smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1ccc(C(=O)NNC(=S)Nc2cccc(C(F)(F)F)c2)cc1 1026728 SWQOYFBQCSOIKB-UHFFFAOYSA-N 369.368 3.345 50 30 FGGC C[C@@H](Cc1ccccc1)NNC(=O)C(O)(c1ccccc1)c1ccccc1 2000397 CDVQLCYIDGFKKI-SFHVURJKSA-N 360.457 3.175 50 30 FGGC CS(=O)(=O)/C(C#N)=C/c1cccn1-c1ccc(OC(F)(F)F)cc1 1046636 XHZUNBSLIDKBPZ-NTEUORMPSA-N 356.325 3.285 50 30 FGGC Cc1cc(C)c2c(N)c(C(=O)NNC(=S)Nc3ccccc3)sc2n1 4334741 ZPQJYRNMQCUWIP-UHFFFAOYSA-N 371.491 3.127 50 30 FGGC Cc1ccc(NC(=S)NNC(=O)CCc2ccc(O)cc2)c(Cl)c1 1026793 ZUJDSZKXCQAYJZ-UHFFFAOYSA-N 363.870 3.304 50 30 FGGC O=C(OCc1ccccc1)N1CCC[C@@H]2O[C@@H](CBr)C[C@@H]21 22050382 GKBRQWNILJEDKY-ILXRZTDVSA-N 354.244 3.340 50 30 FGGC in-vitro COc1cccc(CC(=O)NNC(=O)c2ccc(-c3cccs3)s2)c1 1035116 GPIMBDIUUDWERD-UHFFFAOYSA-N 372.471 3.489 50 30 FGGC Cc1ccc(CN2C(=O)C(=NOC(=O)CCCl)c3ccccc32)cc1 254615765 VCOHABZYOKVRON-UHFFFAOYSA-N 356.809 3.418 50 30 FGGC COc1ccccc1B(OOCC1CCCCC1)OC(C)(C)C(C)(C)O 604936270 HZGCPSNUGHPRHX-UHFFFAOYSA-N 364.291 3.485 50 30 FGGC CO[C@@]1(C(F)(F)F)C[C@@H](CBr)N(C(=O)OC(C)(C)C)C1 723455324 OJWZZOYABBNOSW-KWQFWETISA-N 362.186 3.338 50 30 FGGC O=C(OCc1ccccc1)N1CC[C@@H]2C[C@H](CBr)O[C@@H]2C1 225426937 PYESLKOIIXXBHE-RBSFLKMASA-N 354.244 3.198 50 30 FGGC CC(C)(C)OC(=O)N1CC[C@@]2(C=Cn3ccnc32)[C@@H](Br)C1 2265356073 IXLIKNXODNILQQ-NHYWBVRUSA-N 354.248 3.010 50 30 FGGC O=C(NNC(=S)Nc1ccc(Cl)cc1)c1cnccc1C(F)(F)F 1035832 HTYOZDYQVUSQJK-UHFFFAOYSA-N 374.775 3.385 50 30 FGGC Cc1nn(-c2ccccc2)c(C)c1C(=O)NNC(=O)c1ccc(Cl)cc1 4390272 SEXSLZILKDRQHH-UHFFFAOYSA-N 368.824 3.217 50 30 FGGC O=C(OCc1ccccc1)N1CCC[C@@H]2O[C@H](CBr)C[C@@H]21 22050377 GKBRQWNILJEDKY-KKUMJFAQSA-N 354.244 3.340 50 30 FGGC in-vitro C=COCCCCOC(=O)NCCC[Si](OCC)(OCC)OCC 196372527 VSNLQJPIPDWENU-UHFFFAOYSA-N 363.527 3.091 50 30 FGGC CC(C)(C)[Si](C)(C)OCCOCCOCCI 218773171 ALRRLSCDPRSFLB-UHFFFAOYSA-N 374.335 3.476 50 30 FGGC CC(C)(C)S(=O)(=O)/C(C#N)=C/N/N=C/c1c(Cl)cccc1Cl 2150676 