smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C=CC[Si](Cl)(Cl)CCCCCC 195893774 NEOYJEJPABKFQO-UHFFFAOYSA-N 225.235 4.673 70 10 BJIE ClCCCc1ccc(C2CCCCC2)cc1 147099608 KTHJXUHYHJHJSE-UHFFFAOYSA-N 236.786 4.906 70 10 BJIE CC(C)C[C@@H](N[C@H]1CCC[C@@H]1C)c1ccccc1 218210920 OIFLEBZDVFQJDM-BHYGNILZSA-N 245.410 4.552 70 10 BJIE CCCN[C@H]1CC[C@@H](CCC)C[C@@H]1CC(C)C 217734434 GDVOUUOJMOQUFK-PMPSAXMXSA-N 239.447 4.617 70 10 BJIE CCCC[C@H](CC)C[C@@H](O)[C@@H]1CCC[C@@H](C)C1 217913718 SXFSOMOWMLSHHM-QKPAOTATSA-N 240.431 4.780 70 10 BJIE BrCCCC1CCCCCCC1 164177328 JMPIGFZNKGZZFK-UHFFFAOYSA-N 233.193 4.522 70 10 BJIE Cc1ccc(CC[Si](C)(C)Cl)cc1Cl 247878170 PPNQGROQMMZACX-UHFFFAOYSA-N 247.241 4.635 70 10 BJIE CC(C)c1ccc([C@@H](C)N[C@H]2CCC[C@@H]2C)cc1 218212360 DBRHGAXWTMDCIT-VBQJREDUSA-N 245.410 4.649 70 10 BJIE F[B-](F)(F)CC1CCC(CC(F)(F)F)CC1 380914689 QILNYLDPFGPRIW-UHFFFAOYSA-N 247.011 4.593 70 10 BJIE CC[C@@H](C)c1ccc(N[C@@H]2C[C@@H]3CC=C[C@H]32)cc1 218059897 MZJFTGGZGNKDEF-JWZBEHFJSA-N 241.378 4.577 70 10 BJIE F[B-](F)(F)[C@H]1C[C@@H]1c1ccc2ccccc2c1 1984462230 LYQVDVUZGBNGFK-OLZOCXBDSA-N 235.037 4.545 70 10 BJIE CC(C)c1ccc(CCl)cc1C(F)(F)F 149848570 QKVXYRZCRWGPDP-UHFFFAOYSA-N 236.664 4.568 70 10 BJIE CC(C)(C1CCCCC1)[C@@H]1C[C@@H]1[B-](F)(F)F 1975304702 VCZKZBYZLTWXRE-MNOVXSKESA-N 233.106 4.830 70 10 BJIE CC(=C[B-](F)(F)F)[C@H]1CCCC(C)(C)C1 1956660718 SYNHPNSUOLNEIB-JTQLQIEISA-N 219.079 4.536 70 10 BJIE CCCN[C@@H](CCC(C)C)[C@@H]1CCC[C@@H](C)C1 218020176 DZQOMFOEZDPLOW-OAGGEKHMSA-N 239.447 4.617 70 10 BJIE CC(C)C1CCC([C@H]2C[C@@H]2[B-](F)(F)F)CC1 1975303704 MQQARFZOJIZUPT-HCWSGVFWSA-N 233.106 4.686 70 10 BJIE CCCc1ccccc1[C@@H]1CCCC[C@@H]1Cl 167551778 RNYKXZXZJMVSJT-GJZGRUSLSA-N 236.786 4.904 70 10 BJIE CC(C)c1ccccc1[C@H]1C[C@H]1[B-](F)(F)F 1975299999 XMJVOMHEFXTURK-VXGBXAGGSA-N 227.058 4.515 70 10 BJIE CCCCCC(Cl)(CCCCC)N=O 218020274 NJPZWEFRGJWFOQ-UHFFFAOYSA-N 219.756 4.849 70 10 BJIE C=CCCCc1ccc(/C=C\[B-](F)(F)F)cc1 309627019 OGENTRYQRLIGQC-KHPPLWFESA-N 239.069 4.595 70 10 BJIE CCCC[C@H](CC)C[C@H]1C[C@@H](CC)CC[C@@H]1N 217637823 