CC1)c1cccc(Cl)c1F 217383536 HAVDOEUAXIXGLG-UHFFFAOYSA-N 450.810 5.770 70 1 JKIF CCCOc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(C)c3Cl)[nH]c2cc1Br 586927008 SUVCQXVQIVKXON-UHFFFAOYSA-N 478.195 5.671 70 1 JKIF CC(C)c1nc(-c2ccccc2)c(F)c(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728641 QPLHXKDWQNPOQG-OUKQBFOZSA-N 499.450 5.466 70 1 JKIF C[C@@]1(c2ccc(OS(=O)(=O)C(F)(F)F)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587329495 LCQJOTBVNPIXBM-UNMCSNQZSA-N 496.434 5.034 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)C=C(OS(=O)(=O)C(F)(F)F)CC3)c1 587358431 BEDRFSMWCBIURQ-UHFFFAOYSA-N 475.444 5.810 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(Br)c(F)cc3[nH]2)c1Cl 586926626 RYMIRXBACYIJDG-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3c(Cl)c(Br)cnc3[nH]2)c1Cl 586925069 CCOCXCCKYROXAH-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF COc1ccc(Cl)cc1C#Cc1cc(Br)cc(Br)c1S(=O)(=O)Cl 587918281 KFDSRFTYCUCWPX-UHFFFAOYSA-N 499.007 5.201 70 1 JKIF C[C@]1(c2cc(S(=O)(=O)Cl)ccc2Cl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358366 CUXGFMSIDWUXMJ-RBBKRZOGSA-N 481.328 5.387 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)c1 586927504 ZLZJCPZDFVHDCJ-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ccccc1S(=O)(=O)Cl 587608667 ROWIORPEVSEBOL-OZXSUGGESA-N 492.936 5.225 70 1 JKIF Cc1ccc2c(ccc3nc(-c4cc(S(=O)(=O)Cl)cc(Br)c4Cl)[nH]c32)n1 586927509 ZQTUEMZBJSVSQI-UHFFFAOYSA-N 471.163 5.430 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@@]1(C)NCCc2c1[nH]c1ccc(OCc3ccccc3)cc21 963819583 YAFWZGGLDRUERH-AREMUKBSSA-N 481.017 5.392 70 1 JKIF N#Cc1cc(Cl)c2[nH]c(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)nc2c1 586926475 LDFAYMQGKITSTI-UHFFFAOYSA-N 465.543 5.098 70 1 JKIF O=S(=O)(Oc1ccc([C@H]2c3ccsc3CCN2Cc2cccnc2)cc1Cl)C(F)(F)F 962994460 DGIXCBWNJYSFDZ-IBGZPJMESA-N 488.940 5.173 70 1 JKIF CC(C)Oc1ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2c1 586926935 SHYLOMHUUOFNDM-UHFFFAOYSA-N 464.168 5.361 70 1 JKIF Cc1cc(N)c2c(c1)C(=O)C[C@@](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)(CCl)O2 587407883 JPDWENRMUIAHSL-PMERELPUSA-N 499.978 5.316 70 1 JKIF Cc1ccc2c3c(cc(-c4cc(S(=O)(=O)Cl)ccc4Cl)nc13)-c1ccccc1C2=O 587101938 JWIBEHBTSDZFBQ-UHFFFAOYSA-N 454.334 6.003 70 1 JKIF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587848347 HZDUFWTXSSJANR-PEBXRYMYSA-N 494.813 5.342 70 1 JKIF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587851318 VQJYANICRKXNOF-RCDICMHDSA-N 494.813 5.342 70 1 JKIF CC[C@H](C)c1ccc2[nH]c(-c3ccc(Br)cc3)c(OS(=O)(=O)C(F)(F)F)c2c1 587642290 MPGHERKDGFLUOJ-NSHDSACASA-N 476.314 6.339 70 1 JKIF Cc1c(Br)cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2c1C 586927277 WLUQHHMHHUHDFA-UHFFFAOYSA-N 468.587 5.844 70 1 JKIF CC(C)[C@]1(c2ccc(S(=O)(=O)Cl)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361233 SNEZTDWUSRRUGW-LADGPHEKSA-N 474.937 5.369 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361680 YRJKQHCCMQLGQM-JTHBVZDNSA-N 460.910 5.042 70 1 JKIF COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc([C@H](O)C3CCCCC3)cc2)[C@H](O)C[C@H]1Cl 137011275 JHUZQUMJNPQVQM-VCILPBCZSA-N 451.047 5.886 70 1 JKIF CC(C)Oc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586926534 BDIAWONBEIRASV-UHFFFAOYSA-N 464.168 5.361 70 1 JKIF CCCOc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586927935 LPRAAGTWLTXYOO-UHFFFAOYSA-N 464.168 5.362 70 1 JKIF CC(C)COc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586926918 HCWRZEGVLGBMFX-UHFFFAOYSA-N 478.195 5.608 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc4ncccc4c3[nH]2)c1 586926699 OJANYJWUCNQMGR-UHFFFAOYSA-N 457.136 5.122 70 1 JKIF COc1ccc(-c2nnc(-c3ccc4[nH]c(-c5ccc(S(=O)(=O)Cl)c(C)c5)nc4c3)o2)cc1 586927964 MYUUWKSQZMOQGT-UHFFFAOYSA-N 480.933 5.191 70 1 JKIF Cc1c(Br)cnc2[nH]c(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)nc12 586925817 BFKOCQKJIGXEPW-UHFFFAOYSA-N 499.999 5.039 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(Br)cnc(Br)c3[nH]2)c1Cl 586925777 BCLVIHOAZRIHLH-UHFFFAOYSA-N 499.999 5.039 70 1 JKIF CCCCOc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927541 OKDGBECAPBUJSU-UHFFFAOYSA-N 478.195 5.752 70 1 JKIF Cc1c(-c2ccc(Cl)c(S(=O)(=O)Cl)c2)nc2c(C)ccc3c2c1-c1ccccc1C3=O 587102299 NEVVIZDFVKNXIO-UHFFFAOYSA-N 468.361 6.311 70 1 JKIF CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1ccc(OC)c(S(=O)(=O)Cl)c1)CC2=O 587489519 VCZYMCXSKUYPOB-RUZDIDTESA-N 486.973 5.190 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc(C(F)(F)F)cc3[nH]2)c1 586927449 YWTZAHAIWCAKMR-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358658 DUWAIIOCDKFUEI-GMAHTHKFSA-N 495.355 5.777 70 1 JKIF Oc1ccc2c(c1)[C@@](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)NCC2 963339981 DDKOGOKCLOGEQO-UUWRZZSWSA-N 499.594 5.578 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 587850728 RUPKVZHEZMXULN-MLCYQJTMSA-N 481.214 5.357 70 1 JKIF CCc1ccc(-c2nc3ccc(Oc4ccc(C(=O)OC)cc4)cc3[nH]2)cc1S(=O)(=O)Cl 586926957 HHRKZFPJMNYQMI-UHFFFAOYSA-N 470.934 5.299 70 1 JKIF CCCCOc1cc2nc(-c3ccc(CC)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927832 SHIRUCYKGRIQGB-UHFFFAOYSA-N 471.804 5.661 70 1 JKIF COC(=O)c1cc(Br)c2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc2c1 586926083 LVLMTQNJOBGCKW-UHFFFAOYSA-N 498.569 5.013 70 1 JKIF COc1cc(C2=C(c3ccc(SC)cc3)C[C@H](O[SiH2]C(C)(C)C)C2=O)cc(OC)c1OC 195279339 VBZCNETUPRITOT-IBGZPJMESA-N 472.679 5.005 70 1 JKIF CCCC1([C@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3C/C=C\CCCC(=O)OC)c2)CCC1 137011836 AMSYNEAWRKZFHZ-GJKBXQPLSA-N 463.058 6.052 70 1 JKIF C[C@H](NC(=O)c1cccc(Cl)c1Cl)C1(c2ccc(Br)nc2)CCC(F)(F)CC1 217382785 XNDJMGGHPSVLDD-LBPRGKRZSA-N 492.191 6.417 70 1 JKIF COC(=O)c1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2c(F)c1Nc1ccccc1 586926941 HFLOEBVGBHSORT-UHFFFAOYSA-N 494.331 5.480 70 1 JKIF O=S(=O)(Cl)c1ccc(/N=c2/sc(-c3ccc(Cl)cc3)cn2-c2ccccc2)cc1 103152849 VHGKRHOJMQAKBN-DARPEHSRSA-N 461.395 6.019 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)cc1Cl 586927335 FLNZNCAOWHFZQH-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF CC(C)[C@@]1(c2ccc(S(=O)(=O)Cl)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361234 SNEZTDWUSRRUGW-UPVQGACJSA-N 474.937 5.369 70 1 JKIF CC(C)[C@@]1(c2ccc(S(=O)(=O)Cl)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361235 SNEZTDWUSRRUGW-VWNXMTODSA-N 474.937 5.369 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)c1 586926748 PCXDNKMWYJZMSP-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587850814 RZRNGHZEDIWTRP-PEBXRYMYSA-N 494.813 5.342 70 1 JKIF C[C@]1(c2cc(S(=O)(=O)Cl)ccc2Cl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358360 CUXGFMSIDWUXMJ-IFMALSPDSA-N 481.328 5.387 70 1 JKIF O=S(=O)(Oc1c(-c2ccc(Br)cc2)[nH]c2cc(Cl)c(F)cc12)C(F)(F)F 587630376 ZTWCHAIKCWWYNC-UHFFFAOYSA-N 472.641 5.618 70 1 JKIF Cc1cc(Br)c2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc2c1 