smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(N/N=C/c1cccnc1)c1cccnc1Nc1cccc(C(F)(F)F)c1 98082080 ZZODFMMMQBAOOE-BRJLIKDPSA-N 385.349 4.003 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 102188198 UZRHATKYSCLMQF-LJQKDAIMSA-N 380.403 4.163 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3c(c1)CCC(=O)N3)CC2=O 587461947 VGGZFJQWILIJHK-QFIPXVFZSA-N 399.874 4.329 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(F)cc1CBr)[C@@H](C2)C3=O 587430025 YPIDJNJARIQNKV-KSSFIOAISA-N 377.209 4.218 50 1 GIGF CC[C@H](Br)[C@@H]1CC=CC[C@@H]2O[C@@H](C=C=CBr)C[C@@H]2O1 18061060 ZFUYDSOHVJVQNB-MEXNZXMWSA-N 392.131 4.485 50 1 GIGF biogenic N#CC(=C(/N)Sc1ccccc1F)/C(C#N)=C(\N)Sc1ccccc1F 34802604 SZOVHLAUFAHSSQ-JYFOCSDGSA-N 386.452 4.237 50 1 GIGF COc1ccc2[nH]c(C(=O)N3C[C@H](CCl)c4c3cc(O)c3[nH]ccc43)cc2c1 38967267 LUCSVWOHANBHCS-LBPRGKRZSA-N 395.846 4.346 50 1 GIGF in-vivo CC1=CC[C@H]([C@@](C)(Cl)CCl)O[C@@H]1C(Br)Br 169318219 FVPHWLFPVMYUFV-WEDXCCLWSA-N 380.935 4.442 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@]1(C)[C@@H]2CCC=C(C=O)[C@@]2(C)CC[C@H]1C 2356458397 MPESIRKGUJLXPE-GZIQRIHMSA-N 376.493 4.319 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(CBr)c(F)c1)[C@@H](C2)C3=O 587425918 HZHJZWQAXSPSJM-UGSOOPFHSA-N 377.209 4.218 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(C(=O)Cl)s1 587897850 XTUOBBXTIZJYGI-UHFFFAOYSA-N 386.687 4.144 50 1 GIGF COc1cccc([C@@]2(CCCCCCCl)c3c(cnn3C)CCN2C)c1 963956550 YDZCBIAXOJCLNQ-NRFANRHFSA-N 375.944 4.350 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](Br)C(=O)CC3 586985366 GDTQXBVXYLSHLV-GOSISDBHSA-N 394.224 4.103 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(Br)cc1)O2 587371781 MVIVRCNHUAGILU-KRWDZBQOSA-N 380.669 4.439 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N=C=O)c2)N1 587743863 YGAVWHGESVDARM-VOJFVSQTSA-N 375.241 4.353 50 1 GIGF O=C(N/N=C/c1ccccc1F)c1ccc(-c2cc(=O)c3ccccc3o2)cc1 653762382 PMDQCFTYMYMEFL-AFUMVMLFSA-N 386.382 4.363 50 1 GIGF CC(=O)O[C@@H]1C[C@]2(O)C[C@@]3(C)CC[C@@]2(C[C@H]3Cl)C(C)(C)[C@@H]1Br 2356588703 DIJRDZRTBRINGF-YUBNJOEESA-N 393.749 4.030 50 1 GIGF Cc1nc2ccccc2n1CCC(=O)N/N=C/c1ccc(N(C)C)c2ccccc12 96934310 QFPKNHAFPFVIHG-PCLIKHOPSA-N 399.498 4.104 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](Br)Cc1ccccc1F)O2 587385130 MAJNDUSSUZXSPQ-PKOBYXMFSA-N 392.268 4.446 50 1 GIGF Cc1ccc2c(c1)[C@]1(N[C@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 587740874 LELJGNXYJOYUAR-ODXCJYRJSA-N 399.263 4.474 50 1 GIGF C=C(c1ccc(OC)cc1)[C@@H]1COC2(CCC(=C(C)C(=O)OCC)CC2)OO1 43523745 AFMRTAPPWLTVCR-AIBWNMTMSA-N 388.460 4.205 50 1 GIGF COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCCCCl 587377261 VPWFMIYEMVMIFQ-SFHVURJKSA-N 375.852 4.300 50 1 GIGF O=C(N/N=C1/c2ccccc2-c2nc3ccccc3nc21)c1ccccc1Cl 103228888 CCMNOAYSFZNWEQ-QOMWVZHYSA-N 384.826 4.446 50 1 GIGF CC[C@]1([C@H](C)Br)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587537803 KKESZACDTSLUQT-GEWABHDNSA-N 377.234 4.286 50 1 GIGF N#C/C=C1/CCN(C[C@H]2CCCCN2C(=O)Cc2ccc(Cl)c(Cl)c2)C1 13449206 WKJMMBKITNREGG-MISIWFIQSA-N 392.330 4.073 50 1 GIGF O=Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c[nH]1 587325433 FNAICAQGJWLSTJ-FPOVZHCZSA-N 399.805 4.165 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3ccon3)c1C)O2 587374343 XAVPLDLGPPHGAA-HXUWFJFHSA-N 385.851 4.072 50 1 GIGF COc1ccc(C)cc1[C@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587371823 GGRBWBXJVZVQBZ-LJQANCHMSA-N 390.277 4.150 50 1 GIGF COc1ccc(Cl)c2c1CCN[C@@]2(CBr)CC[C@@H]1CCCO1 963269542 KLFPNSPZRFCNTE-YVEFUNNKSA-N 388.733 4.044 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43967657 IGHHGSMGNAAZGN-CBEKKBIVSA-N 385.504 4.067 50 1 GIGF C[C@@]12CCCC(/C=N/NC(=O)c3cccc(Cl)c3)=C1C(=O)O[C@H]2c1ccoc1 103288532 LFBAUJFSIGBUOP-VPUUYJAHSA-N 398.846 4.434 50 1 GIGF COc1cccc2cc3c(nc12)[C@](C1CCC1)([C@@H](C)Br)NCC3 963059306 QNLATALVBKMKPL-CWTRNNRKSA-N 375.310 4.168 50 1 GIGF O=C(Nc1ccccc1)[C@@H](Cl)[C@@]1(c2ccccc2)NCCc2ccc(O)cc21 963328390 FOOHQYKCZJLOQH-GGAORHGYSA-N 392.886 4.028 50 1 GIGF N#CC1=C(N)Oc2c(ccc3ccccc23)[C@@H]1c1cccc(C#CCCCO)c1 73195814 GGUAVXRXGABCFU-QHCPKHFHSA-N 380.447 4.182 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cccc(Cl)c1)[C@@H](C2)C3=O 587414875 PEERMUPVQQSLTG-KSSFIOAISA-N 393.664 4.386 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@H]1C(C=O)=CC[C@@H]2C(C)(C)CCC[C@]12C 2356510006 KLGPVOFVVYHEGO-WOIUINJBSA-N 376.493 4.319 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 103167900 HLXWDFOMGZVXTL-CVEARBPZSA-N 388.210 4.492 50 1 GIGF COc1cc(/C=C(\C#N)C(N)=O)cc(CSc2ccc3ccccc3c2)c1O 12352715 PWAFUGMDLMAVBQ-CAOOACKPSA-N 390.464 4.239 50 1 GIGF O=C1c2ccccc2C(=O)c2c1ccc1nc(CCCCBr)[nH]c21 586972640 YDDIEDZZUJDTKR-UHFFFAOYSA-N 383.245 4.056 50 1 GIGF COC(=O)C=C(CC[C@@H]1C(C=O)=CC[C@@H]2C(C)(C)CCC[C@]12C)COC(C)=O 2356427553 DWQLMTINEJBFII-TXTKFYIRSA-N 390.520 4.407 50 1 GIGF N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](c1ccccc1)C1CC1 73159692 VKQAHJGPMGPUFN-OUQXZNHLSA-N 381.819 4.423 50 1 GIGF C[C@@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(-c2ccccc2)c(F)c1 103198729 PPEWAWKYMKNUHU-UMYHVIPVSA-N 381.363 4.248 50 1 GIGF Cc1cc(F)c2[nH]c([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)nc2c1 587009953 XUAZDBNPAIVOFA-KRWDZBQOSA-N 384.842 4.131 50 1 GIGF O=C(N/N=C/c1ccc(COc2ccccc2)cc1)c1ccc(O)c(Cl)c1 29126201 BUEQLBHBZQJKRL-YDZHTSKRSA-N 380.831 4.389 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 586974162 RUZQCWZYCIHATN-QMMMGPOBSA-N 385.187 4.370 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(CCl)OC=C1OCc1ccccc1)O2 587374618 IKMYNXSYJHFDCR-JOCHJYFZSA-N 397.858 4.492 50 1 GIGF O=C(N/N=C/c1cccc(F)c1)c1ccc(-c2cc(=O)c3ccccc3o2)cc1 653762376 NHPPEIPVBCRRCU-AFUMVMLFSA-N 386.382 