HGVJLRNLOSPHNX-VGWMRTNUSA-N 239.447 4.747 70 10 BJIE CC(C)[C@H](c1ccccc1)[C@@H]1C[C@@H]1[B-](F)(F)F 1984462384 NXRHXFBWWFUDCX-FRRDWIJNSA-N 241.085 4.664 70 10 BJIE CC(C)C1CCC([C@H]2C[C@H]2[B-](F)(F)F)CC1 1975303705 MQQARFZOJIZUPT-KIDURHIOSA-N 233.106 4.686 70 10 BJIE Cc1ccc(N)c(-c2c(C)ccc3ccccc23)c1 160954802 TTZKJSAQEZCMFY-UHFFFAOYSA-N 247.341 4.706 70 10 BJIE ClC(Cl)c1cccc(C(Cl)Cl)c1 113612944 PLHFWLGJQRLDMI-UHFFFAOYSA-N 243.948 4.639 70 10 BJIE C[C@@H](Oc1ccccc1CCl)c1ccccc1 20436097 MBMQTQALIMPMFA-GFCCVEGCSA-N 246.737 4.565 70 10 BJIE CCC[C@@H](CC)N[C@H]1C[C@@H](C)CC[C@@H]1C(C)C 218177395 VGUAGRAPIZFOJS-JJXSEGSLSA-N 239.447 4.616 70 10 BJIE F[B-](F)(F)C=C1CCCC2(CCCCC2)C1 1958188944 KAASHYNVPZBXTI-UHFFFAOYSA-N 231.090 4.824 70 10 BJIE CC(C)(C)Cc1ccc(/C=C/[B-](F)(F)F)cc1 309619779 WRALGOSMJLFARJ-CMDGGOBGSA-N 241.085 4.675 70 10 BJIE CCC[C@H](CC)N[C@H]1C[C@@H](C)CC[C@@H]1C(C)C 218177469 VGUAGRAPIZFOJS-JONQDZQNSA-N 239.447 4.616 70 10 BJIE CCC[C@H]1CC[C@H](CN)[C@@H](CCC(C)(C)C)C1 218718366 QMXNIFSDABNIQO-SOUVJXGZSA-N 239.447 4.604 70 10 BJIE CCC[C@H](C)C[C@H]1C[C@@H](CC)CC[C@@H]1NCC 217661106 IYXZHZBPFDBHTQ-VGWMRTNUSA-N 239.447 4.617 70 10 BJIE CCCCCC[C@@H](NCC)[C@H]1CCC[C@@H](C)C1 218004868 QXSVLTVKVQXRSE-OWCLPIDISA-N 239.447 4.761 70 10 BJIE CC(C)(C=C[B-](F)(F)F)C1CCCCC1 1912975106 BZBIIGMTPLRZTD-UHFFFAOYSA-N 219.079 4.536 70 10 BJIE CCC[C@@H](C)C[C@H]1C[C@@H](CC)CC[C@@H]1NCC 217661017 IYXZHZBPFDBHTQ-UGUYLWEFSA-N 239.447 4.617 70 10 BJIE CC(C)(C)c1ccc([C@@H]2C[C@@H]2[B-](F)(F)F)cc1 1984462093 KJAXTNXBQNEJNB-RYUDHWBXSA-N 241.085 4.689 70 10 BJIE Cc1ccc(C)c(O[C@H]2CC[C@@H](C)[C@@H](C)C2)c1 217798252 WRJKGDQKJCWFAM-SNPRPXQTSA-N 232.367 4.507 70 10 BJIE CCC1(CCCCCBr)CCC1 147998489 ZFGRUXCSKPJJOE-UHFFFAOYSA-N 233.193 4.522 70 10 BJIE CC[C@H](C)[C@@H](C)Nc1cccc(O[C@H](C)CC)c1 218182785 IHDHCRIBJLNOIF-BFHYXJOUSA-N 249.398 4.710 70 10 BJIE CCCc1ccccc1[C@@H]1CCCC[C@H]1Cl 167551987 RNYKXZXZJMVSJT-LSDHHAIUSA-N 236.786 4.904 70 10 BJIE Cc1ccccc1N[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C 218079820 BECITGTUVUKTAO-JLJPHGGASA-N 243.394 4.622 