586925681 IZUWMAQFUWCBFG-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF CCCC1([C@@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3C/C=C\CCCC(=O)OC)c2)CCC1 137011896 AMSYNEAWRKZFHZ-PXOCQBPVSA-N 463.058 6.052 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)ccc1Cl 586926509 ASXZPYFAMYIZAI-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF O=[N+]([O-])c1c(Br)ccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 586925566 GUYCMIWDUATIBX-UHFFFAOYSA-N 485.530 5.135 70 1 JKIF COC(=O)c1ccc(Oc2ccc3[nH]c(-c4ccc(S(=O)(=O)Cl)c(C)c4)nc3c2)cc1 586927625 HZKFRQQLAVECHX-UHFFFAOYSA-N 456.907 5.045 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)ccc1Cl 586927969 USJBWYAIRLRUSO-UHFFFAOYSA-N 463.186 5.848 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 586925158 MKOMODRYBNHOEZ-UHFFFAOYSA-N 457.338 6.126 70 1 JKIF Nc1ccc(Oc2ccc3nc(-c4c(Cl)ccc(S(=O)(=O)Cl)c4Cl)[nH]c3c2)cc1 586925678 IZMHCERIDFDZJP-UHFFFAOYSA-N 468.749 5.839 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)-c2cc(S(=O)(=O)Cl)c(Cl)cc2C3)c1 587366559 SXZMVQUVCLBTIG-UHFFFAOYSA-N 496.371 6.809 70 1 JKIF CCC([C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587450180 RSWQYZXMTHNDTA-ZUKKLESISA-N 492.555 5.388 70 1 JKIF CCCc1c(O)ccc2c1O[C@H](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587481507 CGVDSODETSJYSP-QHCPKHFHSA-N 480.544 5.475 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)-c2cc(S(=O)(=O)Cl)ccc2CC3)c1 587365469 MIWAGNPDJVRTFK-UHFFFAOYSA-N 475.953 6.350 70 1 JKIF N#CC(C(=O)c1cc(F)c(Cl)nc1Cl)=P(c1ccccc1)(c1ccccc1)c1ccccc1 96929987 SONVSOUGLPNODC-UHFFFAOYSA-N 493.305 5.400 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cnc4ccccc4c3[nH]2)c1 586926005 DGBQAVLYLJNPNB-UHFFFAOYSA-N 457.136 5.122 70 1 JKIF Cc1cc(F)ccc1-c1cc(-c2ccccc2)nc(C(C)C)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728654 ZJVDJMRYBLYZIE-QXMHVHEDSA-N 495.487 5.635 70 1 JKIF O=C(NC[C@@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1cccc(F)c1Cl 217380539 DLDVJLNENOLKMS-CQSZACIVSA-N 465.825 5.627 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3c(Br)ccc(Br)c3[nH]2)cc1Cl 586926927 BKURGFMKRXSQEX-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF CC(C)CCOc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927859 STURNMABOPIWGG-UHFFFAOYSA-N 492.222 5.998 70 1 JKIF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ccccc1S(=O)(=O)Cl 587608666 ROWIORPEVSEBOL-JYFHCDHNSA-N 492.936 5.225 70 1 JKIF Cc1ccc2c3c(cc(-c4cc(S(=O)(=O)Cl)ccc4Br)nc13)-c1ccccc1C2=O 587102931 SLZKFIFDFLQXTI-UHFFFAOYSA-N 498.785 6.112 70 1 JKIF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587849425 LLXJGFXGNYLBBA-RCDICMHDSA-N 494.813 5.342 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(SC(F)(F)F)cc2[nH]1 586924561 FREXLAXYWGDWCG-UHFFFAOYSA-N 457.282 5.431 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(OCc4ccccc4)c(Br)cc3[nH]2)c1 587177998 KXTNERYMEALURD-UHFFFAOYSA-N 495.757 5.883 70 1 JKIF CC(C)CCOc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586928304 VKILKIXNSMQHAJ-UHFFFAOYSA-N 492.222 5.998 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cccc(I)c3[nH]2)c1Cl 586926473 POFJHGBKACTGRW-UHFFFAOYSA-N 487.533 5.069 70 1 JKIF CC[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)N1 962938992 AZJZRBXCYOZJNN-SGTLLEGYSA-N 458.889 5.063 70 1 JKIF O=C1c2ccc(O)cc2O[C@]2(CCc3cc(Cl)c(S(=O)(=O)Cl)cc32)[C@@H]1c1ccc(F)cc1 587358711 FCPBGGNHWHCMCQ-GGAORHGYSA-N 493.339 5.313 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(Br)cc(Cl)c3[nH]2)c1Cl 586926545 QWBVEQZZDJNHLR-UHFFFAOYSA-N 474.978 5.880 70 1 JKIF CC(C)c1cc(-c2ccccc2)nc(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728634 SWKNLGMAGIZAAF-SEYXRHQNSA-N 481.460 5.327 70 1 JKIF CC(C)CCOc1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2cc1Br 587177821 BBMDTLWJVJBYHP-UHFFFAOYSA-N 475.767 5.729 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc4c(c3[nH]2)CCCC4)c1 586926113 HAGRMGNQEKJTSA-UHFFFAOYSA-N 460.180 5.452 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1Cl 586926504 PXUKIWXEPSRPCP-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF O=[N+]([O-])c1cc(Br)cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 586927447 YHHHFZNTRQAQDT-UHFFFAOYSA-N 485.530 5.135 70 1 JKIF Nc1cnc(-c2ccc(-c3ccccc3-c3ccc(-c4cnc(N)cn4)c(F)c3)cc2F)cn1 216873760 MABAQQGUTVUPNU-UHFFFAOYSA-N 452.468 5.377 70 1 JKIF CCc1ccc(-c2nc3cc(C(=O)OC)c(Nc4ccccc4)c(F)c3[nH]2)cc1S(=O)(=O)Cl 586927683 QIOIYAJPBKHJPA-UHFFFAOYSA-N 487.940 5.389 70 1 JKIF CCc1ccc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)cc1S(=O)(=O)Cl 586928042 XAUZKZURKOFPMB-UHFFFAOYSA-N 483.693 5.381 70 1 JKIF CCCC1([C@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3CCCCCCC(=O)OC)c2)CCC1 137011954 PAZBGXZBOAQSBR-VCILPBCZSA-N 465.074 6.276 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)c1Cl 586925056 LEXHRXYMMFOQKC-UHFFFAOYSA-N 494.812 6.741 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@@]2(CS(=O)(=O)F)CC[C@H]3C2(C)C)c1 587360983 SWYQPEIYZOFWAY-DWXRJYCRSA-N 465.546 6.111 70 1 JKIF O=S(=O)(Cl)c1ccc(/N=c2/sc(-c3ccc(Cl)cc3)cn2Cc2ccccc2)cc1 103152846 BVQSXEDQFDFGPH-YYDJUVGSSA-N 475.422 6.078 70 1 JKIF COc1cc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)cc(S(=O)(=O)Cl)c1OC 586924583 FZODWDPCPOYFEZ-UHFFFAOYSA-N 466.946 5.405 70 1 JKIF CC(C)(Br)[C@@H](Br)CC/C(=C/CBr)CBr 1635422 NCKWUVDGCBCHTE-RDOCRHDPSA-N 455.854 5.420 70 1 JKIF CCCOc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927606 PACXAWZGSPYCDV-UHFFFAOYSA-N 464.168 5.362 70 1 JKIF Cc1ccc2c3c(cc(-c4ccc(OS(=O)(=O)C(F)(F)F)cc4)nc13)-c1ccccc1C2=O 586996941 WTEKQHSEHZUFAL-UHFFFAOYSA-N 469.440 5.650 70 1 JKIF Cc1cc(-c2nc3c(C(F)(F)F)c(Br)ccc3[nH]2)ccc1S(=O)(=O)Cl 586927241 DXZXWZZPPIHFOJ-UHFFFAOYSA-N 453.667 5.247 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)c1 586926749 PEAARNQZHYIWQQ-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF CCc1ccc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)cc1S(=O)(=O)Cl 586926641 CCLCJUSXCVQFIH-UHFFFAOYSA-N 467.694 5.501 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)c1Cl 586926112 GYKLARRIXWZFJT-UHFFFAOYSA-N 488.112 5.901 70 1 JKIF O=C1c2ccc(O)cc2O[C@]2(CCCc3ccc(S(=O)(=O)Cl)cc32)[C@@H]1c1ccc(F)cc1 587360075 LHWUOZXJYOVNTL-VWNXMTODSA-N 472.921 5.050 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)c1Cl 586926062 GCKZHDGUHVXWNJ-UHFFFAOYSA-N 488.112 5.901 70 1 JKIF COc1cc(Cc2nc3ccc(Sc4ccccc4)cc3[nH]2)cc(S(=O)(=O)Cl)c1OC 586925209 NAUYSHLHUSIVEC-UHFFFAOYSA-N 474.991 5.250 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)c1 586927021 SZIWLKFEOQIHOA-UHFFFAOYSA-N 475.966 5.275 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)c1 587177804 AMHQGHGCUPQQNB-UHFFFAOYSA-N 457.630 5.323 70 1 JKIF O=[N+]([O-])c1cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2cc1Cl 586925712 ARXPPSYGWNVIPZ-UHFFFAOYSA-N 485.530 5.135 70 1 JKIF Cc1cc(-c2nc3cc(Br)c(OC(F)(F)F)cc3[nH]2)ccc1S(=O)(=O)Cl 