VDCZWANXLKVDRE-LZAMZOHBSA-N 360.266 3.495 50 30 FGGC Cn1nc(-c2ccc(/C=C(\C#N)S(C)(=O)=O)s2)cc1C(F)(F)F 1038537 RSTNXUUWTFPWOC-WEVVVXLNSA-N 361.370 3.076 50 30 FGGC N/C(=N\OC(=O)C(Cl)Cl)c1ccc(OCc2ccccc2)cc1 4382619 FSZFOUFPFPSANB-UHFFFAOYSA-N 353.205 3.233 50 30 FGGC C[C@H]1CCCCN1CC(=O)N[C@H](C)COC1=CC=C[C@H](Cl)[C@H]1Cl 299754840 XQYIONDVMXFPIO-XJIUQZFPSA-N 361.313 3.051 50 30 FGGC N/C(=N\NC(=O)Nc1ccc(Cl)cc1)c1ccc(C(F)(F)F)cn1 4394791 DLZDZEQEYUAOBK-UHFFFAOYSA-N 357.723 3.196 50 30 FGGC C[Si]1(C)O[Si](C)(C)O[Si](C)(c2ccccc2)O[Si](C)(C)O1 195751992 NSLNFHKUIKHPGY-UHFFFAOYSA-N 358.691 3.151 50 30 FGGC O=[N+]([O-])c1ccc(F)c(I)c1CBr 575727799 UDSOMSJVXYYFEB-UHFFFAOYSA-N 359.920 3.233 50 30 FGGC CC(C)[C@H](NN(C)C(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2265362107 KRYMVGJAKCSCEM-IBGZPJMESA-N 368.433 3.481 50 30 FGGC CCOC(=O)[C@H](C)Oc1ccc(NC(=O)C(Cl)Cl)cc1Cl 1042240 LZJUEZLFBYMUDW-ZETCQYMHSA-N 354.617 3.413 50 30 FGGC N#Cc1cc(Br)ccc1N1CCC[C@H](Br)C1=O 133026067 BVWVRLNNPQJKQT-JTQLQIEISA-N 358.033 3.211 50 30 FGGC COc1cccc(/C=N/NC(=O)c2sc3nc(C)cc(C)c3c2N)c1 1035455 NAODVPKUZURXNQ-AWQFTUOYSA-N 354.435 3.268 50 30 FGGC BrCC(Br)(Br)CBr 2003250 SNLFZAHVOKOBOP-UHFFFAOYSA-N 359.681 3.262 50 30 FGGC CCOC(=O)C12CCC(CI)(CC1)O[C@@H]2C(C)C 2265384463 DYSJMVDODIZGPN-LMWSTFAQSA-N 366.239 3.339 50 30 FGGC CC(C)(C)OC(=O)N1CC[C@]2(C=Cn3ccnc32)[C@@H](Br)C1 2265356074 IXLIKNXODNILQQ-XHDPSFHLSA-N 354.248 3.010 50 30 FGGC C=C(C)C(=O)OC[C@@H](O)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C 1070086554 OUSYFXDSWHYKBV-CYBMUJFWSA-N 364.663 3.242 50 30 FGGC O=C(NNC(=O)c1ccccc1OC(F)(F)F)c1ccccc1Cl 1047789 MNMNKDVMQASCIL-UHFFFAOYSA-N 358.703 3.313 50 30 FGGC CN(C)C(CC=NOCCOc1cccc(C(F)(F)F)c1)=C(C#N)C#N 254741791 DKLLAGZTFITLJA-UHFFFAOYSA-N 366.343 3.340 50 30 FGGC CC1(C)O[C@H]2[C@H](CS[C@]2(C=O)COCO[Si](C)(C)C(C)(C)C)O1 1772717765 VPJBURONLNSKMO-HEHGZKQESA-N 362.564 3.187 50 30 FGGC CC(C)(C)C(=O)NNC(=O)c1cc(C(C)(C)C)nn1Cc1ccccc1 