70 10 BJIE CC[C@@H](N[C@H]1CCC[C@@H](C)C1)C1CCCCC1 218188404 IIGWWXHXTGGNDD-VNQPRFMTSA-N 237.431 4.514 70 10 BJIE F[B-](F)(F)/C=C/c1ccccc1-c1ccccc1 2009403643 FAPNZORALZHPIR-ZHACJKMWSA-N 247.048 4.753 70 10 BJIE Cc1ccc(C)n1CCCCCCC(C)C 217972211 ZVWISUSEGIXQQF-UHFFFAOYSA-N 221.388 4.711 70 10 BJIE CC(C)(C)Cc1ccccc1/C=C/[B-](F)(F)F 390758741 YDWAXDBWQDPHJB-CMDGGOBGSA-N 241.085 4.675 70 10 BJIE CCN[C@@H](C)CC(C)(C)[C@H]1CCC[C@@H](CC)C1 218736533 UTSAFWIIEORJDZ-ZNMIVQPWSA-N 239.447 4.617 70 10 BJIE F[B-](F)(F)C=C1CCCCCCCCC1 1912974401 GZZPBJZHAUSBFZ-UHFFFAOYSA-N 219.079 4.824 70 10 BJIE CCC[C@H]1CCCC(=C[B-](F)(F)F)CC1 1912935563 DBJYVVSZNIQFDX-JTQLQIEISA-N 219.079 4.680 70 10 BJIE CC(C)(C)[C@@H]1CCCC(=C[B-](F)(F)F)C1 2209960235 QQPILLAQJYTOFQ-SNVBAGLBSA-N 219.079 4.536 70 10 BJIE CC(C)[C@H](c1ccccc1)[C@@H]1C[C@H]1[B-](F)(F)F 1895770373 NXRHXFBWWFUDCX-JHJVBQTASA-N 241.085 4.664 70 10 BJIE CC(C)(C)c1ccccc1CCCCCl 141473431 CPKQJYFXDPLQNS-UHFFFAOYSA-N 224.775 4.546 70 10 BJIE F[B-](F)(F)C=C1CCC2(CCCCC2)CC1 1959965512 XDUDYPLUDLKGTL-UHFFFAOYSA-N 231.090 4.824 70 10 BJIE CC(C)[C@@H]1CCCCCC1=C[B-](F)(F)F 1912951868 RHAQCHMQFOFOEK-NSHDSACASA-N 219.079 4.536 70 10 BJIE Cc1cc(C)c(C(=O)CC2=CCCCC2)cc1C 161004783 POTLOXZBNPPBDS-UHFFFAOYSA-N 242.362 4.685 70 10 BJIE CCCC[C@H](CC)C[C@H]1C[C@@H](C)CC[C@@H]1CN 218597163 STIXOPYIBGEAOE-CAOSSQGBSA-N 239.447 4.604 70 10 BJIE CCCN[C@@H](C)C[C@@H](C)[C@@H]1CCC[C@@H](CC)C1 218701336 URIMAEKJXLQSJC-QKPAOTATSA-N 239.447 4.617 70 10 BJIE CC(C)[C@H]1CCCCCC1=C[B-](F)(F)F 1912951867 RHAQCHMQFOFOEK-LLVKDONJSA-N 219.079 4.536 70 10 BJIE CCB(CC)OC1=C(CC)CCC[C@@H]1C 196635177 LPTXMNGRKQLRLO-NSHDSACASA-N 208.154 4.518 70 10 BJIE CCC[C@H](C)C[C@H]1C[C@@H](CCC)CC[C@@H]1CN 218743191 KCVQCEKNFVZLPG-JONQDZQNSA-N 239.447 4.604 70 10 BJIE F[B-](F)(F)C=C1CCCCCCCC1(F)F 1912976372 SREBOJGJEFHNIM-UHFFFAOYSA-N 241.032 4.679 70 10 BJIE Cc1ccc(C)c(O[C@@H]2CC[C@@H](C)[C@@H](C)C2)c1 217798177 WRJKGDQKJCWFAM-VHDGCEQUSA-N 232.367 4.507 70 10 BJIE C[C@@H](CC(C)(C)C)C[Si](Cl)(Cl)Cl 195766834 XEPLIPFTDXHUHB-ZETCQYMHSA-N 247.669 4.714 70 