4.363 50 1 GIGF C[C@@]1([C@H](Br)Cc2ccc(F)cc2F)NCCc2ccc(O)cc21 963341971 PGFVAAARXMVJTQ-QZTJIDSGSA-N 382.248 4.038 50 1 GIGF CN(C=O)c1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587497511 ITYGGXBQXMQITH-JOCHJYFZSA-N 383.875 4.258 50 1 GIGF COc1cc(NC(=O)CCl)c(C#Cc2cc(Cl)ccc2OC)cc1C 587900072 HAHWOXQPJSQMJZ-UHFFFAOYSA-N 378.255 4.243 50 1 GIGF C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)C(C)=CC)cc2[C@H]1OC(=O)C(C)=CC 2356639419 PDBXOOAXGJDJOB-TYCQWZJGSA-N 398.455 4.324 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@]42OO3 135739223 UZRHATKYSCLMQF-DKYJUROGSA-N 380.403 4.163 50 1 GIGF COc1cc2c3c(c1)O[C@]1([C@@H](Br)[C@H]4CC[C@]1(C)C4(C)C)[C@@H](C2)C3=O 587411693 GADGSAZQNCDXGZ-ZVBFCMAISA-N 391.305 4.401 50 1 GIGF O=c1c2ccccc2cc2n1Cc1c-2nc2cc3c(cc2c1CCl)OCCO3 58575559 LIZYDZDKJQLZKV-UHFFFAOYSA-N 390.826 4.088 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(Cl)cc1)O2 587372073 HEWLUCIUCXLENJ-QGZVFWFLSA-N 380.669 4.486 50 1 GIGF CCS(=O)(=O)NCCCc1nc2ccc(S(F)(F)(F)(F)F)cc2[nH]1 586942895 SKRRJYIAWQOKDF-UHFFFAOYSA-N 393.403 4.092 50 1 GIGF O=C1C[C@](CCl)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 587498344 NDUMXKMJAXNJTP-QFIPXVFZSA-N 384.859 4.436 50 1 GIGF COc1cc(OC)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CCl 587375595 NJEBIUDEDBBZAQ-HXUWFJFHSA-N 375.852 4.214 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(C(=O)O)oc1C)CC2=O 587459281 HPCCOVRDHOXDOU-IBGZPJMESA-N 378.808 4.044 50 1 GIGF COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C/c3ccccc3)nc2c1 587188815 XEUDPPQMNTXGGW-NTUHNPAUSA-N 382.217 4.176 50 1 GIGF CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)[C@@H](Cl)C1=CCBr 2356729698 BURJCSPPDZTXBA-VWYCJHECSA-N 388.527 4.040 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccsc2CC[C@@H]1Br 587414556 NAMYMKISRXBPJZ-DOTOQJQBSA-N 378.291 4.209 50 1 GIGF Cc1ccc([C@]2([C@H](C)Br)NCCc3c2c(C(C)C)nn3C)cc1 962923085 UUAZJOJCFXLMRN-LIRRHRJNSA-N 376.342 4.025 50 1 GIGF O=C(O)[C@H]1Cc2c(Cl)cc(F)c(F)c2[C@@](CCCl)(c2cccs2)N1 962998177 SKTSMGCZTYITKE-BDJLRTHQSA-N 392.254 4.151 50 1 GIGF COc1cc2nc3c(c(CCl)c2cc1OC)Cn1c-3cc2ccccc2c1=O 58541769 HMYQLANHBYEJCU-UHFFFAOYSA-N 392.842 4.334 50 1 GIGF C[C@H](Br)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587540065 ZUJSYPHKOOKTPF-WQFAYQGZSA-N 389.245 4.286 50 1 GIGF O=C1NC(=O)[C@]2(C3CCC3)Cc3ccccc3[C@]3(CCCCCC[C@H]3Cl)N12 962661661 IANVPEFUYPMOGB-BVYCBKJFSA-N 386.923 4.490 50 1 GIGF C=CCCCCC[C@@H](Cl)[C@@H](CC#CC#C[C@H](C=C)OC(C)=O)OC(C)=O 3797231 FWJJDWCNJORQOU-PWRODBHTSA-N 378.896 4.177 50 1 GIGF BrC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1 40898840 VWGQGECZADCOLA-UHFFFAOYSA-N 395.385 4.301 50 1 GIGF CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CCC3=C[C@]4(C(C)C)CC[C@@]32OO4)[C@]1(C)C(=O)O 238742683 RUPKEZLOZJFANN-LZSCHDGVSA-N 392.492 4.035 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2ccsc2)c1 38145395 LRMZIIZKIYGYSJ-MPSQLMGGSA-N 379.510 4.355 50 1 GIGF CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 100234794 CWCXONZIEDNVKI-SQATWKBSSA-N 399.325 4.010 50 1 GIGF in-vitro C[C@@H]1CC[C@@H]2[C@@H](C)[C@@H](O[C@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@H]1[C@]32OO4 103036647 AKXUGEWGUZMDGE-DIQPKOCXSA-N 399.487 4.476 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(F)cc(Br)c2[nH]1 586971681 WJLRRHKBFDPZKA-SNVBAGLBSA-N 380.055 4.326 50 1 GIGF CC1(C)CC(NC(=O)[C@]23CC[C@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 169304440 VEOCQHPHVDVKDX-ZNOIYHFQSA-N 385.390 4.002 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]32OO4 194892204 SBCGDCBRWXAAIF-PATPHXSYSA-N 386.488 4.398 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](CBr)(C2CC2)N1 587674309 VYKJBTOEQBXTNJ-RTHLEPHNSA-N 377.095 4.123 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C)([C@@H](Cl)C(=O)Nc1ccccc1)CC2=O 587458069 FUXNBZHEYMIAQV-FPOVZHCZSA-N 387.863 4.315 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)N[C@H](C)Cc3ccc(F)c(Br)c32)o1 587685717 RJQRYONLMFYIMU-BCTVWOGZSA-N 387.680 4.210 50 1 GIGF COc1ccc2cc([C@]3(CCl)c4nn(C)cc4CCN3C)ccc2c1Cl 963955734 SJCIDNKNGRYAQE-HXUWFJFHSA-N 390.314 4.206 50 1 GIGF C#CC=CCC(Br)=C1C[C@@H]2O[C@H](CC)[C@@H](Br)C[C@@H]2O1 2356500141 OGLSYOBOMBXPEB-NEBZKDRISA-N 390.115 4.292 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCCCBr)cc1)O2 587375986 WJHOGSGUDYFANP-GOSISDBHSA-N 390.277 4.448 50 1 GIGF CCN(CC)c1ccc2c(c1)OC(/N=C/N)=C(C#N)[C@@H]2c1ccc(Cl)cc1 66074606 LPKDFLSOYXOXNA-HXUWFJFHSA-N 380.879 4.433 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CBr)(C2CC2)N1 587674308 VYKJBTOEQBXTNJ-RMLUDKJBSA-N 377.095 4.123 50 1 GIGF CC[C@]1([C@@H](C)Br)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587537802 KKESZACDTSLUQT-DJCROIMJSA-N 377.234 4.286 50 1 GIGF C=C1C(=O)O[C@@H]2C=C(C)CC=C[C@](C)(OO)CCC=C(C)[C@H](OC(C)=O)C[C@H]12 2356799332 UIRWAUSAMAORJV-VMBXEPDQSA-N 390.476 4.287 50 1 GIGF C[C@]12C=C3C(=O)C[C@@H](c4ccccc4)C[C@@]3(OO1)O[C@H]2c1ccc([N+](=O)[O-])cc1 96933992 QJJZTHNUOHCECI-ZJMJOCHXSA-N 393.395 4.156 50 1 GIGF CC(C)c1cc(C(=O)NCCSSCCN(C)C)c(O)c(C(C)C)c1 618008098 AIPDHWQIJSVVFH-UHFFFAOYSA-N 384.611 4.312 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@H]1c1cccc(O)c1 1857604297 FZSDKEJIGKBJIN-SFHVURJKSA-N 381.391 4.017 50 1 GIGF O=C=Nc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1Cl 587881346 VCWYLHOGOYAMIJ-UHFFFAOYSA-N 393.657 4.325 50 1 GIGF O=C(NN/C=C1\C=Nc2ccccc21)c1cc(-c2cccc3ccccc23)n[nH]1 15973982 CEMYXKKLJYQFIU-JQIJEIRASA-N 379.423 4.221 50 3 GIGF N#Cc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587541264 AIZAROIFIAUIHJ-KNQAVFIVSA-N 391.810 4.360 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 586970276 CSNJNHGNWWRQBH-NSHDSACASA-N 387.075 4.058 50 