586927782 KCRNMILYJVWDPG-UHFFFAOYSA-N 469.666 5.127 70 1 JKIF CC(C)(C)OC(=O)c1ccc(-c2ccc(N3CCC(N4CCc5ccc(F)cc54)CC3)nn2)cc1 218762078 XLUBLYPYORNQLI-UHFFFAOYSA-N 474.580 5.270 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cccc(OCc4ccccc4)c3[nH]2)c1Cl 586927208 VSOMMVGIOZHGBP-UHFFFAOYSA-N 467.761 6.043 70 1 JKIF CCC([C@H]1N[C@H](C(=O)O)Cc2cccc(F)c21)=P(c1ccccc1)(c1ccccc1)c1ccccc1 962917275 FSRZXZYBLYQKNK-BHBYDHKZSA-N 497.550 5.042 70 1 JKIF CCc1ccc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586926871 GSKZCAZLKBERCN-UHFFFAOYSA-N 483.693 5.381 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c1Cl 586925537 GCOIRTFESFYFPT-UHFFFAOYSA-N 497.631 6.502 70 1 JKIF CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1cccc(S(=O)(=O)Cl)c1)CC2=O 587489674 VKNYMZNQRWRBGO-XMMPIXPASA-N 456.947 5.181 70 1 JKIF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)N1 962938991 AZJZRBXCYOZJNN-KZULUSFZSA-N 458.889 5.063 70 1 JKIF COc1cccc(-c2c(C)c(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc3c2oc2ccccc23)c1 587364867 IRBCBBUXJLUTNR-UHFFFAOYSA-N 498.387 7.213 70 1 JKIF CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1ccc(OC)c(S(=O)(=O)Cl)c1)CC2=O 587489524 VCZYMCXSKUYPOB-VWLOTQADSA-N 486.973 5.190 70 1 JKIF Cc1c(Br)cccc1C(=O)NCC1(c2ccc(C(F)(F)F)nc2)CCC(F)(F)CC1 217363249 RIFLDBVPRODDEU-UHFFFAOYSA-N 491.298 6.048 70 1 JKIF CCc1ccc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)cc1S(=O)(=O)Cl 586927290 KIQRRRBSDVIGOD-UHFFFAOYSA-N 483.693 5.381 70 1 JKIF CC(C)COc1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2cc1Br 587178208 VGAAZOUROFIQFV-UHFFFAOYSA-N 461.740 5.339 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 586924882 KDCIUJFUTLKJJI-UHFFFAOYSA-N 461.326 5.050 70 1 JKIF CCCc1c(O)ccc2c1O[C@@](C)(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587481265 AQBHDKOBDWKHEW-JGCGQSQUSA-N 494.571 5.865 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccc(S(F)(F)(F)(F)F)cc3[nH]2)c1Cl 586926778 QBPRXFJZGZERNK-UHFFFAOYSA-N 467.268 6.777 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1Cl 586925135 CIIROLSXPVEGRD-UHFFFAOYSA-N 480.629 5.513 70 1 JKIF O=S(=O)(Oc1c(-c2ccc(Br)cc2)[nH]c2ccc(F)c(Cl)c12)C(F)(F)F 587630247 XAMQCABKZKLDOW-UHFFFAOYSA-N 472.641 5.618 70 1 JKIF CCCN1[C@H](C)Cc2ccccc2[C@@]1(c1cc(S(=O)(=O)Cl)c[nH]1)C(Cl)(Cl)Cl 963244337 WCILIXZQUNTJDX-SJKOYZFVSA-N 470.249 5.213 70 1 JKIF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1cccc(S(=O)(=O)Cl)c1 587607551 NBKFCGVCLXYBJL-BVAGGSTKSA-N 492.936 5.225 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587606007 FQZHSAJIVYQJSF-SIKLNZKXSA-N 479.337 5.240 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(Br)c(Br)cc3[nH]2)cc1Cl 586928380 YWGWNYIFPDTFIY-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359937 JUPNAKFOVSJGMV-QRENOOHASA-N 478.969 5.024 70 1 JKIF Cc1c(Cl)ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c12 586927468 ZDMFUCKESBOCNY-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Cl)cc(Br)c3[nH]2)c1Cl 586927523 ZSLIAQROAHJXTH-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF C[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361661 YFSAUPZLMSCQGG-IFMALSPDSA-N 481.328 5.387 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1Cl 586927493 ZJQFPZKVBALPMQ-UHFFFAOYSA-N 456.095 5.160 70 1 JKIF O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(Cl)c(S(=O)(=O)Cl)cc32)[C@@H]1c1ccc(F)cc1 587358702 FCPBGGNHWHCMCQ-FYYLOGMGSA-N 493.339 5.313 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 587849767 NQGFXQAPTXOJLS-MLCYQJTMSA-N 481.214 5.357 70 1 JKIF O=C(NCC1(c2ccc(C(F)(F)F)nc2)CCC(F)(F)CC1)c1cccc(F)c1Cl 217383425 HDRBTBXDTSMYEF-UHFFFAOYSA-N 450.810 5.770 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361677 YRJKQHCCMQLGQM-FYYLOGMGSA-N 460.910 5.042 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)c1Cl 586926762 PQIUTEHQECXGKW-UHFFFAOYSA-N 488.112 5.901 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cccc(Br)c3[nH]2)c1 586926916 RUBCRJGRSUROFC-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF Cc1c(-c2ccccc2)nc(C(C)C)c(/C=C/P(O)(O)=CC(=O)CC(=O)O)c1-c1ccc(F)cc1 169728664 VFVKSJKKLTZCMS-BUHFOSPRSA-N 495.487 5.635 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1Cl 586926288 JUKMIEFEOZOVFX-UHFFFAOYSA-N 460.211 5.168 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)c1Cl 586925551 GHBIWQSJZLIMRQ-UHFFFAOYSA-N 464.079 6.136 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)ccc1Cl 586927377 LVVZYVUZVULYFU-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF CC(C)c1nc(C2CCCCC2)cc(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728616 RMENOMGRKFCHNM-SEYXRHQNSA-N 487.508 5.708 70 1 JKIF O=C(NC[C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217376999 VZSUYFNLHSYMGI-MRXNPFEDSA-N 457.254 6.108 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc(Br)cc3[nH]2)c1 586925666 AFZDAFXNARYXTF-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 586925241 NIWAAYNPRISYNB-UHFFFAOYSA-N 464.330 5.194 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(F)cc(Br)c3[nH]2)c1Cl 586925743 JMVXTTINRVVQKJ-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF C[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587361663 YFSAUPZLMSCQGG-RBBKRZOGSA-N 481.328 5.387 70 1 JKIF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587848343 HZDUFWTXSSJANR-JLCFBVMHSA-N 494.813 5.342 70 1 JKIF Cc1c(-c2ccc(Cl)c(S(=O)(=O)Cl)c2)nc2cccc3c2c1-c1ccccc1C3=O 587209984 ZJUUVVFSRDBINN-UHFFFAOYSA-N 454.334 6.003 70 1 JKIF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1cccc(S(=O)(=O)Cl)c1 587607555 NBKFCGVCLXYBJL-OZXSUGGESA-N 492.936 5.225 70 1 JKIF CCC([C@H]1CC(=O)c2cc(C)cc(N)c2O1)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587410260 WOEUDRSKUVGNNN-GDLZYMKVSA-N 479.560 5.488 70 1 JKIF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)O2 587408273 LITGBLLNNIVDRQ-SSEXGKCCSA-N 465.533 5.097 70 1 JKIF CCCc1c(O)ccc2c1O[C@@H](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587481498 CGVDSODETSJYSP-HSZRJFAPSA-N 480.544 5.475 70 1 JKIF Cc1cc(Cl)cc2c(OS(=O)(=O)C(F)(F)F)c(-c3ccc(Br)cc3)[nH]c12 587624258 HYMVYLAHFHYPNZ-UHFFFAOYSA-N 468.678 5.788 70 1 JKIF CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1ccccc1S(=O)(=O)Cl)CC2=O 587481296 BBBPQNBUAVNACB-XMMPIXPASA-N 456.947 5.181 70 1 JKIF Cc1ccc2c3c(c4c(nc13)[C@]1(CS(=O)(=O)Cl)CC[C@H]4C1(C)C)-c1ccccc1C2=O 587101659 IRTQBMNGTDDYOI-CRICUBBOSA-N 451.975 5.478 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cccc(OCc3ccccc3)c2[nH]1 586925267 NLPATBLCMSQSBX-UHFFFAOYSA-N 463.342 5.398 70 1 JKIF C[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361662 YFSAUPZLMSCQGG-IRLDBZIGSA-N 481.328 5.387 70 1 JKIF CCc1ccc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)cc1S(=O)(=O)Cl 586927797 RVDDMAVDCDZRJY-UHFFFAOYSA-N 456.795 5.757 70 1 JKIF CCc1ccc(-c2nc3cc(OC(C)C)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586926539 