10 BJIE Cc1cc(CCl)cc(Oc2ccccc2)c1 59670458 CJLIWPLMAYALKI-UHFFFAOYSA-N 232.710 4.526 70 10 BJIE CC(C)(C)Cc1ccc(/C=C\[B-](F)(F)F)cc1 309619782 WRALGOSMJLFARJ-HJWRWDBZSA-N 241.085 4.675 70 10 BJIE CCC[C@@H]1CCCC(=C[B-](F)(F)F)CC1 1912935564 DBJYVVSZNIQFDX-SNVBAGLBSA-N 219.079 4.680 70 10 BJIE CC(C)c1ccc([C@@H]2C[C@@H]2[B-](F)(F)F)cc1 1975303407 KYMVMNBIGULFJL-RYUDHWBXSA-N 227.058 4.515 70 10 BJIE CC[C@@H](N[C@@H]1CCC[C@@H](C)C1)C1CCCCC1 218188250 IIGWWXHXTGGNDD-FVQBIDKESA-N 237.431 4.514 70 10 BJIE CCCCCCCC(C)=C[B-](F)(F)F 1912957711 YGBRJWNWXMDZTR-UHFFFAOYSA-N 207.068 4.680 70 10 BJIE CCC[C@H](C)C[C@@H](NCC)[C@@H]1CCC[C@@H](C)C1 217990948 HGGFZYCMBQIBBB-ZJIFWQFVSA-N 239.447 4.617 70 10 BJIE Cc1cccc(N[C@@H]2C[C@H]3CC[C@@]2(C)C3(C)C)c1 218049870 FDHZVNQESIJOQI-FRFSOERESA-N 243.394 4.622 70 10 BJIE CC(=C[B-](F)(F)F)c1ccc(CC(C)C)cc1 1912968102 YGVFBVQJRRCBCK-UHFFFAOYSA-N 241.085 4.675 70 10 BJIE CC(C)(C)N=C=Nc1c(Cl)cccc1Cl 34458322 DBZCLGBDBOWIAM-UHFFFAOYSA-N 243.137 4.597 70 10 BJIE CCC(C)(C)c1ccc(C[C@@H](C)CCl)cc1 148038085 NQJUHTMEVUNFBT-GFCCVEGCSA-N 238.802 4.792 70 10 BJIE in-vitro C[C@@H](CC(C)(C)C)C[Si](C)(Cl)Cl 195766693 ZBQAZUXZJUGVOY-QMMMGPOBSA-N 227.251 4.608 70 10 BJIE CCCN[C@@H](C[C@H](C)CC)[C@@H]1CCC[C@@H](C)C1 218022302 PVPLCRYNKYXOSU-FPCVCCKLSA-N 239.447 4.617 70 10 BJIE F[B-](F)(F)[C@H]1C[C@@H]1c1ccc(C2CCC2)cc1 2212622089 RZRBUCJPSUPXLM-OLZOCXBDSA-N 239.069 4.659 70 10 BJIE CCCN[C@@H](C)C[C@H](C)[C@@H]1CCC[C@@H](CC)C1 218701483 URIMAEKJXLQSJC-CAOSSQGBSA-N 239.447 4.617 70 10 BJIE CC[C@H](Br)[C@H](CC)C1CCCCC1 145312151 WMYGABITRHOLIZ-NEPJUHHUSA-N 247.220 4.766 70 10 BJIE CCCC[C@@H](CC)CC(=O)[C@H]1CCC[C@@H](C)C1 217904412 OJAPSDHFFJTJJB-KFWWJZLASA-N 238.415 4.988 70 10 BJIE F[B-](F)(F)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 1984462229 LYQVDVUZGBNGFK-CHWSQXEVSA-N 235.037 4.545 70 10 BJIE F[B-](F)(F)[C@H]1C[C@H]1c1ccc(C2CCC2)cc1 2212622090 RZRBUCJPSUPXLM-STQMWFEESA-N 239.069 4.659 70 10 BJIE CC(C)(C)c1ccccc1[C@H]1C[C@H]1[B-](F)(F)F 1984461641 GGKXNUBJIJATME-ZYHUDNBSSA-N 241.085 4.689 70 10 BJIE C=CCCCCCCCC[SiH](Cl)Cl 