1 GIGF CC(=O)O[C@H]1C[C@]2(O)C[C@]3(C)CC[C@]2(C[C@@H]3Cl)C(C)(C)[C@H]1Br 169643293 DIJRDZRTBRINGF-FFCKFQGWSA-N 393.749 4.030 50 1 GIGF C/C(CC(=O)NC1CCCCC1)=N/NC(=O)Cc1ccc(-c2ccccc2)cc1 6014013 JHOQUANAENHCIM-ITYLOYPMSA-N 391.515 4.227 50 1 GIGF CCCCCCOC(=O)[C@H](Br)[C@H](F)C(=O)OCCCCCC 33815064 HXMKOCXMUASSJO-KGLIPLIRSA-N 383.298 4.335 50 1 GIGF C[C@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(-c2ccccc2)c(F)c1 103198728 PPEWAWKYMKNUHU-AEOXGOBCSA-N 381.363 4.248 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(O)cc2)N1 587685342 PTFDJKWYDMQRQN-BTDLBPIBSA-N 384.676 4.310 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](CCN3CCCCC3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 100012231 QFWYMQIBFZJDLA-GDUPHFKNSA-N 379.541 4.113 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] 103176503 XDXFIYWDJSSSPE-HZPDHXFCSA-N 388.210 4.492 50 1 GIGF COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl 587374007 FQVROTUYQFWNGS-SFHVURJKSA-N 375.852 4.300 50 1 GIGF Cc1cc2nc(-c3ccc(C(=O)N/N=C/c4ccc(O)cc4)cc3)[nH]c2cc1C 1857561011 XPQQESOTCMRUBY-ZMOGYAJESA-N 384.439 4.316 50 1 GIGF COc1ccc(OC)c2c1C[C@H](C)N[C@@]2(CBr)c1ccc(F)cc1 963576889 AWYSKBOBGBBMNV-BUXKBTBVSA-N 394.284 4.016 50 1 GIGF CC(C)(C)CC(=O)Nc1ccc(Cl)cc1C(=O)NNCc1ccccc1F 103210158 LVAOEPLGAMNZCD-UHFFFAOYSA-N 391.874 4.288 50 1 GIGF C#CC=CCC(Br)=C1C[C@@H]2O[C@H](CC)[C@H](Br)C[C@@H]2O1 2356500144 OGLSYOBOMBXPEB-UXOAXIEHSA-N 390.115 4.292 50 1 GIGF BrC/C=C/c1nc2cc(Br)c(Br)cc2[nH]1 586972152 IQIHYLPWFRSDPF-OWOJBTEDSA-N 394.892 4.496 50 1 GIGF O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1C[C@H]1c1ccccc1 6252433 UGOFNVAWWWTSKR-TUVRHOMCSA-N 375.384 4.109 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1OCCBr)O2 587371687 FONHFZCUGBEQFF-QGZVFWFLSA-N 376.250 4.057 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)([C@@H](C)Br)[C@@H](C2)C3=O 587415525 UJNNDPPWXHHJDF-QROBEVECSA-N 387.273 4.430 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@H](OC(=O)C=Cc2ccccc2)C1 2356566372 FRHWTFAYHKXVPQ-YCSHWKNNSA-N 378.468 4.318 50 1 GIGF CC(C)=CCOc1ccc([C@H]2C[C@H]2C(=O)NNc2nncc3ccccc23)cc1 49067075 VCYCXVVUFLVCEQ-NHCUHLMSSA-N 388.471 4.222 50 1 GIGF C[C@@H](CCC(=O)NN)[C@@H]1CC[C@@H]2[C@H]3CC[C@H]4C[C@@H](O)CC[C@@]4(C)[C@@H]3CC[C@@]12C 299872371 BXSPCFWJSALCFW-VKPXTEDRSA-N 390.612 4.412 50 1 GIGF aggregator ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@@H]4O[C@H]34)[C@]1(Cl)C2(Cl)Cl 113904624 ZXFXBSWRVIQKOD-XBGDBVOPSA-N 389.320 4.453 50 1 GIGF COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCCCCl 587377258 VPWFMIYEMVMIFQ-GOSISDBHSA-N 375.852 4.300 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587546245 VFQTWOWTSFJZEX-YLJYHZDGSA-N 385.803 4.093 50 1 GIGF O=C(CCCCCC(=O)Nc1ccccc1O)N/N=C/C=C/c1ccccc1 95809052 NPDCDNKLJDYASI-ZWGHNKAYSA-N 379.460 4.097 50 1 GIGF O=C(N/N=C/c1cc(O)cc(O)c1)c1ccc(-c2nc3ccccc3s2)cc1 299870569 WLDZEBCMWVNJNX-WSDLNYQXSA-N 389.436 4.138 50 1 GIGF CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@@H]3[C@H](CC(=O)O)C(=O)O[C@@]32C1 299848046 CWCXONZIEDNVKI-CJZZSSRZSA-N 399.325 4.010 50 1 GIGF CCCCNS(=O)(=O)c1ccc2nc(/C(C#N)=C\c3ccc(C)cc3)[nH]c2c1 587188875 XWIDXEIXMYFCSL-ATVHPVEESA-N 394.500 4.014 50 1 GIGF Cc1nn(C)cc1/C=N\NC(=O)c1ccc2c(c1)c(C)c(C)n2Cc1ccccc1 15989727 XATNJMFESTVZDB-MXAYSNPKSA-N 399.498 4.112 50 3 GIGF O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)c1ccc(O)c(Cl)c1 29126750 SPMBSLYDIRBHLZ-YDZHTSKRSA-N 380.831 4.389 50 1 GIGF COc1ccc2[nH]c(C)c([C@]3(CCl)CC(=O)c4cc(C)cc(N)c4O3)c2c1 587372446 LJSTWQMELRCMQD-OAQYLSRUSA-N 384.863 4.475 50 1 GIGF C=C1C(=O)O[C@H]2CC(C)=CCCC(=C)[C@H](OO)CCC(COC(C)=O)=CC[C@@H]12 2356406914 LCYYYCIAJNWGOB-HBMCJLEFSA-N 390.476 4.289 50 1 GIGF C=C(C=O)[C@@H]1Oc2ccc([C@H](C)OC(=O)C(C)=CC)cc2[C@H]1OC(=O)C(C)=CC 2356639418 PDBXOOAXGJDJOB-ORYQWCPZSA-N 398.455 4.324 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]32OO4 194892169 SBCGDCBRWXAAIF-OPSCQPNISA-N 386.488 4.398 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(Br)c(F)c(F)c2[nH]1 586970977 JKSCFZQUHRGOQW-SNVBAGLBSA-N 398.045 4.465 50 1 GIGF CC(C)[C@H](Br)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587537263 CEKNCSKZUKVDLQ-RVKKMQEKSA-N 377.234 4.142 50 1 GIGF C=Cc1ccc(C)[n+](C[Si](C)(C)O[Si](C)(C)C[n+]2cc(C=C)ccc2C)c1 195472633 MCAFFSBLCMSLAL-UHFFFAOYSA-N 398.699 4.370 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CBr)(C2CC2)N1 587673526 NSZKOEBVPRYEQU-RMLUDKJBSA-N 377.095 4.123 50 1 GIGF C=C(C)[C@H](Cl)CC=C(C)[C@@H]1CC[C@@]2(C)OC3=C(C[C@@H]12)C(=O)[C@@]1(O)CO[C@H]3C1 2356691681 SPHHHXFBOCONBA-VZKGRTKSSA-N 392.923 4.068 50 1 GIGF O=C(CCc1cccc(Cl)c1Cl)N[C@@H](Cc1ccccc1)C(=O)CCl 26147975 JTXCAMWTOGVDBF-INIZCTEOSA-N 398.717 4.461 50 1 GIGF CCOC(=O)c1c(O[C@H]2CCCC[C@H]2Cl)cc(Cc2ccccc2)[nH]c1=O 95591842 BJKWBSFFJGSPLK-SJORKVTESA-N 389.879 4.071 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2ccc(F)c(F)c2F)C(C)(C)C)c1 653880671 PSICCWKFQDSMBP-UHFFFAOYSA-N 378.394 4.306 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@H]1C(C=O)=CC[C@@H]2C(C)(C)CCC[C@@]12C 2356510005 KLGPVOFVVYHEGO-KNKQGSTJSA-N 376.493 4.319 50 1 GIGF O=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1cccc(O)c1 299829749 LCZSOEWCSCAEFA-UHFFFAOYSA-N 398.418 4.394 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCl)c1ccc(O)cc1 587543448 KNQSZMXNLZVWEH-GHTZIAJQSA-N 382.799 4.194 50 1 GIGF Cc1ccc2c(c1)[C@]1(N[C@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 587744412 ZTAARCZUDVSLBY-MPBGBICISA-N 399.263 4.474 50 1 GIGF Cc1ccc2c(c1)[C@@]1(N[C@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 587744413 ZTAARCZUDVSLBY-ODXCJYRJSA-N 399.263 4.474 50 1 GIGF CC(=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@H]4C(C=O)=CC[C@@H]23)O1)CO 