1047710 MRCZUZYZHFNYGW-UHFFFAOYSA-N 356.470 3.036 50 30 FGGC ClCCOP1OCC2(CO1)COP(OCCCl)OC2 5133279 DNRRTXPAUIIZED-UHFFFAOYSA-N 353.075 3.031 50 30 FGGC CS(=O)(=O)SCCCCCCCCCCSS(C)(=O)=O 22055468 VANCBNNGOYOQGY-UHFFFAOYSA-N 362.604 3.493 50 30 FGGC in-vitro O=C(NNC(=O)c1ccccc1OC(F)(F)F)c1ccc(Cl)cc1 1047794 WKAWTYDABLBIFR-UHFFFAOYSA-N 358.703 3.313 50 30 FGGC Cc1ccc(C(=O)NNC(=O)c2sc(-c3csc(C)n3)nc2C)cc1 1047796 ICKHAQLDMSSYES-UHFFFAOYSA-N 372.475 3.267 50 30 FGGC Cc1nc(COc2ccc(C3SCCS3)cc2)sc1C(=O)NN 4394445 LIDBYSCJBYIKRX-UHFFFAOYSA-N 367.521 3.113 50 30 FGGC CCOC(=O)/C(C#N)=C/N/C(=N\N=C(/C)c1cc2ccccc2o1)SC 4300237 JYOMGRSXBHYBMC-CONBCKQJSA-N 370.434 3.436 50 30 FGGC CCOC(=O)/C(C#N)=C\Nc1ccc(-c2nnc(C(F)(F)F)o2)cc1C 13467864 GLCZFMJKEZUEGG-FLIBITNWSA-N 366.299 3.446 50 30 FGGC CCOc1ccc(CNC(=O)NCCBr)c2ccccc12 33639102 IIYZJZXQNAJKMF-UHFFFAOYSA-N 351.244 3.433 50 30 FGGC CC[C@H]1C(=O)O[Si](c2ccccc2)(c2ccccc2)N1c1ccccc1 195794773 MOLCMQWEFWGJPH-NRFANRHFSA-N 359.501 3.085 50 30 FGGC O=C(CBr)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 22064610 USZJZGVAIGKLRF-UHFFFAOYSA-N 363.167 3.159 50 30 FGGC in-vitro Cc1ccc(NC(=S)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 13658018 QJWBZQZVUXWOBE-UHFFFAOYSA-N 364.814 3.188 50 30 FGGC O=C(NNC(=O)c1csc(-c2cccnc2)n1)Nc1ccc(Cl)cc1 1040545 PLOSFUQJOBBCIX-UHFFFAOYSA-N 373.825 3.325 50 30 FGGC O=C(CCl)ON=C1C(=O)N(Cc2cccc(Cl)c2)c2ccccc21 725274000 INTIBRKYGVFJJR-UHFFFAOYSA-N 363.200 3.373 50 30 FGGC CC(C)C[C@@H](NC(=O)Cc1ccsc1)C(=O)N/N=C/c1cccs1 4349131 YQUDOEQOHQKSIP-BFERYNQYSA-N 363.508 3.033 50 30 FGGC Cc1nc(C(=O)NNC(=S)Nc2ccccc2C(F)(F)F)cs1 1047542 ARNLDQIFYJEDRG-UHFFFAOYSA-N 360.386 3.102 50 30 FGGC Cc1onc(-c2c(Cl)cccc2Cl)c1NC(=O)NNC(=O)N(C)C 12369558 QWONPIFIGHAHQO-UHFFFAOYSA-N 372.212 3.265 50 30 FGGC COC(=O)/C(C#N)=C\c1ccccc1N1CCN(Cc2ccccc2)CC1 59607883 UQIGKZGZGSKWBS-HKWRFOASSA-N 361.445 3.089 50 30 FGGC Cc1ccccc1NC(=S)NNC(=O)c1ccccc1-n1cccc1 1048165 