200053020 XYBABAFBBXGTBF-UHFFFAOYSA-N 239.262 4.601 70 10 BJIE Cc1ccc(N[C@@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)cc1 218078841 NTAXQYLPIUYLPK-YSVLISHTSA-N 243.394 4.622 70 10 BJIE CC(=C[B-](F)(F)F)C1CCC(C)(C)CC1 1955264804 ZQXDPNYIULEYQB-UHFFFAOYSA-N 219.079 4.536 70 10 BJIE C/C=C/CCCCC[C@H](Cl)CCC 148257011 AWNXLOHEOLMCHG-OGOUPESXSA-N 202.769 4.921 70 10 BJIE F[B-](F)(F)[C@H]1C[C@@H]1c1cccc2ccccc12 1984461962 IWWUTDPKABZSNR-OLZOCXBDSA-N 235.037 4.545 70 10 BJIE CCCC[C@@H](CC)C[C@H]1C[C@@H](C)CC[C@@H]1NC 217630976 DSKQHDUBSYPXCJ-JJXSEGSLSA-N 239.447 4.617 70 10 BJIE CC(C)(C)Cc1ccccc1/C=C\[B-](F)(F)F 390758744 YDWAXDBWQDPHJB-HJWRWDBZSA-N 241.085 4.675 70 10 BJIE CC(C)CCC[C@H](C)CC[B-](F)(F)F 2242081158 UXFHBGQOQTVUEY-JTQLQIEISA-N 209.084 4.686 70 10 BJIE CCCN[C@@H]1CC[C@@H](C)C[C@@H]1C[C@@H](C)CCC 217633811 QKXCINBMYCIOTE-XUWVNRHRSA-N 239.447 4.617 70 10 BJIE CC(C)(/C=C/[B-](F)(F)F)C1CCCCC1 1885273470 BZBIIGMTPLRZTD-CMDGGOBGSA-N 219.079 4.536 70 10 BJIE CCCN[C@@H](CCC(C)C)[C@H]1CCC[C@@H](C)C1 218020324 DZQOMFOEZDPLOW-PMPSAXMXSA-N 239.447 4.617 70 10 BJIE CC(C)(C1CCCCC1)[C@H]1C[C@H]1[B-](F)(F)F 1975304704 VCZKZBYZLTWXRE-WDEREUQCSA-N 233.106 4.830 70 10 BJIE CCCC[C@@H](CC)C[C@@H]1C[C@@H](CC)CC[C@@H]1O 218286107 LXMHGAIXMGVXMP-QXSJWSMHSA-N 240.431 4.780 70 10 BJIE CCC[C@H]1CC[C@H](NC)[C@@H](CCC(C)(C)C)C1 217705811 DFIWHHKWAZVIOS-KKUMJFAQSA-N 239.447 4.617 70 10 BJIE CCCCB(CCCC)CCCCOCC 205929453 OQMDEHICJKXEEW-UHFFFAOYSA-N 226.213 4.898 70 10 BJIE CC(C)(C)c1ccccc1[C@@H]1C[C@H]1[B-](F)(F)F 1895769388 GGKXNUBJIJATME-CMPLNLGQSA-N 241.085 4.689 70 10 BJIE Cc1ccc(N[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)cc1 218079079 NTAXQYLPIUYLPK-UKPHBRMFSA-N 243.394 4.622 70 10 BJIE Cc1ccccc1[C@@H](C)CCCCCl 168476414 KJBPBBMWAMRVLK-LBPRGKRZSA-N 210.748 4.508 70 10 BJIE F[B-](F)(F)C[C@H](c1ccccc1)C1CCCC1 1902518808 XXPKOTPEMAMYGU-CYBMUJFWSA-N 241.085 4.808 70 10 BJIE CCC[C@@H]1CC[C@@H](NCC)[C@@H](C[C@@H](C)CC)C1 217714999 SLCYMTGEAAKGMB-XUWVNRHRSA-N 239.447 4.617 70 10 BJIE F[B-](F)(F)[C@H]1C[C@@H]1c1cccc(C2CCC2)c1 