2356324324 IXOCIELJWNTVCH-HXVOOFQVSA-N 398.543 4.186 50 1 GIGF C[C@](Cl)(C=O)C=C[C@@H](Br)[C@](C)(Cl)C=CBr 2356306754 JDUDNUKHKRTULQ-OPRDCNLKSA-N 378.919 4.409 50 1 GIGF CC[C@@H]1C[C@@H]1[C@@H]1OC(=O)CCCC=CCC=C[C@@H]2[C@H](O)[C@H](Br)C[C@H]21 2356793905 KULVVWPMIUGXPG-AYGHAXAXSA-N 397.353 4.391 50 1 GIGF Cl[C@H](Cn1ncc2c(NCCc3ccccc3)ncnc21)c1ccccc1 40405569 FSEASSKBJKLGGN-LJQANCHMSA-N 377.879 4.461 50 1 GIGF O=[N+]([O-])c1ccc2nn(Cc3ccccc3)c(OCCCBr)c2c1 653717108 OHNPMZRZWWQQCT-UHFFFAOYSA-N 390.237 4.157 50 1 GIGF O=C(N/N=C\c1ccc(COc2ccc([N+](=O)[O-])cc2)o1)c1cccc(Cl)c1 13108690 NTTQBGWLVYQFAL-NHDPSOOVSA-N 399.790 4.184 50 3 GIGF O=C(O)CCC/C=C\C[C@H]1[C@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 13888914 ZOQXTNLUBHPZOZ-ONQJZQEDSA-N 384.944 4.289 50 1 GIGF in-vitro O=C1c2ccc(O)cc2O[C@](CBr)(C2CC2)[C@H]1c1ccc(F)cc1 587324400 YPSQUTBAJQZABS-PKOBYXMFSA-N 391.236 4.434 50 1 GIGF O=C(O)CCC/C=C/C[C@@H]1[C@H](Cl)C[C@H](O)[C@@H]1/C=C\[C@H](O)C1CCCCC1 261192077 ZOQXTNLUBHPZOZ-CVIZRMAMSA-N 384.944 4.289 50 1 GIGF in-vitro Cc1ccccc1/C=N/NC(=O)c1ccc(-c2nnc(-c3ccccc3O)o2)cc1 473167236 GVWLGPPLAGWXQO-ZVHZXABRSA-N 398.422 4.182 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CC(C)C)([C@@H](Cl)C(=O)OCC)CC2=O 587459734 PGGUDTQBNWPPHU-ICSRJNTNSA-N 382.884 4.265 50 1 GIGF COc1ccc(C[C@H]2CC(=O)O[C@@H]2CO[Si](C)(C)C(C)(C)C)cc1OC 1772597488 OITDRWVMNFKYBN-MAUKXSAKSA-N 380.557 4.200 50 1 GIGF COc1ccc2c(c1)N(CC1CCCCC1)C(=O)/C2=N\NC(=O)C1CCCCC1 40974790 SGSNRQUWPQAYOG-FLFQWRMESA-N 397.519 4.023 50 1 GIGF CCCCCC(=O)OC[C@]1(C)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 1772629915 ZNWNJGLETZOGIH-LGTDJQLHSA-N 382.497 4.114 50 1 GIGF N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@H]1c1ccccc1Cl 1772634859 ANQGTAVFBAXZSG-SFHVURJKSA-N 399.841 4.237 50 1 GIGF COC(=O)/C=C/c1cccc([C@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)c1 73196328 YUPAXNZLZIMBTR-FQTAANOTSA-N 382.419 4.244 50 1 GIGF C=C(C=O)[C@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C/C)cc2[C@@H]1OC(=O)/C(C)=C/C 238771503 PDBXOOAXGJDJOB-HGPGDARXSA-N 398.455 4.324 50 1 GIGF Cc1c(F)ccc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c12 587010029 ZRXWWABEKOGSTL-KRWDZBQOSA-N 384.842 4.131 50 1 GIGF CN(C)/C=C(\C#N)[C@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 587529603 AGVZBDKYNOMXPU-FDGLKFFFSA-N 378.497 4.457 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(C(=O)O)cc1CBr 587898679 OPYSIZVQUIQIBM-UHFFFAOYSA-N 379.637 4.342 50 1 GIGF C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C(=O)CBr)[C@@H]1CCC2=O 3927303 AGHFYYSPGSRXOM-IEYYFSCXSA-N 393.321 4.032 50 1 GIGF CC(=O)NC1=C(C#N)[C@H](c2ccccc2)C2=C(C[C@@H](c3ccccc3)CC2=O)O1 64549311 LPTXCIPKWKYQCQ-AVRDEDQJSA-N 384.435 4.072 50 1 GIGF CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)cc2F)c(C(=O)OC)c1 101459822 NTVZXBSUEDTOAT-VLGSPTGOSA-N 386.354 4.103 50 1 GIGF O=C(N/N=C1/c2ccccc2-c2nc3ccccc3nc21)c1ccc(Cl)cc1 103228892 BEQOWINNAKQGPZ-QOMWVZHYSA-N 384.826 4.446 50 1 GIGF C=C(C)[C@H](Cl)CC=C(C)[C@@H]1CC[C@]2(C)OC3=C(C[C@@H]12)C(=O)[C@@]1(O)CO[C@H]3C1 2356691680 SPHHHXFBOCONBA-PVCCVCOLSA-N 392.923 4.068 50 1 GIGF N#Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(CCl)c1 587877570 BEQXHEIBXCQNQQ-UHFFFAOYSA-N 391.685 4.314 50 1 GIGF COC[C@@H](C)n1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587370741 BKIGSNFEYPUVEY-SPLOXXLWSA-N 390.911 4.302 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C#N)=COc1ccccc12 587743096 VEYDRGCHNQLRRS-NSPYISDASA-N 385.236 4.166 50 1 GIGF CCOC(=O)c1cnc2c(cnn2C[C@H](Cl)c2ccccc2)c1N1CCCC1 13491827 JYZVRXBAEBBEHF-SFHVURJKSA-N 398.894 4.188 50 1 GIGF C=C1[C@@H](C)C[C@@H](OC(=O)/C=C\c2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 238755174 RIGSJIIZCIKSKY-ONZSPIJZSA-N 378.468 4.174 50 1 GIGF Cc1ccc2c(c1)[C@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C(C#N)=CO2 587572542 PSQFVWDDAAFZJG-ZJSXRUAMSA-N 397.386 4.358 50 1 GIGF COc1cc2c3c(c1)O[C@@]1(c4ccsc4CC[C@@H]1Br)[C@@H](C2)C3=O 587453632 RNLWFFQZXCQRPQ-QITLCBANSA-N 391.286 4.109 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@@H]3O[C@H](O)[C@@H]1[C@@]32C 2356572930 SRJIDFQIECGKBW-DNWZOHJTSA-N 382.928 4.209 50 1 GIGF CC[C@]1(CCCCl)c2scnc2C[C@@H](C(=O)O)N1C(=O)OC(C)(C)C 963143124 KWICASSLUGSBDM-SJCJKPOMSA-N 388.917 4.014 50 1 GIGF CCC[C@H]1C[C@@H](OC(C)=O)C(Cl)=C(C(Br)Br)O1 2356792336 JPGOTFWANJGLNW-JGVFFNPUSA-N 390.499 4.073 50 1 GIGF C=C1C[C@H](OC(C)=O)[C@H](Br)C(C)(C)[C@@]12CC=C(C)C[C@H]2OC(C)=O 13379290 UFKFDTHMWZFEOE-ZMMAXQRCSA-N 399.325 4.326 50 1 GIGF biogenic CC(C)=CCOc1ccc([C@@H]2C[C@@H]2C(=O)NNc2nncc3ccccc23)cc1 49067069 VCYCXVVUFLVCEQ-SFTDATJTSA-N 388.471 4.222 50 1 GIGF COc1ccc2c(=O)cc([C@H](C)Br)oc2c1CBr 73197775 PMNNIKBGAHQHRV-ZETCQYMHSA-N 376.044 4.152 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)[C@@H]2CCC[C@@H]3O[C@H](C)C[C@@H]32)C(C)(C)C)c1 299846651 WDYHWAPYSQDGTB-AFYVEPGGSA-N 386.536 4.169 50 1 GIGF COc1ccc([C@](C)(O)c2nc(N3CCC(Cl)CC3)nc3ccccc23)cc1 1911585364 GQWVVUXQFNQZKC-QFIPXVFZSA-N 397.906 4.102 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)cc1F)[C@@H](C2)C3=O 587425685 GGFXWVBNHYZIOA-UGSOOPFHSA-N 395.199 4.011 50 1 GIGF O=C([C@H](Cl)[C@@]1(C2CC2)c2c(F)cccc2C[C@@H]2CCCN21)C(F)(F)F 963094699 CRAQFGJCIMXNFR-YLQAJVPDSA-N 375.793 4.190 50 1 GIGF C/C(CCC(=O)Nc1cccc(F)c1)=N\NC(=O)c1ccc(-n2cccc2)cc1 1772593045 BRDMZKMMOWTUCB-PCLIKHOPSA-N 392.434 4.141 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 102188186 UZRHATKYSCLMQF-BOHVNUKXSA-N 380.403 4.163 50 1 GIGF O=C(O)[C@H]1Cc2c(Cl)cc(F)c(F)c2[C@](CCCl)(c2cccs2)N1 962998178 SKTSMGCZTYITKE-BZNIZROVSA-N 392.254 4.151 50 1 GIGF Cc1cccc(C(=O)N(NC(=O)c2ccc3c(c2C)C[C@@H](C)O3)C(C)(C)C)c1 103203921 VLCTZHVJXYWGLV-OAHLLOKOSA-N 380.488 