BETGJVSCTOXEOK-UHFFFAOYSA-N 457.777 5.270 70 1 JKIF CC[C@@]1(c2cccc(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358063 ARWWQLSXGCJXNQ-GGAORHGYSA-N 460.910 5.123 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)c1 587178051 NLDYUMFNZXIEBT-UHFFFAOYSA-N 457.630 5.323 70 1 JKIF Cc1cc(F)ccc1-c1cc(-c2ccccc2)nc(C(C)C)c1CCP(O)(O)=CC(=O)CC(=O)O 169728631 JSDQRZHMVURIMW-UHFFFAOYSA-N 497.503 5.207 70 1 JKIF O=C1C[C@H](C=P(c2ccccc2)(c2ccccc2)c2ccccc2)Oc2c1ccc1c2CCCC1 587530599 GAIKAKQCTFGILD-RUZDIDTESA-N 476.556 5.696 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 587849769 NQGFXQAPTXOJLS-YPMLDQLKSA-N 481.214 5.357 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587606006 FQZHSAJIVYQJSF-KNQAVFIVSA-N 479.337 5.240 70 1 JKIF Oc1ccc2c(c1)[C@](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)NCC2 963339980 DDKOGOKCLOGEQO-UMSFTDKQSA-N 499.594 5.578 70 1 JKIF COc1cccc(-c2cc(-c3cc(S(=O)(=O)Cl)ccc3Cl)nc3c2oc2ccccc23)c1 587366015 QAWJNPMXUZGOFF-UHFFFAOYSA-N 484.360 6.905 70 1 JKIF CCc1ccc(-c2nc3cc(OCCC(C)C)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586927821 SEOIOPGAULSYCM-UHFFFAOYSA-N 485.831 5.907 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3c(Br)ccc(Br)c3[nH]2)ccc1Cl 586928122 ZLMYQBMQWSAAHZ-UHFFFAOYSA-N 484.984 5.336 70 1 JKIF CC[C@]1(c2cccc(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587358072 ARWWQLSXGCJXNQ-JTHBVZDNSA-N 460.910 5.123 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(S(F)(F)(F)(F)F)cc3[nH]2)c1Cl 586925780 JTBYLWZCXQXKQP-UHFFFAOYSA-N 487.686 7.122 70 1 JKIF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1cccc(S(=O)(=O)Cl)c1 587607553 NBKFCGVCLXYBJL-JYFHCDHNSA-N 492.936 5.225 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)cc1Cl 586927418 MPIMFRUMUCWJPG-UHFFFAOYSA-N 460.367 6.088 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)c1Cl 586927366 XLEXOLZITNGLCL-UHFFFAOYSA-N 459.660 5.671 70 1 JKIF CCCCCOc1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2cc1Br 587178230 WHKCHCDRIHYCDA-UHFFFAOYSA-N 475.767 5.873 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)c1Cl 586927054 UEWWAZUEAXFPOK-UHFFFAOYSA-N 488.112 5.901 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)cc1Cl 586928256 SKDPRSLODKXAKS-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF CN(C)Cc1ccc(-c2c(-c3cccc(OC(F)(F)F)c3)cc3n2[C@H](CCCl)CNC3=O)cc1 143148560 MEQUDKNTYPMAEZ-LJQANCHMSA-N 491.941 5.696 70 1 JKIF Cc1ccc(S(=O)(=O)Cl)cc1[C@]1(C)NCCc2c1[nH]c1ccc(OCc3ccccc3)cc21 963819586 YAFWZGGLDRUERH-SANMLTNESA-N 481.017 5.392 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3ccc(S(F)(F)(F)(F)F)cc3[nH]2)ccc1Cl 586927240 JSXFGXXMVHIACR-UHFFFAOYSA-N 453.241 6.468 70 1 JKIF CC(C)(C)c1ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2n1 586925951 CFPYXYOVHXACSC-UHFFFAOYSA-N 463.184 5.266 70 1 JKIF O=C(NC[C@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1cccc(F)c1Cl 217380616 DLDVJLNENOLKMS-AWEZNQCLSA-N 465.825 5.627 70 1 JKIF CCCN1[C@@H](C)Cc2ccccc2[C@]1(c1cc(S(=O)(=O)Cl)c[nH]1)C(Cl)(Cl)Cl 963244335 WCILIXZQUNTJDX-SJCJKPOMSA-N 470.249 5.213 70 1 JKIF CC(C)c1cc(-c2ccccc2)nc(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728635 SWKNLGMAGIZAAF-OUKQBFOZSA-N 481.460 5.327 70 1 JKIF COc1ccc(Cl)cc1C#Cc1ccc(NC(=O)Nc2ccc(S(=O)(=O)Cl)c(C)c2)cc1 587918115 BCCSQCXKOXKJHX-UHFFFAOYSA-N 489.380 5.628 70 1 JKIF CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1ccccc1S(=O)(=O)Cl)CC2=O 587481295 BBBPQNBUAVNACB-DEOSSOPVSA-N 456.947 5.181 70 1 JKIF C[C@]1(c2ccc(OS(=O)(=O)C(F)(F)F)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587329488 LCQJOTBVNPIXBM-IFMALSPDSA-N 496.434 5.034 70 1 JKIF Cc1ccc2c3c(c4c(nc13)[C@@]1(CS(=O)(=O)Cl)CC[C@@H]4C1(C)C)-c1ccccc1C2=O 587101829 IRTQBMNGTDDYOI-GKVSMKOHSA-N 451.975 5.478 70 1 JKIF C[C@@]1(C=P(c2ccccc2)(c2ccccc2)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587533741 UVPLQZNNXQJWCQ-XIFFEERXSA-N 490.583 6.086 70 1 JKIF O=C(c1ccccc1)c1ccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2c1 586926627 SCUPWZARWSYCIR-UHFFFAOYSA-N 465.745 5.695 70 1 JKIF Cc1nc2[nH]c(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)nc2cc1Br 586926821 QRSNQIARBZABNM-UHFFFAOYSA-N 499.999 5.039 70 1 JKIF CC([C@@H]1CC(=O)c2cc(C)cc(N)c2O1)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587410026 UYUOQICQBCWXOY-LJAQVGFWSA-N 465.533 5.097 70 1 JKIF O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c21 586927265 WKLADKYFHLOSQE-UHFFFAOYSA-N 491.739 5.240 70 1 JKIF Cc1cc(F)ccc1-c1cc(-c2ccccc2)nc(C(C)C)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728655 ZJVDJMRYBLYZIE-VAWYXSNFSA-N 495.487 5.635 70 1 JKIF CCc1ccc(-c2nc3c(Br)ccc(Br)c3[nH]2)cc1S(=O)(=O)Cl 586926514 AYDHHPKHMGNSBT-UHFFFAOYSA-N 478.593 5.245 70 1 JKIF O=C(NC[C@H](CC1(C(F)(F)F)CC1)c1ccc(C2CC2)nc1)c1cccc(Cl)c1Cl 217365175 DRYIWTQLTCNERN-HNNXBMFYSA-N 457.323 6.512 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)ccc1Cl 586927350 LKBAEFJIJKLBFK-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF COc1ccc(Cl)cc1C#Cc1cc(S(=O)(=O)Cl)ccc1Oc1cccc(F)c1 587916064 BQPMEFRVVVFRNC-UHFFFAOYSA-N 451.302 5.607 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cccc(OC(F)(F)F)c3[nH]2)c1 586926924 SEGIOIYPKGLKGT-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF O=C(COc1ccc2ccccc2c1)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 218481271 IVTYHMYOZWIFRD-UHFFFAOYSA-N 472.535 5.431 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 586925017 KNXOUSKRMWYRGH-UHFFFAOYSA-N 459.660 5.492 70 1 JKIF COc1cc(C2=C(c3ccc(SC)cc3)C[C@@H](O[SiH2]C(C)(C)C)C2=O)cc(OC)c1OC 195279330 VBZCNETUPRITOT-LJQANCHMSA-N 472.679 5.005 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@@]2(CS(=O)(=O)Cl)CC[C@@H]3C2(C)C)c1 587364438 FBSSCFQPHPRMHM-QYBDOPJKSA-N 482.001 6.380 70 1 JKIF C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587849422 LLXJGFXGNYLBBA-FPTDNZKUSA-N 494.813 5.342 70 1 JKIF CC[C@@H](C)c1ccc2[nH]c(-c3ccc(Br)cc3)c(OS(=O)(=O)C(F)(F)F)c2c1 587642289 MPGHERKDGFLUOJ-LLVKDONJSA-N 476.314 6.339 70 1 JKIF O=S(=O)(Cl)c1c[nH]c([C@@]2(C(Cl)(Cl)Cl)NCCc3cccc(-c4ccccc4)c32)c1 962670395 QUILURGHPNWTHI-LJQANCHMSA-N 490.239 5.369 70 1 JKIF CC(C)Oc1cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2cc1Br 586925385 FDVOVECPFGACNV-UHFFFAOYSA-N 498.613 6.014 70 1 JKIF COc1cccc(-c2cc(-c3ccc(OS(=O)(=O)C(F)(F)F)cc3)nc3c2oc2ccccc23)c1 587360034 KDJRGHRFJJDRES-UHFFFAOYSA-N 499.466 6.552 70 1 JKIF O=C(NC[C@@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1cccc(Cl)c1Cl 217380168 KMYKPPPJRDAZAH-CQSZACIVSA-N 482.280 6.141 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 587850731 RUPKVZHEZMXULN-YPMLDQLKSA-N 481.214 5.357 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(OC(C)C)c(Br)cc2[nH]1 586925957 ZRFULZUXWSCBAY-UHFFFAOYSA-N 494.194 5.369 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Br)c(Br)cc3[nH]2)c1 587178241 WUNYQKRRUARASF-UHFFFAOYSA-N 