1902963828 VLLDTKJGTICXDZ-OLZOCXBDSA-N 239.069 4.659 70 10 BJIE CC(=C[B-](F)(F)F)C12CC3CC(CC(C3)C1)C2 1912956097 BRNMPAAPAQTFPX-UHFFFAOYSA-N 243.101 4.536 70 10 BJIE CCN[C@@H](C)CC(C)(C)[C@H]1CCCC[C@@H]1CC 218735629 LZUVQWLWRPLOSB-KKUMJFAQSA-N 239.447 4.617 70 10 BJIE CC[C@H](C)c1ccc(Br)cc1Cl 217869821 BECYHWHSOSPZDR-ZETCQYMHSA-N 247.563 4.616 70 10 BJIE CC(C)CCCCCC[C@H](C)Br 163489421 HJTQBGCSPNWDSU-NSHDSACASA-N 235.209 4.766 70 10 BJIE ClCCC1CCCCCCCCC1 149691047 PNAWIHITUFWGAC-UHFFFAOYSA-N 202.769 4.756 70 10 BJIE Cc1cccc(N[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)c1 218049941 FDHZVNQESIJOQI-UKPHBRMFSA-N 243.394 4.622 70 10 BJIE 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CCC[C@H]1CC[C@H](N)[C@@H](CC2CCCCC2)C1 217693393 GVUHKBJRKUKHLA-IMJJTQAJSA-N 237.431 4.501 70 10 BJIE CCC[C@H]1CC[C@@H](NCC)[C@@H](CCC(C)C)C1 217720131 ZDDHQJSKOMCKEQ-HRCADAONSA-N 239.447 4.617 70 10 BJIE CC[C@@H](C)c1ccc(N[C@H]2C[C@@H]3CC=C[C@H]32)cc1 218060066 MZJFTGGZGNKDEF-UOJCXKCYSA-N 241.378 4.577 70 10 BJIE CCCCC1CCC(=C[B-](F)(F)F)CC1 238242305 YJNNTFQCDJHVBW-UHFFFAOYSA-N 219.079 4.680 70 10 BJIE CC(=C[B-](F)(F)F)c1ccc(C(C)(C)C)cc1 1912956698 KEACSOOWKVIQHA-UHFFFAOYSA-N 241.085 4.774 70 10 BJIE F[B-](F)(F)[C@H]1C[C@H]1c1cccc(C2CCC2)c1 1902963830 VLLDTKJGTICXDZ-STQMWFEESA-N 239.069 4.659 70 10 BJIE CC(C)CCC[C@@H](C)CC[B-](F)(F)F 2242081159 UXFHBGQOQTVUEY-SNVBAGLBSA-N 209.084 4.686 70 10 BJIE CC[C@@H](C[C@H](C)CC)N[C@@H]1CCCC[C@@H]1CC 217850458 SBRSYNZKZVOTPI-FXUDXRNXSA-N 239.447 4.760 70 10 BJIE Cc1coc2c1cc(Cl)c1ccccc12 160629171 KSFFILSETBHDTH-UHFFFAOYSA-N 216.667 4.548 70 10 BJIE CC(C)(C)[C@H]1CCCC(=C[B-](F)(F)F)C1 2209960234 QQPILLAQJYTOFQ-JTQLQIEISA-N 219.079 4.536 70 10 BJIE CCC[C@H]1CC[C@@H](NC)[C@@H](CCC(C)(C)C)C1 217705640 DFIWHHKWAZVIOS-SOUVJXGZSA-N 239.447 4.617 70 10 BJIE CC(C)[C@@H]1CCCC(=C[B-](F)(F)F)CC1 1912936166 NBFRIBAGMRHCSN-LLVKDONJSA-N 219.079 4.536 70 10 BJIE CC(C)(C)C1CCC(=C[B-](F)(F)F)CC1 238139648 CWVXZQPPATUYQX-UHFFFAOYSA-N 219.079 4.536 70 10 BJIE CC[C@H](C)[C@H](C)Nc1cccc(O[C@H](C)CC)c1 218182706 IHDHCRIBJLNOIF-MJBXVCDLSA-N 