TWBTWZLHEVKEIL-UHFFFAOYSA-N 350.447 3.417 50 30 FGGC Cc1cccc(Cl)c1NC(=O)NNC(=O)c1cc(C)n(C(C)(C)C)n1 1028348 FSKNGGWCEMOXNR-UHFFFAOYSA-N 363.849 3.375 50 30 FGGC CCOC(=O)C12CCC(CI)(CC1)O[C@H]2C(C)C 2265384464 DYSJMVDODIZGPN-XGNXJENSSA-N 366.239 3.339 50 30 FGGC C[C@H](Cc1ccccc1)NNC(=O)C(O)(c1ccccc1)c1ccccc1 2000398 CDVQLCYIDGFKKI-GOSISDBHSA-N 360.457 3.175 50 30 FGGC COc1ccc(OCCC(=O)NNC(=S)Nc2ccc(C)cc2C)cc1 3161615 JRQSISFBSOYMQX-UHFFFAOYSA-N 373.478 3.099 50 30 FGGC C[C@H]1CCCCN1CC(=O)N[C@H](C)COC1=CC=C[C@H](Cl)[C@@H]1Cl 299754837 XQYIONDVMXFPIO-FHIRATQRSA-N 361.313 3.051 50 30 FGGC CC[C@@H]1C(=O)O[Si](c2ccccc2)(c2ccccc2)N1c1ccccc1 195794772 MOLCMQWEFWGJPH-OAQYLSRUSA-N 359.501 3.085 50 30 FGGC Cc1ccc(CN2C(=O)C(=NOC(=O)[C@H](C)Cl)c3ccccc32)cc1 2265276368 DADPNIPLEYBOTE-ZDUSSCGKSA-N 356.809 3.416 50 30 FGGC Cc1cc(C(F)(F)F)cc(NNC(=O)NC(=O)c2c(F)cccc2F)n1 1024300 JVWWZTIROMNYKX-UHFFFAOYSA-N 374.269 3.154 50 30 FGGC Cc1nc(-c2nc(C)c(C(=O)NNC(=O)Nc3ccccc3)s2)cs1 4394550 QPULXNGROYFALR-UHFFFAOYSA-N 373.463 3.350 50 30 FGGC CSc1sc(C(=O)NNC(C)=O)c2c1C1(CCC2)SCCS1 4351425 INARSMCMPIQFFO-UHFFFAOYSA-N 374.578 3.220 50 30 FGGC Cc1cc(C(=O)N/N=C/N(C)C)nn1-c1c(Cl)cc(Cl)cc1Cl 4391724 PFJLDBQQENRYTR-CNHKJKLMSA-N 374.659 3.376 50 30 FGGC O=C(NN=Cc1ccc([N+](=O)[O-])cc1)c1ccoc1-c1ccccc1O 254820367 ZDNNQQKPIMYLQR-UHFFFAOYSA-N 351.318 3.324 50 30 FGGC Cc1ccc(O)c(C(=O)NNC(=S)Nc2ccccc2C(F)(F)F)c1 1040837 IDNUDVLCIYPUTK-UHFFFAOYSA-N 369.368 3.351 50 30 FGGC N#Cc1cc(Br)ccc1N1CCC[C@@H](Br)C1=O 133026248 BVWVRLNNPQJKQT-SNVBAGLBSA-N 358.033 3.211 50 30 FGGC O=C(CSc1ccc(Cl)cc1)NNC(=S)Nc1ccccc1 4245000 NMVFHMMBBCNCIX-UHFFFAOYSA-N 351.884 3.450 50 30 FGGC O=C(CSCC(=O)Nc1ccccc1)N/N=C/c1ccccc1Cl 3126394 TXZXPHJRUJPZHF-VXLYETTFSA-N 361.854 3.162 50 30 FGGC Cc1ccc(CN2C(=O)C(=NOC(=O)[C@@H](C)Cl)c3ccccc32)cc1 2265276367 DADPNIPLEYBOTE-CYBMUJFWSA-N 356.809 3.416 50 30 FGGC CCCCCCCC[Si](OCCOC)(OCCOC)OCCOC 200055102 LPPVYLWWCCCYMV-UHFFFAOYSA-N 366.571 3.275 