468.529 5.067 70 1 JKIF COc1ccc(Cl)cc1C#Cc1ccc(-c2ccc(OS(=O)(=O)C(F)(F)F)cc2)cc1 587914584 JXVKVSVEVKUTGV-UHFFFAOYSA-N 466.864 5.644 70 1 JKIF COC(=O)c1cc(Cl)c2[nH]c(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)nc2c1 586926059 FZCHBBHMXBSSDG-UHFFFAOYSA-N 498.569 5.013 70 1 JKIF CCCC1([C@@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3Cc3cccc(OCC(=O)O)c3)c2)CCC1 144569935 LFURQAOXCGLIRL-DYEJEPNJSA-N 487.036 5.468 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c1 586926750 PFBIOXYBCIWICV-UHFFFAOYSA-N 492.075 5.731 70 1 JKIF CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359934 JUPNAKFOVSJGMV-OPJFBBAISA-N 478.969 5.024 70 1 JKIF O=S(=O)(Cl)c1ccc(/N=c2/oc(-c3ccc(Cl)cc3)cn2Cc2ccccc2)cc1 103152851 KQBFDOOXBWNUPB-YYDJUVGSSA-N 459.354 5.610 70 1 JKIF Nc1ccc(-c2ccc3nc(-c4c(Cl)ccc(S(=O)(=O)Cl)c4Cl)[nH]c3c2)cc1N 586924929 APKCXCLRGDDYLN-UHFFFAOYSA-N 467.765 5.296 70 1 JKIF Cc1cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2cc1Br 586926042 KRMZYEINHHULTF-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF Cc1cc(-c2nc3cc(Br)c(OCCC(C)C)cc3[nH]2)ccc1S(=O)(=O)Cl 586926862 AVZAYBDTZHCWTD-UHFFFAOYSA-N 471.804 5.653 70 1 JKIF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(-c2ccc(S(=O)(=O)Cl)cc2)cc1 587896511 RCHUMTUOWGQBQQ-UHFFFAOYSA-N 492.811 5.298 70 1 JKIF C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587850812 RZRNGHZEDIWTRP-FPTDNZKUSA-N 494.813 5.342 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)c1Cl 586928930 MPKXWMYHKOONGD-UHFFFAOYSA-N 474.394 6.396 70 1 JKIF O=C(O)CC(=O)C=P(O)(O)/C=C/c1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1C1CC1 169728625 ZUZJIIKQQLFQMX-OUKQBFOZSA-N 479.444 5.081 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1Cl 586927451 YIOXCGVANAQLEI-UHFFFAOYSA-N 463.733 5.561 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)c1 587177876 DJTIKFPGHKSHCX-UHFFFAOYSA-N 473.629 5.203 70 1 JKIF Cc1c(-c2ccccc2)nc(C2CC2)c(/C=C/P(O)(O)=CC(=O)CC(=O)O)c1-c1ccc(F)cc1 169728659 VFNSSXLZSSSVCF-BUHFOSPRSA-N 493.471 5.389 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(S(F)(F)(F)(F)F)cc2[nH]1 586924393 DFEUPVZEZMQXMM-UHFFFAOYSA-N 483.267 6.477 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)c1 587178099 PSXZZAARYVNFCI-UHFFFAOYSA-N 473.629 5.203 70 1 JKIF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587849423 LLXJGFXGNYLBBA-JLCFBVMHSA-N 494.813 5.342 70 1 JKIF O=C1c2ccc(O)cc2O[C@]2(CCc3cc(Cl)c(S(=O)(=O)Cl)cc32)[C@H]1c1ccc(F)cc1 587358716 FCPBGGNHWHCMCQ-GMAHTHKFSA-N 493.339 5.313 70 1 JKIF CC([C@H]1CC(=O)c2cc(C)cc(N)c2O1)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587410023 UYUOQICQBCWXOY-GDLZYMKVSA-N 465.533 5.097 70 1 JKIF CC(C)COc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586927939 LWXINMWTCXYKSZ-UHFFFAOYSA-N 478.195 5.608 70 1 JKIF Cc1ccc2c3c(c4c(nc13)-c1cc(S(=O)(=O)Cl)c(Cl)cc1C4)-c1ccccc1C2=O 587100801 AGLOXSPTJUGMHE-UHFFFAOYSA-N 466.345 5.907 70 1 JKIF O=C1c2ccccc2-c2cc(-c3cc(S(=O)(=O)Cl)ccc3Cl)nc3ccc(O)c1c23 586994462 TXDCPKUJNFOOFA-UHFFFAOYSA-N 456.306 5.400 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)cnc2[nH]1 217119753 QERVGYYPIGRNLQ-UHFFFAOYSA-N 482.462 5.541 70 1 JKIF O=C(NC[C@@H](CC1(C(F)(F)F)CC1)c1cnc(C(F)(F)F)nc1)c1ccccc1Cl 217375238 UIGGFHHHBJIJNF-LLVKDONJSA-N 451.798 5.395 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc(Oc4ccccc4)cc3[nH]2)c1 586926622 NMIKPZBBOATBAW-UHFFFAOYSA-N 498.185 6.366 70 1 JKIF N#Cc1cc(Br)c2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc2c1 586927526 ZQYPDYLPHARXBH-UHFFFAOYSA-N 465.543 5.098 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)c(Cl)cc3[nH]2)c1 586925660 AFSNZGLBFQNUAS-UHFFFAOYSA-N 474.978 5.880 70 1 JKIF CC([C@H]1CC(=O)c2ccc3c(c2O1)CCCC3)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587532558 OPRHKUOFBKWVID-JGCGQSQUSA-N 490.583 6.086 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358655 DUWAIIOCDKFUEI-GGAORHGYSA-N 495.355 5.777 70 1 JKIF O=C1c2ccccc2-c2cc(-c3ccc(OS(=O)(=O)C(F)(F)F)cc3)nc3ccc(O)c1c23 586987271 VAXAVDBRQOUVIT-UHFFFAOYSA-N 471.412 5.047 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587606008 FQZHSAJIVYQJSF-UGKGYDQZSA-N 479.337 5.240 70 1 JKIF O=S(=O)(Cl)c1c[nH]c([C@]2(C(Cl)(Cl)Cl)NCCc3cccc(-c4ccccc4)c32)c1 962670392 QUILURGHPNWTHI-IBGZPJMESA-N 490.239 5.369 70 1 JKIF CCc1ccc(-c2nc3cc(Br)c(Br)cc3[nH]2)cc1S(=O)(=O)Cl 586927235 JRUKHQDBGJGQBP-UHFFFAOYSA-N 478.593 5.245 70 1 JKIF COC(=O)c1cc2[nH]c(-c3ccc(S(=O)(=O)Cl)c(C)c3)nc2c(F)c1Nc1ccccc1 586927229 DWCPHYMRUYZMNL-UHFFFAOYSA-N 473.913 5.135 70 1 JKIF O=C1c2ccccc2-c2cc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc3ccc(O)c1c23 586994442 SFFPBSAPEBDLAR-UHFFFAOYSA-N 456.306 5.400 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)c(F)cc3[nH]2)c1 586927034 TVWVCHAHWXNHCO-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359918 JUPNAKFOVSJGMV-BWGBAMLBSA-N 478.969 5.024 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cccc(Br)c4)ccc3C)cnc2[nH]1 217123219 SGOAPURXQSXVHO-UHFFFAOYSA-N 493.361 5.285 70 1 JKIF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)N1 587848350 HZDUFWTXSSJANR-RCDICMHDSA-N 494.813 5.342 70 1 JKIF O=C1C[C@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)Oc2c1ccc1c2CCCC1 587530563 FWLDBSGAHANYKD-VWLOTQADSA-N 452.959 5.402 70 1 JKIF O=S(=O)(Cl)c1ccc(Sc2nnc(Nc3ccc(Br)cc3)s2)cc1 103272774 RJPQRFLCPWTBFG-UHFFFAOYSA-N 462.803 5.123 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(Br)cc(F)c3[nH]2)c1Cl 586926724 SYPPKXJGUHJFQV-UHFFFAOYSA-N 458.523 5.366 70 1 JKIF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1cccc(S(=O)(=O)Cl)c1 587607556 NBKFCGVCLXYBJL-ZEQKJWHPSA-N 492.936 5.225 70 1 JKIF O=C(O)CC(=O)C=P(O)(O)/C=C\c1c(-c2ccc(F)cc2)cc(-c2ccccc2)nc1C1CC1 169728624 ZUZJIIKQQLFQMX-SEYXRHQNSA-N 479.444 5.081 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 587850727 RUPKVZHEZMXULN-MGNBDDOMSA-N 481.214 5.357 70 1 JKIF Cc1ccc2c3c(c4c(nc13)[C@@]1(CS(=O)(=O)Cl)CC[C@H]4C1(C)C)-c1ccccc1C2=O 587101833 IRTQBMNGTDDYOI-NSYGIPOTSA-N 451.975 5.478 70 1 JKIF CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359922 JUPNAKFOVSJGMV-DRRUGAFGSA-N 478.969 5.024 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)c1 586926757 PLGRPOQIBFBAJZ-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF Cc1cc(-c2nc3c(C(F)(F)F)cc(Br)cc3[nH]2)ccc1S(=O)(=O)Cl 586927960 MYLGWGKHIUZQAR-UHFFFAOYSA-N 453.667 5.247 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)c1 587177801 AFUDOWPDGQOBCO-UHFFFAOYSA-N 457.630 5.323 70 1 JKIF CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728673 BNWXGYASSDBALW-BUHFOSPRSA-N 495.487 5.501 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)Cc4cccc(C(F)(F)F)c4)ccc3C)cnc2[nH]1 217119675 MHQAAPSKFBCCSS-UHFFFAOYSA-N 496.489 5.470 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(OCC(C)C)c(Br)cc3[nH]2)c1Cl 586925832 BMOKKJNGRJYAOV-UHFFFAOYSA-N 492.222 5.917 70 1 JKIF