4.213 50 1 GIGF O=C1c2ccccc2[C@@]2(NCCc3c(Cl)cc(Cl)cc32)[C@@H]1Br 963127249 ZYJCWPUCXJYVCQ-SJORKVTESA-N 397.099 4.343 50 1 GIGF CC1=CC(=O)[C@H]2C(C=O)=CC[C@H]3[C@@]4(CC[C@]3(C)C[C@H]12)O[C@@H](/C=C(\C)CO)C[C@@H]4C 1857555013 IXOCIELJWNTVCH-UXKDEEFMSA-N 398.543 4.186 50 1 GIGF CC1=NN(c2ccccc2)[C@]2(C1)[C@H](Cl)C(=O)N2c1nc2ccccc2s1 5964602 BARPPGCSDZGDGV-VQIMIIECSA-N 382.876 4.233 50 1 GIGF COC(=O)C1=C(C(F)(F)F)N(C)C(C)=C(C#N)[C@H]1c1ccc(F)cc1Cl 58568651 BAVATTCEWXIPMY-CYBMUJFWSA-N 388.748 4.295 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 586973337 HYWQLBPBMIXDSS-SECBINFHSA-N 377.213 4.447 50 1 GIGF Nc1ccc2[nH]c(C(=O)N3C[C@@H](CCl)c4c3cc(N)c3ccccc43)cc2c1 1653498 PBDNTIFKUNPLTI-CYBMUJFWSA-N 390.874 4.468 50 1 GIGF O=C(c1c(CO)oc2cc(Br)cnc12)[C@@H](Cl)c1ccccc1 587275774 FRVXWAPXFNMHHM-AWEZNQCLSA-N 380.625 4.245 50 1 GIGF NC(=O)Nc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587498949 REWLPTAXFREZSR-OAQYLSRUSA-N 384.863 4.156 50 1 GIGF COc1cccc(/C=N/NC(=O)c2cc(C)nc3ccc(Br)cc23)c1 103229986 ZAZMEJZUVYBFRD-SRZZPIQSSA-N 398.260 4.078 50 1 GIGF CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]1Cl 587327890 HZTZXISCFQCGMB-PIKOESSRSA-N 376.811 4.045 50 1 GIGF NNC(=O)c1ccc2nc(Cc3ccc(-c4ccccc4Cl)cc3)[nH]c2c1 587062193 FBXXLHWGYZLRLO-UHFFFAOYSA-N 376.847 4.078 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2ccc(I)cc2[nH]1 587087823 VUAIETWOXZICST-SECBINFHSA-N 397.029 4.352 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](CBr)(C2CC2)N1 587673527 NSZKOEBVPRYEQU-RTHLEPHNSA-N 377.095 4.123 50 1 GIGF Cc1ccc(S(=O)(=O)N(Nc2ccccc2)C(=O)Oc2ccccc2)cc1 653805746 BKBWRWKRVCXJGR-UHFFFAOYSA-N 382.441 4.212 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc3c4c(c1)cc(O)n4CCC3)O2 587371160 DPWBBGQYIKTBRB-JOCHJYFZSA-N 396.874 4.283 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3ccccn3)c1C)O2 587374226 VGVVOFSLRGEVKS-JOCHJYFZSA-N 395.890 4.479 50 1 GIGF N#Cc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587541263 AIZAROIFIAUIHJ-DENIHFKCSA-N 391.810 4.360 50 1 GIGF Cc1cccc([C@@]2([C@@H](C)Br)NCCc3c2c(C(C)C)nn3C)c1 962916082 IUCOPCHQLMXDRX-AUUYWEPGSA-N 376.342 4.025 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(C(=O)Cl)c1ccc(F)cc1 587573732 XCIWTDWDPCOOEU-LAUBAEHRSA-N 398.773 4.154 50 1 GIGF C=C(C)[C@H](Cl)C/C=C(/C)[C@@H]1CC[C@]2(C)OC3=C(C[C@@H]12)C(=O)[C@@]1(O)CO[C@@H]3C1 685935938 SPHHHXFBOCONBA-FCWVIISWSA-N 392.923 4.068 50 1 GIGF biogenic,in-vitro O=C(O)[C@@H]1Cc2cc(F)ccc2[C@@](CCCCl)(c2cccc(Cl)c2)N1 962892482 FVFVKKAMZOFBCJ-PKOBYXMFSA-N 382.262 4.341 50 1 GIGF COc1ccc(Cc2coc3cc(OCCCCCl)cc(O)c3c2=O)cc1 1772597311 CBDVKCYVQQJJDS-UHFFFAOYSA-N 388.847 4.496 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 586970953 MRITWXUPBIJVOR-NSHDSACASA-N 376.176 4.314 50 1 GIGF Cn1cccc1CN1CCc2sccc2[C@@]1(CCl)c1ccc(C#N)cc1 962371678 HHTKVJILDBKLRP-OAQYLSRUSA-N 381.932 4.499 50 1 GIGF Cn1ccnc1[C@]1(CCl)c2ccccc2CCN1[C@H](C#N)c1ccccc1 963199770 DAPUUZPHSHULLO-IRLDBZIGSA-N 376.891 4.025 50 1 GIGF N#CC1=C(N)Oc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2[C@@H]1c1ccccn1 4075041 BCSAKHYDYBSHNM-FQEVSTJZSA-N 391.434 4.357 50 1 GIGF COc1cccc2c1cc1n2C(=O)[C@H](SSCc2ccccc2)N(C)C1=O 13553910 LHSHXLIQINTOOF-FQEVSTJZSA-N 398.509 4.283 50 1 GIGF Cc1onc(/C=C/C#N)c1-c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 34290542 DUNFVIXDSVWNSQ-NSCUHMNNSA-N 376.256 4.499 50 1 GIGF O=C(CCCCl)Nc1ccc(SCC(=O)Nc2ccc(Cl)cn2)cc1 96908530 IBNBCZAJGBKREX-UHFFFAOYSA-N 398.315 4.423 50 1 GIGF O=C(N/N=C/c1cccc(O)c1O)c1ccc(-c2nc3ccccc3s2)cc1 299865082 NCJPCWWBPIQOTJ-WSDLNYQXSA-N 389.436 4.138 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C\N(C)C)(c1ccccc1Cl)O2 587376012 BMBHMEKGTLZSOQ-KXXOPMGUSA-N 381.863 4.060 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@@H]1c1cccc(O)c1 1857604296 FZSDKEJIGKBJIN-GOSISDBHSA-N 381.391 4.017 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(OC)ccc1OC)CC2=O 587460553 UAGJKFQSLUKSQV-NRFANRHFSA-N 390.863 4.461 50 1 GIGF Cc1c(/C=C(\C#N)C(=O)NCC2CCCCC2)c2ccccc2n1CCN(C)C 40973905 YFAARTBKYOHSTK-HMMYKYKNSA-N 392.547 4.115 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 586973215 GVRQUZQVWMVGBB-SECBINFHSA-N 377.213 4.447 50 1 GIGF COc1cc2c3c(c1)O[C@](c1[nH]c(C)c(C(C)=O)c1C)([C@@H](C)Cl)[C@@H](C2)C3=O 587417683 OJEPAGDGLXMDEA-PYDTXJQDSA-N 387.863 4.113 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(C#N)cc2)N1 587690003 YPIDIOZBVUEGNZ-ADLMAVQZSA-N 393.687 4.476 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@@H]1c1ccc(F)cc1 1857590337 ALWFMQDMXPLYSU-GOSISDBHSA-N 383.382 4.451 50 1 GIGF CC1(C)C(Br)=C[C@@H]2O[C@]2(C)[C@@]12C[C@H](Br)[C@]1(C)C[C@H]2O1 2356851372 QGZVAFYBURCCNT-DXIVLCDLSA-N 392.131 4.164 50 1 GIGF O=C(Nc1nccs1)c1c(CCl)nc2c(C(F)(F)F)cccc2c1O 29236906 DDWDFSXHAPAIOE-UHFFFAOYSA-N 387.770 4.407 50 1 GIGF NNC(=O)Cn1c(-c2ccccc2O)cc(-c2ccccc2)c1-c1ccccc1 66078662 XPCFNTKLKXYMQC-UHFFFAOYSA-N 383.451 4.185 50 1 GIGF O=C(CCCl)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496757 FLGHAIKCVYMJPD-QHCPKHFHSA-N 397.902 4.171 50 1 GIGF C=C1[C@@H](CBr)O[C@@]2(C)CC[C@@H](Br)C(C)(C)[C@@H]2C[C@H]1O 2356489834 LWYFAEHJQSCFQJ-VVSAWPALSA-N 396.163 4.046 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@]2(C)[C@@H]1C(C=O)=C[C@@H]1CC(C)(C)C[C@H]12 100782782 NFCOJBIECSQMAM-ZISHLKMASA-N 384.472 4.149 50 1 GIGF endogenous,in-man C=C(C=O)[C@@H]1Oc2ccc([C@H](C)OC(=O)C(C)=CC)cc2[C@@H]1OC(=O)C(C)=CC 2356639417 PDBXOOAXGJDJOB-NDXORKPFSA-N 398.455 4.324 50 1 GIGF COc1cc(/C=C\CO)cc(OC)c1OC/C=C(\C)C/C=C/C(C)(C)OO 85799236 RVCISGRHDQEYDW-FRIQHKRZSA-N 378.465 4.249 50 1 GIGF COc1ccc(-c2ccc(C(=O)NCCCSSCCN(C)C)o2)cc1 618012432 FIPUTBLFUUEBED-UHFFFAOYSA-N 394.562 4.018 50 1 GIGF CC[C@H](Br)[C@H]1CC=CC[C@@H]2O[C@@H](C=C=CBr)C[C@@H]2O1 