50 30 FGGC O=C(NNS(=O)(=O)c1ccccc1)c1csc2ccc(Cl)cc12 1040538 DCFXRYKTDRYJEY-UHFFFAOYSA-N 366.851 3.178 50 30 FGGC C[C@H](COC1=CC=C[C@H](Cl)[C@H]1Cl)NC(=O)CN1CCCC[C@H]1C 299754838 XQYIONDVMXFPIO-VWPFQQQWSA-N 361.313 3.051 50 30 FGGC C[C@H](NC(=O)OC(C)(C)C)c1nc(CI)co1 204739246 PEOASTQODDPYFY-ZETCQYMHSA-N 352.172 3.195 50 30 FGGC CC(C)(C)OC(=O)N1CC[C@]2(C=Cn3ccnc32)[C@H](Br)C1 2265356072 IXLIKNXODNILQQ-IAQYHMDHSA-N 354.248 3.010 50 30 FGGC COc1ccc(/C=N/NC(=O)c2sc3nc(C)cc(C)c3c2N)cc1 1035453 JDBVPCOXRNSLLB-AWQFTUOYSA-N 354.435 3.268 50 30 FGGC Cc1ccc([N+](=O)[O-])c(C(=O)NNC(=S)Nc2cccc(Cl)c2)c1 1033046 QGFCHCAMXZKZSS-UHFFFAOYSA-N 364.814 3.188 50 30 FGGC COC(=O)c1c(-c2c(Cl)cccc2Cl)noc1NC(=O)NN(C)C 1042792 ZHZQOYXPMRFNAX-UHFFFAOYSA-N 373.196 3.033 50 30 FGGC C[C@@H](NC(=O)OC(C)(C)C)c1nc(CI)co1 204739256 PEOASTQODDPYFY-SSDOTTSWSA-N 352.172 3.195 50 30 FGGC CCOC(=O)c1c(C)csc1NC(=O)/C(C#N)=C/c1ccc(O)cc1 1026219 LVZMHCWZRSCWJB-MDWZMJQESA-N 356.403 3.485 50 30 FGGC CC(C)C[C@H](NC(=O)Cc1ccsc1)C(=O)N/N=C/c1cccs1 4349128 YQUDOEQOHQKSIP-ZNBBLSJYSA-N 363.508 3.033 50 30 FGGC O=C(Cl)C(F)(F)[C@](F)(Br)C(F)(F)Br 8698365 UQBKGDRTYHZFME-GSVOUGTGSA-N 354.294 3.436 50 30 FGGC C[C@H](COC1=CC=C[C@H](Cl)[C@@H]1Cl)NC(=O)CN1CCCC[C@H]1C 299754839 XQYIONDVMXFPIO-WVZRYYJFSA-N 361.313 3.051 50 30 FGGC CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1 1046688 OROGCTLEAIHMCT-CQSZACIVSA-N 369.421 3.358 50 30 FGGC O=C(NNC(=O)c1ccccc1Cl)c1ccc(OC(F)(F)F)cc1 1047787 PSNHJZISVMOPPX-UHFFFAOYSA-N 358.703 3.313 50 30 FGGC CCC[C@H]1OC2(CI)CCC1(C(=O)OCC)CC2 2265384665 GUMQHPVECCRSBT-LMWSTFAQSA-N 366.239 3.483 50 30 FGGC COC(=O)c1c(C)[nH]c(C)c1/C=C(\C#N)S(=O)(=O)c1ccc(C)cc1 1039902 FUWFYOBIXNVJAA-OQLLNIDSSA-N 358.419 3.065 50 30 FGGC COC(=O)c1scc(C)c1NC(=O)/C(C#N)=C/c1ccc(C#N)cc1 1026399 AVAWZECSULJPKV-VGOFMYFVSA-N 351.387 3.260 50 30 FGGC O=C(NNC(=S)Nc1ccc(OCc2ccccc2)cc1)c1ccco1 1324190 PVQRIQJNPBIOCB-UHFFFAOYSA-N 367.430 3.490 50 30 FGGC