249.398 4.710 70 10 BJIE CC(C)(C)Cc1cccc(/C=C/[B-](F)(F)F)c1 309622403 ZOFGJSGUILUZQB-BQYQJAHWSA-N 241.085 4.675 70 10 BJIE CCB(CC)OC1=C(CC)CCC[C@H]1C 196635188 LPTXMNGRKQLRLO-LLVKDONJSA-N 208.154 4.518 70 10 BJIE C[C@@H](CCl)CCCC1CCCCC1 149909337 FWOLMCSHQMZJLI-LLVKDONJSA-N 202.769 4.612 70 10 BJIE CC(C)Cc1ccc([C@H]2C[C@H]2[B-](F)(F)F)cc1 1984461408 DJCAHTZFCSEXMY-CHWSQXEVSA-N 241.085 4.590 70 10 BJIE CCCCCCCCCC[B-](F)(F)F 203448310 RYHGWBUDNWUNLO-UHFFFAOYSA-N 209.084 4.975 70 10 BJIE CCCC[C@@H](CC)C[C@H](O)[C@@H]1CCC[C@@H](C)C1 217913811 SXFSOMOWMLSHHM-FPCVCCKLSA-N 240.431 4.780 70 10 BJIE C[C@@H](Cl)C1CCC2(CCCCC2)CC1 167376706 TUPORLMDVLSRKE-LLVKDONJSA-N 214.780 4.754 70 10 BJIE CCCCC[C@H]1CC=C([B-](F)(F)F)CC1 238219133 UJPPCSMUQYTSPU-JTQLQIEISA-N 219.079 4.680 70 10 BJIE C[C@H](Oc1ccccc1CCl)c1ccccc1 20436100 MBMQTQALIMPMFA-LBPRGKRZSA-N 246.737 4.565 70 10 BJIE CC(C)CCCCCC[C@@H](C)Br 163489312 HJTQBGCSPNWDSU-LLVKDONJSA-N 235.209 4.766 70 10 BJIE F[B-](F)(F)[C@@H]1C[C@@H]1c1cc2sccc2s1 1904834900 GQVPKXULDDAACA-NTSWFWBYSA-N 247.095 4.668 70 10 BJIE CC(C)CCC[C@@H](C)CCCBr 147263043 OVVOWVARKDXNGA-LLVKDONJSA-N 235.209 4.624 70 10 BJIE Cc1ccc(N[C@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)cc1 218078914 NTAXQYLPIUYLPK-JLJPHGGASA-N 243.394 4.622 70 10 BJIE c1cc2cc(N[C@H]3C[C@H]4CC[C@H]3C4)ccc2s1 218170567 FJGTWOSBDQOBKH-MJVIPROJSA-N 243.375 4.502 70 10 BJIE F[B-](F)(F)[C@H]1C[C@H]1C1CCCCCCC1 1885273907 HFDOPAKYGJBKDT-QWRGUYRKSA-N 219.079 4.584 70 10 BJIE CC1([C@H]2C[C@H]2[B-](F)(F)F)CCCCCC1 1885274941 QCYWHMBTHDQSJP-VHSXEESVSA-N 219.079 4.584 70 10 BJIE CCCN[C@@H](c1ccccc1)[C@@H]1CCC[C@@H](C)C1 218038585 KTUGJDMHDYCGEJ-OIISXLGYSA-N 245.410 4.554 70 10 BJIE CC(C)(C)[C@@H]1CCCC(=C[B-](F)(F)F)CC1 1912935746 GRVDFBYRQMLBQP-LLVKDONJSA-N 233.106 4.926 70 10 BJIE CC1(C)CC(=CCBr)CC(C)(C)C1 60018980 BMLGYCDPCPIHRF-UHFFFAOYSA-N 245.204 4.544 70 10 BJIE CC(C)(C)C1CCC(C=C[B-](F)(F)F)CC1 1912936775 WDCNZRRQUDVPTL-UHFFFAOYSA-N 233.106 4.782 70 10 BJIE BrCCC1CCCCCCCCC1 149613576 BTLMJIJEGNNSRI-UHFFFAOYSA-N 247.220 4.912 70 10 BJIE