137129903 ZFUYDSOHVJVQNB-PJROQUJHSA-N 392.131 4.485 50 1 GIGF CC(=O)NCc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587496347 CLLYQMWPRXEWHN-QHCPKHFHSA-N 397.902 4.301 50 1 GIGF N#CC1=C(N)Oc2ccc3ccccc3c2[C@H]1c1cccc(C#CCCCO)c1 73195816 YVKLFXFOUNBXBO-QHCPKHFHSA-N 380.447 4.182 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(OCCCCl)c(OC)c1)[C@@H](C2)C3=O 587423640 VDMRFQJEOSQKGH-YCRPNKLZSA-N 388.847 4.200 50 1 GIGF CN(C)c1ccc(/C=N/NC(=O)c2nc3ccccc3nc2-c2ccccc2)cc1 40915007 UIAHROXZZKFISI-PCLIKHOPSA-N 395.466 4.127 50 1 GIGF Cc1cccc(C)c1N/C=C1\C=C(C=O)c2c(ccc3c(C)cc(=O)oc23)C1=O 102897260 ONVXNFHRLVOOPC-LFIBNONCSA-N 385.419 4.493 50 1 GIGF C=C1[C@H](O)C[C@H]2C(C)(C)[C@@H](Br)CC[C@]2(C)O[C@H]1CBr 238756962 LWYFAEHJQSCFQJ-MCZMQQNQSA-N 396.163 4.046 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(CCc1ccccc1)[C@@H](C2)C3=O 587413296 GOAAJPFWJKCIKI-JXFKEZNVSA-N 387.273 4.209 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1cccc(F)c1CBr)[C@@H](C2)C3=O 587423947 LWOZTRDEXCDNMN-KPZWWZAWSA-N 377.209 4.218 50 1 GIGF Cn1ccc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 587328095 SWYOPZDCLHNTJH-FPOVZHCZSA-N 385.822 4.363 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(-c3c[nH]c4ccc(C#N)cc34)c(CCCl)c2c1 587648458 AEZSRCFCHMOJID-UHFFFAOYSA-N 397.887 4.373 50 1 GIGF CS(=O)(=O)Nc1ccc(-c2csc(/C(C#N)=C/c3cccs3)n2)cc1 587924368 UWOOULTZMQOZLJ-UKTHLTGXSA-N 387.511 4.307 50 1 GIGF CO[C@H]1O[C@@]2(C)OO[C@]13[C@H](CCOCc1ccccc1)CCC[C@@H]3C[C@@H]2C 102179690 XCVQTZNHQAJEIO-KHUIRXAESA-N 376.493 4.455 50 1 GIGF COc1ccc(CCl)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl 587878495 HOFJRRWPXFGVEJ-UHFFFAOYSA-N 396.701 4.451 50 1 GIGF C=C(C)C[C@@H](OC)[C@@H](C#N)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C 197979259 CLZQZVYEOXAFHV-DHIUTWEWSA-N 393.603 4.436 50 1 GIGF CCOc1ccc([C@]2([C@@H](C)Cl)NC[C@@H]3CC(=O)N(C)c4cccc2c43)cc1 963033861 VLMXLRWJZAOZAB-GTQRCTGISA-N 384.907 4.010 50 1 GIGF N#CC1=CC2(c3ccccc3Nc3ccccc32)N(/N=C/c2ccc(F)cc2)C1=O 1857772905 DMCYKACABJAPIE-JFLMPSFJSA-N 394.409 4.453 50 1 GIGF C#CC=CCC(Br)=C1C[C@@H]2O[C@H](CC)[C@H](Br)C[C@H]2O1 2356500137 OGLSYOBOMBXPEB-GBOPCIDUSA-N 390.115 4.292 50 1 GIGF N#C/C(=C1/Nc2ccccc2S1)c1ccnc(NCCc2ccc(N)cc2)n1 13647773 CPNVYKFYEFEQKU-CAPFRKAQSA-N 386.484 4.123 50 1 GIGF COc1ccc(/C=N/NC(=O)CSc2cc(C)nc3ccccc23)cc1Cl 72109046 ZPOHZKBURNLYOC-SSDVNMTOSA-N 399.903 4.448 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@H](Oc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103105646 QBWAUDCKUYPUNV-PGEAIUTCSA-N 378.440 4.413 50 1 GIGF N#CC(C#N)=Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 587883630 PVZOSNXJWJRHFI-UHFFFAOYSA-N 394.261 4.134 50 1 GIGF Cc1ccc([C@]2(CCl)N[C@@H](C(=O)O)Cc3c(Cl)cc(F)c(F)c32)s1 962972396 UQNKEOUAELDHPI-BZNIZROVSA-N 392.254 4.069 50 1 GIGF CCC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@@H](C=C=CBr)C[C@H]2O1 2356545023 MALGKLBGBZTMPV-SPXPDEDDSA-N 392.131 4.485 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)([C@H](C#N)c1nc(C)cs1)CC2=O 587493449 HOLJPPTTZDSIFD-KUHUBIRLSA-N 390.892 4.360 50 1 GIGF COc1ccc2c(c1OC)[C@@H](c1ccc(CCl)cc1)NCC21CCOCC1 963186826 GXUGWEPGHCYNQN-HXUWFJFHSA-N 387.907 4.183 50 1 GIGF N#CC1=C(N)OC(c2ccccn2)=C([S@](=O)c2ccccc2)[C@H]1c1ccccc1 1857641747 YLORRRPESSBODW-AFJIDDCJSA-N 399.475 4.066 50 1 GIGF CC[C@@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@H]2CC=C[C@H]1Br 2356803524 XERQFTJKXUDTGT-QFZSPTBQSA-N 378.104 4.095 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(C)c(F)c1)O2 587381658 KWKZIZJDTZQLGD-GOSISDBHSA-N 378.241 4.280 50 1 GIGF CCCC[C@@H](/C=N\NC(=O)N1CCCc2ccccc21)NC(=O)OC(C)(C)C 37858420 BEHFWCMFOMSYBI-WPGBELRESA-N 388.512 4.218 50 1 GIGF COc1cc(/C=N/NC(=O)CSc2cc(C)nc3ccccc23)ccc1Cl 72110798 NQJYUCJFWBZABM-SSDVNMTOSA-N 399.903 4.448 50 1 GIGF C[Si](C)(C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 197620825 FVVKAWTWWBNYIX-SRZZPIQSSA-N 391.450 4.112 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(CBr)cc1F)[C@@H](C2)C3=O 587425953 ISSZMTDGSTYDAY-SCLBCKFNSA-N 377.209 4.218 50 1 GIGF CN(c1ccc(-c2csc(C(C#N)=C3CCCCC3)n2)cc1)S(C)(=O)=O 8209783 JBZVYPLCLPRADI-UHFFFAOYSA-N 387.530 4.447 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2C2(CC(CBr)C2)N1 587672803 IBTYTVDATAXGEN-JUXJKVCFSA-N 377.095 4.123 50 1 GIGF CN(C)CCSSCCNC(=O)c1ccc(Oc2ccccc2)cc1 618007659 DOILDFXVTXTGIH-UHFFFAOYSA-N 376.547 4.152 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 103196257 DWAVMDSJIRPCPO-JKSUJKDBSA-N 385.832 4.127 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 103167311 DKLRKSZQSVUEJP-JKSUJKDBSA-N 388.210 4.492 50 1 GIGF C[C@@]1(CC(=O)NCc2ccccc2OC(F)(F)F)CC2(CCCCC2)OO1 49678936 QDHOZPCLAACLAH-QGZVFWFLSA-N 387.398 4.405 50 1 GIGF O=c1cc(CSC(=S)N(CCCl)CCCl)oc2ccccc12 42921917 CTRCQTAGWUSWPE-UHFFFAOYSA-N 376.330 4.091 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cc(F)cc(F)c1)O2 587385350 NKBKXZYSJJCGHL-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4nccc(Cl)c14)[C@@H](C2)C3=O 587419364 CKWIHIRDTBAAMX-JEOXALJRSA-N 389.238 4.107 50 1 GIGF O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)Oc1ccc([N+](=O)[O-])cc1 43409148 JLZZJRDRDVGIDJ-HXUWFJFHSA-N 390.395 4.062 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587546241 VFQTWOWTSFJZEX-PXNSSMCTSA-N 385.803 4.093 50 1 GIGF Cc1ccc(-c2csc(NC(=O)NCCSSCCN(C)C)n2)cc1 618007824 JSSZNEZDURPBLC-UHFFFAOYSA-N 396.607 4.183 50 1 GIGF C[C@H](COC[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C 2356519375 YTNMLZVAADXGMA-CABCVRRESA-N 394.733 4.089 50 1 GIGF C=C(C)[C@H](Cl)CC=C(C)[C@@H]1CC[C@@]2(C)OC3=C(C[C@H]12)C(=O)[C@@]1(O)CO[C@H]3C1 2356691679 SPHHHXFBOCONBA-OFGMKEHYSA-N 392.923 4.068 50 1 GIGF NNC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1-c1nc2ccccc2[nH]1 