CCOC(=O)C(C#N)=C(O)C(=Cc1ccccc1)NC(=O)c1ccccc1 2265270074 LXAZOLXBGYUODO-UHFFFAOYSA-N 362.385 3.356 50 30 FGGC Cc1cc(NNC(=O)c2cccc(C(F)(F)F)c2)nc2c1c(C)nn2C 1038119 DOQCHXCTTMJXCS-UHFFFAOYSA-N 363.343 3.361 50 30 FGGC C=C(C)C(=O)OC[C@H](O)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C 1070086555 OUSYFXDSWHYKBV-ZDUSSCGKSA-N 364.663 3.242 50 30 FGGC CC(=O)Nc1ccc(N(CCBr)CCBr)cc1 2038965 HDIDAFMIJYIOOS-UHFFFAOYSA-N 364.081 3.241 50 30 FGGC CC(C)(C)[Si](OC[C@@H]1C=CC(=O)O1)(c1ccccc1)c1ccccc1 195845213 VXTQWNKHHWYJRP-KRWDZBQOSA-N 352.506 3.045 50 30 FGGC Cc1noc(-c2cccs2)c1C(=O)NNC(=O)c1c(F)cccc1F 1047540 JMXCPHXGCUXZSV-UHFFFAOYSA-N 363.345 3.065 50 30 FGGC COc1cc(OC)cc(C(=O)NNC(=S)Nc2ccc(C(C)C)cc2)c1 1048527 RPWZZOZNYRIHNR-UHFFFAOYSA-N 373.478 3.459 50 30 FGGC NNC(=O)c1oc2nc(-c3ccccc3)cc(-c3cccs3)c2c1N 1035708 COJUDFWZHLKCJK-UHFFFAOYSA-N 350.403 3.409 50 30 FGGC CC(=O)NCC[C@@]12[C@@H]3C=C[C@@H](C)[C@@H]1CC[C@H](O[Si](C)(C)C)[C@@H]2OC3 2265352299 ZUZLJLSTEKTBOC-YHDJZSDMSA-N 351.563 3.350 50 30 FGGC CC(=O)OCc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)o1 1038044 GVNDWZGDPKWLSR-LZYBPNLTSA-N 365.794 3.334 50 30 FGGC CC(C)(C)c1ccc(C(=O)NNC(=S)Nc2ccc3c(c2)OCO3)cc1 1036021 LILIGAKGHXMDEA-UHFFFAOYSA-N 371.462 3.344 50 30 FGGC O=C(OC[C@H]1O[C@H](Cl)C[C@@H]1OC(=O)c1ccccc1)c1ccccc1 141535149 IZFYHYLUWFWUTQ-BBWFWOEESA-N 360.793 3.423 50 30 FGGC CCC[C@@H]1OC2(CI)CCC1(C(=O)OCC)CC2 2265384666 GUMQHPVECCRSBT-XGNXJENSSA-N 366.239 3.483 50 30 FGGC O=C(OCc1ccccc1)N1CC[C@@H]2C[C@@H](CBr)O[C@@H]2C1 225427018 PYESLKOIIXXBHE-QLFBSQMISA-N 354.244 3.198 50 30 FGGC Cc1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)sc2C)cc1 1043267 HQZXXMXCBFVBDH-UHFFFAOYSA-N 365.458 3.431 50 30 FGGC CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1 1046689 OROGCTLEAIHMCT-AWEZNQCLSA-N 369.421 3.358 50 30 FGGC CCOC(=O)/C(C#N)=C/N/C(=N\N=C\c1c(F)cccc1Cl)SC 4300229 QRUJXEBCTWTPRJ-RWTIUXBZSA-N 368.821 3.092 50 30 FGGC