CCCCC[C@H](O)c1ccc([C@H]2[C@H](Cl)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)OC(C)C)cc1 43177264 NXZMSAVZNLOSHL-MDCHKLGYSA-N 483.520 7.687 70 1 JKIF O=C(NC[C@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1cccc(Cl)c1Cl 217380242 KMYKPPPJRDAZAH-AWEZNQCLSA-N 482.280 6.141 70 1 JKIF O=C1c2ccccc2-c2cc(-c3ccc(OS(=O)(=O)C(F)(F)F)cc3)nc3cccc1c23 587103957 OVLZHLFLZCCFCF-UHFFFAOYSA-N 455.413 5.342 70 1 JKIF C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587851315 VQJYANICRKXNOF-FPTDNZKUSA-N 494.813 5.342 70 1 JKIF C[C@]1(C=P(c2ccccc2)(c2ccccc2)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587533739 UVPLQZNNXQJWCQ-MGBGTMOVSA-N 490.583 6.086 70 1 JKIF CCCCCOc1cc2nc(-c3ccc(CC)c(S(=O)(=O)Cl)c3)[nH]c2cc1Br 586927998 VPHRJOHJCWKAEA-UHFFFAOYSA-N 485.831 6.051 70 1 JKIF CC(C)c1nc(-c2cccs2)cc(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728645 RLEKPHCEZDNCRQ-MDZDMXLPSA-N 487.489 5.389 70 1 JKIF O=C1C[C@@H](C=P(c2ccccc2)(c2ccccc2)c2ccccc2)Oc2c1ccc1c2CCCC1 587530607 GAIKAKQCTFGILD-VWLOTQADSA-N 476.556 5.696 70 1 JKIF CC(C)c1nc(-c2ccccc2)cc(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728649 XZQKIIGUJLQTQC-SEYXRHQNSA-N 481.460 5.327 70 1 JKIF N#Cc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2cc1C(F)(F)F 586926548 MCCVICQCJBKQCL-UHFFFAOYSA-N 499.095 5.464 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)c1Cl 586927491 YZTFPEAFHHRJBP-UHFFFAOYSA-N 464.079 6.136 70 1 JKIF CCc1nc(-c2ccccc2)c(C)c(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728628 GVINGYGKIBHQDN-YPKPFQOOSA-N 481.460 5.074 70 1 JKIF O=C1c2ccc(O)cc2O[C@@]2(CCCc3ccc(S(=O)(=O)Cl)cc32)[C@@H]1c1ccc(F)cc1 587360068 LHWUOZXJYOVNTL-ISKFKSNPSA-N 472.921 5.050 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(O)c(C(F)(F)F)c4)ccc3C)cnc2[nH]1 217123236 XFRUZDJTDSYIPM-UHFFFAOYSA-N 498.461 5.247 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)ccc1Cl 586926687 CZPFTAZBSMDXBM-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF Cc1cc(-c2nc3c(OC(F)(F)F)cc(Br)cc3[nH]2)ccc1S(=O)(=O)Cl 586928184 QXFJQNUOXCUAPA-UHFFFAOYSA-N 469.666 5.127 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587606005 FQZHSAJIVYQJSF-DENIHFKCSA-N 479.337 5.240 70 1 JKIF Cc1cc(Br)cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c12 586927374 XPSWQBUBHSUTFA-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF COC(=O)c1ccc(Oc2ccc3nc(-c4ccc(Cl)c(S(=O)(=O)Cl)c4)[nH]c3c2)cc1 586927812 RZDLFDCIKPXTOJ-UHFFFAOYSA-N 477.325 5.390 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cccc(C(F)(F)F)c3[nH]2)c1 586926659 NRPIAGTWJAIHRM-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF CCCCOc1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2cc1Br 587178054 NQNUCNJKKYOLOW-UHFFFAOYSA-N 461.740 5.483 70 1 JKIF Cc1c(Br)ccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 586924969 AXXJASUGVSZXIZ-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(Br)ccc(Br)c3[nH]2)c1Cl 586927059 UIGITHAPJVNKDF-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF Cc1c(S(=O)(=O)Cl)sc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc12 587895260 DTFBMGAPEZAWBB-UHFFFAOYSA-N 486.829 5.154 70 1 JKIF O=[N+]([O-])c1nccn1CCC[Si](F)(c1cccc2ccccc12)c1cccc2ccccc12 205835968 QUOQEZIZMGAILQ-UHFFFAOYSA-N 455.565 5.217 70 1 JKIF Cc1cc(-c2cc(-c3ccccc3)nc(C(C)C)c2/C=C\P(O)(O)=CC(=O)CC(=O)O)ccc1F 169728642 VEYGKWZPHSGXDA-QXMHVHEDSA-N 495.487 5.635 70 1 JKIF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ccccc1S(=O)(=O)Cl 587608668 ROWIORPEVSEBOL-ZEQKJWHPSA-N 492.936 5.225 70 1 JKIF CC(C)(C)c1ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2c1 586927256 VQISGDNSRFVXQS-UHFFFAOYSA-N 462.196 5.871 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1Cl 586927395 XPVCLBYSUHRWNA-UHFFFAOYSA-N 461.757 6.771 70 1 JKIF CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359945 JUPNAKFOVSJGMV-YSCRXONVSA-N 478.969 5.024 70 1 JKIF CC[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)N1 962938979 AZJZRBXCYOZJNN-KPZWWZAWSA-N 458.889 5.063 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 586925268 NNGRXEWLGJUCSM-UHFFFAOYSA-N 459.660 5.492 70 1 JKIF Cc1cc(-c2nc3cc(Br)c(OCC(C)C)cc3[nH]2)ccc1S(=O)(=O)Cl 586927636 IFNZBEJZPBQEBG-UHFFFAOYSA-N 457.777 5.263 70 1 JKIF COc1cccc(-c2cc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc3c2oc2ccccc23)c1 587364387 CXTKGGVYTHFYDO-UHFFFAOYSA-N 484.360 6.905 70 1 JKIF CN(C)Cc1ccc(-c2c(-c3cccc(OC(F)(F)F)c3)cc3n2[C@@H](CCCl)CNC3=O)cc1 143148342 MEQUDKNTYPMAEZ-IBGZPJMESA-N 491.941 5.696 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(OC(C)C)c(Br)cc3[nH]2)c1Cl 586926543 LZNBDEONWDXINB-UHFFFAOYSA-N 478.195 5.669 70 1 JKIF CC(C)OC(=O)CCC/C=C\C[C@@H]1[C@@H](c2ccc([C@@H](O)C3CCCCC3)cc2)[C@H](O)C[C@H]1Cl 137010048 MJSOWZQIYLGSHR-GESNTHCBSA-N 477.085 6.440 70 1 JKIF Cc1cc(-c2nc3cc(Br)c(C(F)(F)F)cc3[nH]2)ccc1S(=O)(=O)Cl 586928239 RWCJPMPWFSSDFH-UHFFFAOYSA-N 453.667 5.247 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1Cl 586925094 CFSIMIHIXFIUNI-UHFFFAOYSA-N 463.733 5.561 70 1 JKIF CC(C)c1nc2c(c(-c3ccc(F)cc3)c1/C=C/P(O)(O)=CC(=O)CC(=O)O)Cc1ccccc1-2 169728676 IIZZKIRFLVXSKX-VAWYXSNFSA-N 493.471 5.231 70 1 JKIF CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359927 JUPNAKFOVSJGMV-LPYGUSEBSA-N 478.969 5.024 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(Oc4ccccc4)cc3[nH]2)c1Cl 586926697 SSUUTMXVDQZCJM-UHFFFAOYSA-N 453.734 6.257 70 1 JKIF O=C(NC[C@@H](CC1(C(F)F)CC1)c1ccc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217365843 UGWHWRGXVZKSKE-GFCCVEGCSA-N 467.265 6.356 70 1 JKIF O=C(c1cccc(C(F)(F)F)c1Cl)N1[C@H]2CC[C@@H]1c1nnc(-c3ccc(Cl)s3)n1C2 217349676 PJMVTHMVIKAXFS-JOYOIKCWSA-N 473.307 5.692 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c1 586926156 IASSCIOXISPUQY-UHFFFAOYSA-N 492.075 5.731 70 1 JKIF CN(C(=O)c1ccccc1)[C@H]1C[C@@]23CCN(CC4CC4)[C@H]4CC[C@@H]1C[C@]42Cc1ccc(O)cc13 216854024 SUAHKVANOLNHNZ-YPJSVLOBSA-N 456.630 5.001 70 1 JKIF O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(-c2cccs2)cc1 73294951 GTAJKXZJYWUXMB-UHFFFAOYSA-N 462.554 6.394 70 1 JKIF Cc1cc(-c2nc3c(Br)cc(C(F)(F)F)cc3[nH]2)ccc1S(=O)(=O)Cl 586928241 RYUSRLYZJNUSRR-UHFFFAOYSA-N 453.667 5.247 70 1 JKIF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587851317 VQJYANICRKXNOF-PEBXRYMYSA-N 494.813 5.342 70 1 JKIF Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Br)c(Br)cc3[nH]2)c1Cl 586926272 JOJUYJZZHVFAMW-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF CCC([C@@H]1N[C@H](C(=O)O)Cc2cccc(F)c21)=P(c1ccccc1)(c1ccccc1)c1ccccc1 962917285 FSRZXZYBLYQKNK-FIBWVYCGSA-N 497.550 5.042 70 1 JKIF O=C1c2ccc(O)cc2O[C@]2(CCCc3ccc(S(=O)(=O)Cl)cc32)[C@H]1c1ccc(F)cc1 587360072 LHWUOZXJYOVNTL-UPVQGACJSA-N 472.921 5.050 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(OCc3ccccc3)cc2[nH]1 586924273 AALHSNWCQQEXML-UHFFFAOYSA-N 463.342 5.398 70 1 JKIF Cc1cc(=O)oc2cc(-c3ccc(C(F)(F)F)cc3)c(OS(=O)(=O)C(F)(F)F)cc12 1772576114 LBGVQJZWGXLVAS-UHFFFAOYSA-N 