13005106 MTURNYINKAJCQZ-UHFFFAOYSA-N 390.057 4.447 50 1 GIGF N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccccc1)C1CC1 73159686 VKQAHJGPMGPUFN-XLCPLWEUSA-N 381.819 4.423 50 1 GIGF Cc1ccccc1/C=C1\CN(C)CC2=C1OC(N)=C(C#N)[C@H]2c1ccccc1C 40605951 DRBHVAYLZITACG-NOPGXUSGSA-N 383.495 4.394 50 1 GIGF O=C(N/N=C1\C(=O)N(c2ccccc2)c2ccccc21)c1cc2ccccc2o1 206390060 COCRTAQATUJASH-FLFQWRMESA-N 381.391 4.245 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OCCBr)c1)O2 587372230 HXCWRXITVXKRCK-KRWDZBQOSA-N 376.250 4.057 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCl)COc1ccccc1 587543155 JQLXBFNKRIIIHY-DENIHFKCSA-N 396.826 4.410 50 1 GIGF Cc1ccc(Oc2ccc(C(=O)NCCSSCCN(C)C)cc2)cc1 618009071 RLHRIQIMXIHXBC-UHFFFAOYSA-N 390.574 4.460 50 1 GIGF CCOC(=O)c1[nH]c2cc(Cl)ccc2c1/C=N/NC(=O)CC1CCCC1 1857568173 NAGQEUPFAMXLQP-SRZZPIQSSA-N 375.856 4.028 50 1 GIGF C[C@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 58504633 SBCGDCBRWXAAIF-PEDOCSDGSA-N 386.488 4.398 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)([C@@H](C)Br)[C@@H](C2)C3=O 587427510 IIJVMJFMIGUIAM-XAILHKCVSA-N 391.236 4.261 50 1 GIGF O=C1OC(=O)c2cc(-c3nc4cc(OC(F)(F)F)c(Cl)cc4[nH]3)ccc21 586907662 NMSZIPSFLRXFSH-UHFFFAOYSA-N 382.681 4.093 50 1 GIGF C[C@]1(CCCBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539724 XWLSJRCPSPMUQP-MAUKXSAKSA-N 377.234 4.288 50 1 GIGF CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2cccc(Cl)c2)c(C(=O)OC)c1 101459813 GCQDAIAICFECST-ZCXUNETKSA-N 384.819 4.478 50 1 GIGF Cc1ccc(NC(=O)N2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)cc1 44202068 NEQQCFSSPLVKDN-UHFFFAOYSA-N 398.503 4.450 50 1 GIGF COc1cc2c3c(c1)O[C@@](CSC#N)(c1sccc1Cl)[C@@H](C2)C3=O 587454449 ZEBNEFLKDVDRLZ-APPDUMDISA-N 377.874 4.267 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(Cl)cc1)O2 587372071 HEWLUCIUCXLENJ-KRWDZBQOSA-N 380.669 4.486 50 1 GIGF CCOC(=O)c1cnc2c(cnn2C[C@@H](Cl)c2ccccc2)c1NC1CC1 13491816 DQSKSPGAGGAIOZ-QGZVFWFLSA-N 384.867 4.162 50 1 GIGF Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)on1 587326653 MGUAQMPYMLJDTC-UYAOXDASSA-N 387.794 4.321 50 1 GIGF C[C@@H]1CC[C@H]2[C@@](C)(C(=O)Sc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@H]1[C@@]23OO4 103188967 RLMAGUNMIOCDGD-DASLHKFDSA-N 390.501 4.310 50 1 GIGF O=C1/C(=N/c2ccc(F)cc2)[C@H](Cl)C(=O)N1c1ccc(Cl)c(Cl)c1 169687473 ZSBZOQPTCBJQKU-NONDHBLVSA-N 385.609 4.386 50 1 GIGF CCOC(=O)C1=C(O)C[C@H](c2ccccc2)N(C(=O)CCl)[C@H]1c1ccccc1 100078273 OLZUOULUTZTBDG-UTKZUKDTSA-N 399.874 4.315 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2ccc(F)c(Br)c2[nH]1 586971570 TXUILHCUZSCLEO-SNVBAGLBSA-N 380.055 4.326 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CBr)(c1ccc(N)cc1)CC2=O 587456084 KIRQYVIJLAYBND-IBGZPJMESA-N 390.277 4.183 50 1 GIGF CN(C)CCSSCCCNC(=O)c1ccccc1Cc1ccccc1 618009043 QENQGUUQDUZUTN-UHFFFAOYSA-N 388.602 4.340 50 1 GIGF C=C1[C@H](O)C[C@H]2C(C)(C)[C@H](Br)CC[C@]2(C)O[C@H]1CBr 2356489833 LWYFAEHJQSCFQJ-KDBYPZKRSA-N 396.163 4.046 50 1 GIGF C[C@]12C=C3C(=O)C[C@H](c4ccccc4)C[C@@]3(OO1)O[C@H]2c1ccc([N+](=O)[O-])cc1 96933991 QJJZTHNUOHCECI-ZIPUMODLSA-N 393.395 4.156 50 1 GIGF CCCCCC(=O)OC[C@@]1(C)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 1772629916 ZNWNJGLETZOGIH-USANHHIESA-N 382.497 4.114 50 1 GIGF CCOC(=O)/C(C#N)=C\Nc1ccc2ncnc(Nc3ccccc3CC)c2c1 95604383 PNDWLOMOJSPEMN-SSZFMOIBSA-N 387.443 4.318 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cc4ccccc4o1)[C@@H](C2)C3=O 587411260 CPFLRXBMOWAVRX-XOBRGWDASA-N 399.240 4.479 50 1 GIGF N#C/C(C(=O)Nc1ccc(C(F)(F)F)cc1)=C(/O)c1ccc([N+](=O)[O-])cc1 59034388 SKHJQPAQCABKOI-PFONDFGASA-N 377.278 4.045 50 1 GIGF COC(=O)/C=C(\C)CC[C@@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=C(C=O)C[C@@H]21 95909213 RYBWQXGDQMJOIS-XRXCJDGOSA-N 390.520 4.405 50 1 GIGF biogenic,in-vitro C[C@H]1[C@@H](O[C@H](C#N)c2ccccc2)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]1[C@@]24OO3 103036651 AKXUGEWGUZMDGE-UPJWIIGRSA-N 399.487 4.476 50 1 GIGF C[C@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]32OO4 194892223 SBCGDCBRWXAAIF-NGQOLSHVSA-N 386.488 4.398 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 587087779 UDWXKWGBGGDZSK-BYPYZUCNSA-N 375.551 4.161 50 1 GIGF CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1Cl 587327887 HZTZXISCFQCGMB-LCLWPZTBSA-N 376.811 4.045 50 1 GIGF O=C1NC(=O)[C@]2(C3CCC3)Cc3ccccc3[C@]3(CCCCCC[C@@H]3Cl)N12 962661687 IANVPEFUYPMOGB-YUXAGFNASA-N 386.923 4.490 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2cccs2)c1 38145327 KVBKSLWDDPQZCU-NGYXKBBWSA-N 379.510 4.355 50 1 GIGF CCOc1ccc([N+](=O)[O-])cc1C(=O)NN(c1ccccc1)c1ccccc1 84669095 GSFFKDVIADZFPT-UHFFFAOYSA-N 377.400 4.477 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1cccc(C(=O)OC)c1)CC2=O 587458475 CGWFRSDGPWKCKH-NRFANRHFSA-N 388.847 4.231 50 1 GIGF ClC[C@@]1(c2cscn2)c2ccccc2C[C@H]2CN(c3ccccc3)CCN21 962627936 IIBMQCCPCRSMCQ-UGKGYDQZSA-N 395.959 4.372 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(C(Cl)Cl)N1 587689449 SMVLAUJDDRMUPI-SREIQFSDSA-N 375.496 4.360 50 1 GIGF COc1ccc(OC)c2c1C[C@H](C)N[C@]2(CBr)c1ccc(F)cc1 963576892 AWYSKBOBGBBMNV-HXPMCKFVSA-N 394.284 4.016 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@H]1[C@]32OO4 43888885 SBCGDCBRWXAAIF-WXGMYWTDSA-N 386.488 4.398 50 1 GIGF Cc1ccccc1/C=N/NC(=O)CCCCCCC(=O)Nc1ccccc1O 95808865 HJHCELYDBFOQDU-XQNSMLJCSA-N 381.476 4.130 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(CC(=O)O)s1)CC2=O 587495201 PSTRZOMQVHLIIM-LJQANCHMSA-N 394.876 4.133 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(CBr)c(Oc3ccccc3)c2c1 587648564 IOJDGBUGQBKENL-UHFFFAOYSA-N 380.263 4.259 50 1 GIGF CCN(CC)Cc1ccc2nc(NC(=O)N/N=C(\C)c3ccccn3)sc2c1 1857613488 DCPOJVPZUKRYJU-ZVHZXABRSA-N 