CCOC(=O)[C@@H](C)Oc1ccc(NC(=O)C(Cl)Cl)cc1Cl 1042239 LZJUEZLFBYMUDW-SSDOTTSWSA-N 354.617 3.413 50 30 FGGC CCOC(OCC)c1ccc(/C=C(\C#N)S(=O)(=O)c2ccccn2)cc1 1037551 OPWRCVBKCQLITF-GHRIWEEISA-N 372.446 3.492 50 30 FGGC CN(C)c1ccc(/C=C2/C(=C(C#N)C#N)c3ccccc3S2(=O)=O)cc1 8462429 VXUVPVBTOKITQX-ODLFYWEKSA-N 361.426 3.382 50 30 FGGC O=C(NNC(=O)c1csc(Cc2ccsc2)n1)Nc1ccccc1 1040552 DSDLWKSZBLHXKL-UHFFFAOYSA-N 358.448 3.262 50 30 FGGC Cc1n[nH]c(-c2cccs2)c1C(=O)N/N=C/c1ccc([N+](=O)[O-])s1 4338246 PLDQPQUXXREPPW-VIZOYTHASA-N 361.408 3.180 50 30 FGGC Cc1nn(CC(=O)N/N=C/c2ccccc2Cl)c(C)c1Br 1037419 SSLVSXSZWPQAAH-REZTVBANSA-N 369.650 3.066 50 30 FGGC CCCCC#Cc1cncc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1 4364051 FALIAJBMWDXWAA-UHFFFAOYSA-N 355.825 3.352 50 30 FGGC CC(C)[C@@H](NN(C)C(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2265362108 KRYMVGJAKCSCEM-LJQANCHMSA-N 368.433 3.481 50 30 FGGC CC(C)(C)OC(=O)N1CC[C@@]2(C=Cn3ccnc32)[C@H](Br)C1 2265356071 IXLIKNXODNILQQ-ABAIWWIYSA-N 354.248 3.010 50 30 FGGC O=C(CCCCCCCCCCBr)ON1C(=O)CCC1=O 725239991 RQMVHFRIRKSDGS-UHFFFAOYSA-N 362.264 3.499 50 30 FGGC CCOc1ccc(/C=N/NC(=O)N/N=C/c2ccc(OCC)cc2)cc1 1040442 UQJIMXFAOUHBBW-KVVJQUGZSA-N 354.410 3.151 50 30 FGGC O=C(CCl)Nc1ccc(-c2ccc(NC(=O)CCl)c(O)c2)cc1O 103832282 PUDPEBQWWPNOAM-UHFFFAOYSA-N 369.204 3.119 50 30 FGGC O=C(Cl)C(F)(F)[C@@](F)(Br)C(F)(F)Br 8698364 UQBKGDRTYHZFME-VKHMYHEASA-N 354.294 3.436 50 30 FGGC Cc1cc(C)n(-c2ccc(-n3cccc3/C=C(\C#N)S(C)(=O)=O)cc2)n1 1043645 HTPWJGVWDZMPLH-XDHOZWIPSA-N 366.446 3.189 50 30 FGGC CS/C(=C(/C#N)S(=O)(=O)c1ccc(Cl)cc1)N1CCSCC1 1037399 YKPAXTUEQHMLID-YPKPFQOOSA-N 374.940 3.218 50 30 FGGC O=C(NNC(=O)c1ccc(OC(F)(F)F)cc1)c1ccc(Cl)cc1 1047785 FRQPZJVWSIHGND-UHFFFAOYSA-N 358.703 3.313 50 30 FGGC C[N+](C)=c1ccn(C(F)(F)P(c2ccccc2)c2ccccc2)cc1 104840373 PUXNKMOIXYUFOP-UHFFFAOYSA-N 357.364 3.160 50 30 FGGC Cc1[nH]c2ccccc2c1SCC(=O)NNC(=O)Nc1ccccc1 1039365 NLYKACZKLNZWGU-UHFFFAOYSA-N 354.435 3.421 50 30 FGGC