452.328 5.016 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(C)c(C(F)(F)F)c4)ccc3C)cnc2[nH]1 217125735 JTRZIHVDZUAZRZ-UHFFFAOYSA-N 496.489 5.850 70 1 JKIF Cc1cc(-c2cc(-c3ccccc3)nc(C(C)C)c2/C=C/P(O)(O)=CC(=O)CC(=O)O)ccc1F 169728643 VEYGKWZPHSGXDA-VAWYXSNFSA-N 495.487 5.635 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)c1 586927376 XTJHNHKRLUQTLU-UHFFFAOYSA-N 478.048 5.130 70 1 JKIF CC[C@]1(c2cccc(S(=O)(=O)Cl)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358059 ARWWQLSXGCJXNQ-FYYLOGMGSA-N 460.910 5.123 70 1 JKIF C[C@@]1(c2cc(S(=O)(=O)Cl)ccc2Cl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587358361 CUXGFMSIDWUXMJ-IRLDBZIGSA-N 481.328 5.387 70 1 JKIF Cc1cc(Br)c2[nH]c(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)nc2c1 586927024 SZMAHXCSZTUJJF-UHFFFAOYSA-N 499.011 5.644 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3c(Br)ccc(Br)c3[nH]2)c1 587177915 GRMZYHAHQGWELL-UHFFFAOYSA-N 468.529 5.067 70 1 JKIF CCCOc1cc2nc(-c3cc(Cl)c(S(=O)(=O)Cl)cc3OC)[nH]c2cc1Br 586924353 CGDPBMANXDMYHE-UHFFFAOYSA-N 494.194 5.371 70 1 JKIF CC(C)c1nc(-c2ccccc2)c(F)c(-c2ccc(F)cc2)c1/C=C\P(O)(O)=CC(=O)CC(=O)O 169728640 QPLHXKDWQNPOQG-SEYXRHQNSA-N 499.450 5.466 70 1 JKIF CC(C)(C)c1cccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c12 586927371 XPBFVRBYCDGJNE-UHFFFAOYSA-N 462.196 5.871 70 1 JKIF CC[C@@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 587849766 NQGFXQAPTXOJLS-MGNBDDOMSA-N 481.214 5.357 70 1 JKIF O=C(NC[C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217376902 VZSUYFNLHSYMGI-INIZCTEOSA-N 457.254 6.108 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)ccc1Cl 586926615 BRIYTEBQYTZYOY-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(OCc4ccccc4)cc3[nH]2)c1Cl 586926074 LPLMVKQIWCFNDG-UHFFFAOYSA-N 467.761 6.043 70 1 JKIF C[C@]1(c2ccc(OS(=O)(=O)C(F)(F)F)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587329492 LCQJOTBVNPIXBM-RBBKRZOGSA-N 496.434 5.034 70 1 JKIF CC([C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587532559 OPRHKUOFBKWVID-YTTGMZPUSA-N 490.583 6.086 70 1 JKIF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587850813 RZRNGHZEDIWTRP-JLCFBVMHSA-N 494.813 5.342 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)ccc1Cl 586926431 AERCQLROSCWRHT-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF Cc1c(-c2ccccc2)nc(C(C)C)c(CCP(O)(O)=CC(=O)CC(=O)O)c1-c1ccc(F)cc1 169728660 SNWAYQAIOURTOK-UHFFFAOYSA-N 497.503 5.207 70 1 JKIF O=C(NCC1(c2cnc(C(F)(F)F)nc2)CCC(F)(F)CC1)c1cccc(Cl)c1Cl 217372669 YUZMKQKVLJEEJJ-UHFFFAOYSA-N 468.253 5.679 70 1 JKIF Cc1c(-c2ccccc2)nc(C(C)C)c(/C=C\P(O)(O)=CC(=O)CC(=O)O)c1-c1ccc(F)cc1 169728663 VFVKSJKKLTZCMS-YPKPFQOOSA-N 495.487 5.635 70 1 JKIF COc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2cc1Cl 586927549 ZVCQAVZUNSHXGS-UHFFFAOYSA-N 470.559 5.235 70 1 JKIF CC[C@]1(c2ccc(Cl)c(S(=O)(=O)Cl)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 587850730 RUPKVZHEZMXULN-XTZNXHDOSA-N 481.214 5.357 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(Br)cc(Cl)c2[nH]1 586924362 CPEYTYBAOADKFS-UHFFFAOYSA-N 470.559 5.235 70 1 JKIF Cc1ccccc1-c1cc(-c2ccc(F)cc2)c(/C=C\P(O)(O)=CC(=O)CC(=O)O)c(C(C)C)n1 169728656 UFPAWXQZRXBTSO-SEYXRHQNSA-N 495.487 5.635 70 1 JKIF O=S(=O)(Cl)c1cc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)ccc1Cl 586927638 PRMJTHWGNIDYND-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF N#Cc1cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2cc1C(F)(F)F 586924867 AGWOZOXBOHOLLZ-UHFFFAOYSA-N 454.644 5.355 70 1 JKIF COc1cccc(-c2cc(-c3cc(S(=O)(=O)Cl)ccc3C)nc3c2oc2ccccc23)c1 587365503 MVITVQAMWPWFKU-UHFFFAOYSA-N 463.942 6.560 70 1 JKIF COc1ccc([C@@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1S(=O)(=O)Cl 587530731 GTUHROMUSBPWBB-SANMLTNESA-N 482.985 5.411 70 1 JKIF O=S(=O)(F)CCNc1ccccc1Oc1cccc(-c2c(O)nc3cc(Cl)ccc3c2O)c1 36294541 RFXVWSJEAZEHDH-UHFFFAOYSA-N 488.924 5.470 70 1 JKIF CC(C)c1nc(C2CCCCC2)cc(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728617 RMENOMGRKFCHNM-OUKQBFOZSA-N 487.508 5.708 70 1 JKIF CCCCOc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(C)c3Cl)[nH]c2cc1Br 586926019 DPJHNQGFHOSMDA-UHFFFAOYSA-N 492.222 6.061 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cc(Cl)cc(Br)c3[nH]2)c1Cl 586926057 LCWIEYIETIPGCR-UHFFFAOYSA-N 474.978 5.880 70 1 JKIF CSc1ccc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2c1 586926541 LZLUDLXUEXXQBQ-UHFFFAOYSA-N 452.182 5.295 70 1 JKIF O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(Cl)c(S(=O)(=O)Cl)cc32)[C@H]1c1ccc(F)cc1 587358720 FCPBGGNHWHCMCQ-JTHBVZDNSA-N 493.339 5.313 70 1 JKIF CCCCC[C@@H](O)c1ccc([C@H]2[C@H](Cl)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)OC(C)C)cc1 43177266 NXZMSAVZNLOSHL-KZGLXXRISA-N 483.520 7.687 70 1 JKIF Cc1ccccc1-c1cc(-c2ccc(F)cc2)c(/C=C/P(O)(O)=CC(=O)CC(=O)O)c(C(C)C)n1 169728657 UFPAWXQZRXBTSO-OUKQBFOZSA-N 495.487 5.635 70 1 JKIF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587850815 RZRNGHZEDIWTRP-RCDICMHDSA-N 494.813 5.342 70 1 JKIF COc1ccc(Cl)cc1C#Cc1cc(S(=O)(=O)Cl)ccc1Oc1ccc(F)cc1 587916969 UVRPQWBDLOJTFX-UHFFFAOYSA-N 451.302 5.607 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc5[nH]ccc5c4)ccc3C)cnc2[nH]1 217031684 QEACCOSLYWQSQM-UHFFFAOYSA-N 453.502 5.004 70 1 JKIF CC(C)Oc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586928160 QMOQIIQIERWKOA-UHFFFAOYSA-N 464.168 5.361 70 1 JKIF COc1ccc([C@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1S(=O)(=O)Cl 587530712 GTUHROMUSBPWBB-AREMUKBSSA-N 482.985 5.411 70 1 JKIF CCCCCC(=O)c1ccc([C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)OC(C)C)cc1 43177353 LRGSWBVGKXFEFN-ZQPQKCKDSA-N 463.058 6.590 70 1 JKIF COC(=O)c1ccc(Oc2ccc3nc(-c4cc(S(=O)(=O)F)ccc4Cl)[nH]c3c2)cc1 587179800 AEQPHMHBGFVTAI-UHFFFAOYSA-N 460.870 5.120 70 1 JKIF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ccccc1S(=O)(=O)Cl 587608665 ROWIORPEVSEBOL-BVAGGSTKSA-N 492.936 5.225 70 1 JKIF CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359943 JUPNAKFOVSJGMV-STWMFMCASA-N 478.969 5.024 70 1 JKIF CCCc1c(O)ccc2c1O[C@](C)(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)CC2=O 587481276 AQBHDKOBDWKHEW-YTTGMZPUSA-N 494.571 5.865 70 1 JKIF O=C(NC[C@@H](CC1(C(F)(F)F)CC1)c1ccc(C2CC2)nc1)c1cccc(Cl)c1Cl 217365096 DRYIWTQLTCNERN-OAHLLOKOSA-N 457.323 6.512 70 1 JKIF O=C1C[C@](c2ccccc2)(c2cccc(S(=O)(=O)Cl)c2)Oc2c1ccc1c2CCCC1 587531180 IZWCVLZKTPCQLG-VWLOTQADSA-N 452.959 5.402 70 1 JKIF Cc1ccc2c3c(cc(-c4ccc(Cl)c(S(=O)(=O)Cl)c4)nc13)-c1ccccc1C2=O 587102397 PAMLVICBKHSDLQ-UHFFFAOYSA-N 454.334 6.003 70 1 JKIF CCCC1([C@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3Cc3cccc(OCC(=O)O)c3)c2)CCC1 137015384 LFURQAOXCGLIRL-KZDJQDIGSA-N 487.036 5.468 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc4ccccc4cc3[nH]2)c1 586926014 DMJQVUUUGHEZHS-UHFFFAOYSA-N 456.148 5.727 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 586924337 BKKVSYBJSYDHSR-UHFFFAOYSA-N 475.659 5.371 70 1 JKIF COC(=O)c1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2c(F)c1Nc1ccccc1 586928102 PVTZVQDRAQBIOI-UHFFFAOYSA-N 494.331 5.480 70 1 JKIF NS(=O)(=O)C[C@H](CC(=O)Nc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1)c1ccccc1 217078152 DMSCAHDPEYGXKR-INIZCTEOSA-N 479.385 5.187 70 1 JKIF NS(=O)(=O)C[C@@H](CC(=O)Nc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1)c1ccccc1 217078180 DMSCAHDPEYGXKR-MRXNPFEDSA-N 479.385 5.187 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(Sc3ccccc3)cc2[nH]1 586928300 VDHQESOWOACHCE-UHFFFAOYSA-N 465.383 5.971 70 1 JKIF CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)Cl)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587359931 JUPNAKFOVSJGMV-NWACYDSMSA-N 478.969 5.024 70 1 JKIF CCc1ccc(-c2nc3ccc(-c4nnc(-c5ccc(OC)cc5)o4)cc3[nH]2)cc1S(=O)(=O)Cl 586927001 ICWIWRCSSMHNIT-UHFFFAOYSA-N 494.960 5.445 70 1 JKIF COC(=O)c1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2c(F)c1Nc1ccccc1 587177856 CLWUFPPPKHPAMA-UHFFFAOYSA-N 477.876 5.211 70 1 JKIF CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359923 JUPNAKFOVSJGMV-KSVBPBMVSA-N 478.969 5.024 70 1 JKIF Cc1cc(N)c2c(c1)C(=O)C[C@](C=P(c1ccccc1)(c1ccccc1)c1ccccc1)(CCl)O2 587407886 JPDWENRMUIAHSL-SSEXGKCCSA-N 499.978 5.316 70 1 JKIF O=C(NCC1(c2ccc(F)nc2)CCC(F)(F)CC1)c1cc(C(F)(F)F)ccc1Cl 217360287 ICYAYECZGNGCKB-UHFFFAOYSA-N 450.810 5.770 70 1 JKIF O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ccc(I)cc3[nH]2)c1Cl 586926737 UQUNRRVQTNZBIE-UHFFFAOYSA-N 487.533 5.069 70 1 JKIF O=C1c2ccccc2-c2c3c(nc4cccc1c24)-c1cc(S(=O)(=O)Cl)c(Cl)cc1C3 587208561 BTDMJDQYQFTIIR-UHFFFAOYSA-N 452.318 5.598 70 1 JKIF CCCC1([C@H](O)c2cccc([C@H]3[C@H](O)C[C@@H](Cl)[C@@H]3CCCCCCC(=O)O)c2)CCC1 137010293 QJVZVQODDFMWMY-FSHOYSFVSA-N 451.047 6.187 70 1 JKIF Cc1c(-c2ccc(Cl)c(S(=O)(=O)Cl)c2)nc2ccc(O)c3c2c1-c1ccccc1C3=O 586992990 COVZGALUOHWJOX-UHFFFAOYSA-N 470.333 5.708 70 1 JKIF O=C1c2ccc(O)cc2O[C@@]2(CCCc3ccc(S(=O)(=O)Cl)cc32)[C@H]1c1ccc(F)cc1 587360070 LHWUOZXJYOVNTL-LADGPHEKSA-N 472.921 5.050 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cccc(C(C)C)c4)ccc3C)cnc2[nH]1 217125807 KNFWJQMNWXDXIY-UHFFFAOYSA-N 456.546 5.646 70 1 JKIF O=C(NC[C@H](c1ccc(F)cc1)c1cnc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl 217378904 IGFZEMQKBHZFBX-OAHLLOKOSA-N 458.242 5.503 70 1 JKIF CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)Cl)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587359925 JUPNAKFOVSJGMV-LLUPRIMMSA-N 478.969 5.024 70 1 JKIF CCC([C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587450167 RSWQYZXMTHNDTA-WXGMZPBLSA-N 492.555 5.388 70 1 JKIF Cc1cc(-c2nc3c(Br)cc(OC(F)(F)F)cc3[nH]2)ccc1S(=O)(=O)Cl 586928231 RTQSZQNNDWKPGW-UHFFFAOYSA-N 469.666 5.127 70 1 JKIF COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cccc(OC(F)(F)F)c4)ccc3C)cnc2[nH]1 217031457 LCUOOAZVWAYHDC-UHFFFAOYSA-N 498.461 5.421 70 1 JKIF COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(Cl)cc(Br)c2[nH]1 586924596 GIALFOZUJBFTLJ-UHFFFAOYSA-N 470.559 5.235 70 1 JKIF CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1cccc(S(=O)(=O)Cl)c1)CC2=O 587489670 VKNYMZNQRWRBGO-DEOSSOPVSA-N 456.947 5.181 70 1 JKIF O=C(NCCCl)NCCCN1c2nc3ccccc3cc2Sc2cc3ccccc3nc21 143748473 NJASXENAYFDUMK-UHFFFAOYSA-N 463.994 5.314 70 1 JKIF Cc1cc(-c2nc3c(C(=O)Nc4ccc(C(F)(F)F)cc4)cccc3[nH]2)ccc1S(=O)(=O)Cl 586927486 FSSMIKSCEXVOKY-UHFFFAOYSA-N 493.894 5.737 70 1 JKIF O=C(NC[C@H](CC1(C(F)(F)F)CC1)c1cnc(C(F)(F)F)nc1)c1ccccc1Cl 217375302 UIGGFHHHBJIJNF-NSHDSACASA-N 451.798 5.395 70 1 JKIF CCc1ccc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)cc1S(=O)(=O)Cl 586926608 BOTWOGLXPQNHAU-UHFFFAOYSA-N 467.694 5.501 70 1 JKIF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@]2(CS(=O)(=O)Cl)CC[C@H]3C2(C)C)c1 587364439 FBSSCFQPHPRMHM-WXTAPIANSA-N 482.001 6.380 70 1 JKIF O=S(=O)(Cl)c1cc(Br)c(Cl)c(-c2nc3cc(Cl)cc(Cl)c3[nH]2)c1 586926474 LCPBBIKMYLTOHI-UHFFFAOYSA-N 474.978 5.880 70 1 JKIF CC[C@]1(c2cccc(S(=O)(=O)Cl)c2)c2ccc3c(c2CCN1C(=O)OC(C)(C)C)NCCC3 961775064 IGCDSQGDQZPQNO-VWLOTQADSA-N 491.053 5.419 70 1 JKIF CCCOc1cc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2cc1Br 586926489 PVQFWJBWFGGTJV-UHFFFAOYSA-N 498.613 6.016 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3ccc(S(F)(F)(F)(F)F)cc3[nH]2)cc1Cl 586928061 OVYXBWIUIFUKBT-UHFFFAOYSA-N 453.241 6.468 70 1 JKIF O=C1C[C@@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)Oc2c1ccc1c2CCCC1 587530557 FWLDBSGAHANYKD-RUZDIDTESA-N 452.959 5.402 70 1 JKIF CC(C)c1nc(-c2ccccc2)cc(-c2ccc(F)cc2)c1/C=C/P(O)(O)=CC(=O)CC(=O)O 169728650 XZQKIIGUJLQTQC-OUKQBFOZSA-N 481.460 5.327 70 1 JKIF Cc1cc(-c2nc3cc(Br)c(OCc4ccccc4)cc3[nH]2)ccc1S(=O)(=O)Cl 586928313 WGFYCPMPZALHOB-UHFFFAOYSA-N 491.794 5.807 70 1 JKIF O=C(NC[C@@H](c1cnc(C(F)(F)F)nc1)C1CCC(F)(F)CC1)c1c(F)cccc1Cl 217380354 BBABFHCUJHALBA-CYBMUJFWSA-N 465.825 5.627 70 1 JKIF [C-]#[N+]c1ccc(N2C(=O)C(CCl)(CCl)N(c3ccc(C)cc3)C2=S)cc1C(F)(F)F 167536168 JZGWWSIIAWHGJH-UHFFFAOYSA-N 472.319 5.919 70 1 JKIF CCC([C@@H]1CC(=O)c2cc(C)cc(N)c2O1)=P(c1ccccc1)(c1ccccc1)c1ccccc1 587410261 WOEUDRSKUVGNNN-LJAQVGFWSA-N 479.560 5.488 70 1 JKIF COc1ccc(-c2ccc(C(=O)C=P(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1 73275750 ARWKQPBEKVXBTR-UHFFFAOYSA-N 486.551 6.341 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)cc1Cl 586928302 VGZZVHLYQGYYHF-UHFFFAOYSA-N 474.085 5.592 70 1 JKIF Cc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(Br)c3Cl)[nH]c2cc1Cl 586927005 STMPYCRFFGQLFM-UHFFFAOYSA-N 454.560 5.535 70 1 JKIF CCc1ccc(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)cc1S(=O)(=O)Cl 586928140 ZZFIONFLCFRUES-UHFFFAOYSA-N 453.976 5.997 70 1 JKIF COC(=O)c1ccc(Oc2ccc3nc(-c4cc(S(=O)(=O)Cl)cc(C)c4Cl)[nH]c3c2)cc1 586928599 FKBSNGKAMJOSME-UHFFFAOYSA-N 491.352 5.698 70 1 JKIF CCc1ccc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)cc1S(=O)(=O)Cl 586927853 SQCDOCVWOIYLAW-UHFFFAOYSA-N 467.694 5.501 70 1 JKIF O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)c1 587177960 JBSODNSHRDDOFB-UHFFFAOYSA-N 457.630 5.323 70 1 JKIF O=C(Nc1ccc(C(F)(F)F)cc1)c1cccc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c12 587178150 SDABYPGPHOMVNH-UHFFFAOYSA-N 497.857 5.813 70 1 JKIF CC(C)[C@]1(c2ccc(S(=O)(=O)Cl)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587361221 SNEZTDWUSRRUGW-ISKFKSNPSA-N 474.937 5.369 70 1 JKIF CCCN1[C@H](C)Cc2ccccc2[C@]1(c1cc(S(=O)(=O)Cl)c[nH]1)C(Cl)(Cl)Cl 963244332 WCILIXZQUNTJDX-PXAZEXFGSA-N 470.249 5.213 70 1 JKIF O=S(=O)(Cl)c1ccc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)cc1Cl 586927682 ISPKCJWNBIEUNW-UHFFFAOYSA-N 490.084 5.472 70 1 JKIF CCCCOc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cc1Br 586926782 ABVONOBEMBVAOS-UHFFFAOYSA-N 478.195 5.752 70 1 JKIF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ccccc2S(=O)(=O)Cl)N1 587851316 VQJYANICRKXNOF-JLCFBVMHSA-N 494.813 5.342 70 1 JKIF