396.520 4.079 50 1 GIGF C=C(C)[C@@H]1CC[C@](C)([C@@H]2CC[C@](C)(N=C=S)[C@@H]3CC[C@](C)(O)[C@H](NC)[C@H]32)O1 2356874897 ZWINEQINZVLQEU-BMZFMZSISA-N 392.609 4.137 50 1 GIGF C=C(C)[C@@H]1CC[C@](C)([C@@H]2CC[C@](C)(N=C=S)[C@@H]3CC[C@](C)(O)[C@@H](NC)[C@H]32)O1 2356874900 ZWINEQINZVLQEU-XQJOZJDQSA-N 392.609 4.137 50 1 GIGF CC[C@@]1(CBr)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587322870 PJRVYGSNAUMQAV-WMZOPIPTSA-N 379.225 4.434 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 587541596 CKNDESCMYNYDBT-JXFKEZNVSA-N 385.803 4.093 50 1 GIGF CC1(C)C[C@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]23C1 36378448 CWCXONZIEDNVKI-MQJZHBLNSA-N 399.325 4.010 50 3 GIGF in-vitro CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)C=C1[C@H](Br)CCl 85951768 QXFISWVHGXXPPG-MXWKQRLJSA-N 388.527 4.040 50 1 GIGF O=C(O)Cc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)s1 587531819 MLOAMVMAXMXLNP-FQEVSTJZSA-N 390.888 4.354 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1c(F)cccc1F)[C@@H](C2)C3=O 587424997 ZUEWCZWEWBKOKW-BBATYDOGSA-N 395.199 4.011 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@H]1c2ccsc2CCN1Cc1cccnc1 963000694 WQIMOTNZPVUGAK-HXUWFJFHSA-N 386.952 4.343 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(C(=O)Cl)cc1F 587893734 AVMDWHWNAPXDEM-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(F)c(CBr)c1)[C@@H](C2)C3=O 587423913 LIFUGBZDVAFNOF-SCLBCKFNSA-N 377.209 4.218 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(c2cscn2)[C@H]1c1ccc(F)cc1 587374569 PDZQOWQDWTWUOR-PKOBYXMFSA-N 389.835 4.481 50 1 GIGF O=CN1CCc2cc([C@@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 587499563 VOPFJTIGIZPCNY-QHCPKHFHSA-N 395.886 4.184 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cc(F)ccc1F)([C@@H](C)Br)O2 587380984 DQGJCBZSGHTMBT-MGNBDDOMSA-N 396.231 4.500 50 1 GIGF COc1cc2c3c(c1)O[C@](c1cccs1)([C@H](C)Br)[C@@H](C2)C3=O 587451958 PMPHHZULGVSZAB-YALKKGATSA-N 379.275 4.183 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CSC#N)(c1cccc([N+](=O)[O-])c1)CC2=O 587489165 BEZLJCCDCRIHOC-HXUWFJFHSA-N 398.440 4.328 50 1 GIGF CN1C(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@H](CC[C@@]4(O)C#CCCCl)[C@@H]3CC[C@@H]12 40368844 SUSIRKQQOODCLS-UCKAWJCSSA-N 391.983 4.213 50 1 GIGF Cn1c(CCCC(=O)O)nc2cc(N(CCCCl)CCCCl)ccc21 100042114 QWPBSWXYDDBXCY-UHFFFAOYSA-N 386.323 4.045 50 1 GIGF COc1cc(OC)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CCl 587375591 NJEBIUDEDBBZAQ-FQEVSTJZSA-N 375.852 4.214 50 1 GIGF CN(C=O)c1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587497513 ITYGGXBQXMQITH-QFIPXVFZSA-N 383.875 4.258 50 1 GIGF Cc1ccc(C(=O)Cl)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl 587878632 NEHDIKUWPLAYJS-UHFFFAOYSA-N 394.685 4.391 50 1 GIGF O=C1c2ccccc2C(=O)N1Cc1c(CCl)[nH]c2cc(Cl)c(F)cc12 587627990 DSCRQDRIOJBTJV-UHFFFAOYSA-N 377.202 4.495 50 1 GIGF CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1ccccc1Cl)[C@@H](Br)C2=O 106022299 QFNRBQIMRXBWHH-JCURWCKSSA-N 384.701 4.437 50 1 GIGF Cc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 33917366 LBPVNXBZELTUHJ-GAISBVLPSA-N 383.495 4.394 50 1 GIGF COc1ccc([C@@H]2O[C@]34C[C@@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 96933995 JKVGVXPPLHTQLQ-QMZRJTEUSA-N 378.424 4.256 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C\N(C)C)(c1ccc(Cl)cc1)O2 587377953 LBNSVSPSIJLRLI-OKULMJQMSA-N 381.863 4.060 50 1 GIGF CC(C)[C@@]1(CBr)N[C@@H](C)Cc2ccc(F)c(Br)c21 587671759 ANMYOZRURBUUBM-LKFCYVNXSA-N 379.111 4.369 50 1 GIGF COc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cccc1CCl 587878002 XLJHIFLSXUKKOR-UHFFFAOYSA-N 396.701 4.451 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(F)c(CBr)c1)[C@@H](C2)C3=O 587423914 LIFUGBZDVAFNOF-UGSOOPFHSA-N 377.209 4.218 50 1 GIGF [C-]#[N+]C(=C\C1=C[C@H](O)[C@@H](O)CC1)/C(=C/[C@H]1CC[C@H](OC(=O)C=C(C)C)CC1)[N+]#[C-] 238736918 KLFCZJPRAVIRKE-RXUJDKBMSA-N 396.487 4.103 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4cccc1c24)C(=O)[C@H](Br)CC3 587101788 MREAEADTURXOCL-CQSZACIVSA-N 378.225 4.339 50 1 GIGF CC(C)=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@@]4(O)C(C=O)=CC[C@H]23)O1 2356400893 MNTJKNWRCITJMY-SLZLNBAESA-N 398.543 4.328 50 1 GIGF O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C12C[C@H]3C[C@@H](C1)CC(c1ccccc1)(C3)C2 653887846 VLJOSFQZBDMBML-OFCXAWBRSA-N 393.443 4.176 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@H]1c1ccc(O)cc1 1857558878 XNKHXCZRDIAVBS-SFHVURJKSA-N 381.391 4.017 50 1 GIGF CC(=O)[C@@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C[C@](O)(CCl)[C@@]21C 2356384223 LSUMZADQUYYJTQ-FXSSSKFRSA-N 378.940 4.303 50 1 GIGF COc1ccc(OC)c2c1C[C@@H](C)N[C@@]2(CBr)c1ccc(F)cc1 963576888 AWYSKBOBGBBMNV-BLVKFPJESA-N 394.284 4.016 50 1 GIGF O=Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c[nH]1 587325432 FNAICAQGJWLSTJ-CTNGQTDRSA-N 399.805 4.165 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1OCCBr)O2 587375443 SMGLQVBYUYZYCG-IBGZPJMESA-N 390.277 4.232 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(CBr)c(Cc3ccccc3)c2c1 587648430 DSFKODYENIECQZ-UHFFFAOYSA-N 378.291 4.057 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@@H]3O[C@H](O)[C@H]1[C@]32C 2356572929 SRJIDFQIECGKBW-DGONOLKGSA-N 382.928 4.209 50 1 GIGF CC[C@H](O[Si](C)(C)C(C)(C)C)[C@](C)(O)[C@@H](O)[C@@H](C)COC(=O)C(C)(C)C 2356699300 MIABMGRTXDZCFD-ULMVMLMRSA-N 390.637 4.124 50 1 GIGF O=C(Cl)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587542220 GDBZKCCZYAMKKQ-YLJYHZDGSA-N 380.783 4.474 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc2c(Cl)c(C(=O)NN)sc2c1 587920738 MRPJCGSLPHCLLX-UHFFFAOYSA-N 391.279 4.220 50 1 GIGF C#CC=CCC(Br)=C1C[C@@H]2O[C@H](CC)[C@@H](Br)C[C@H]2O1 2356500139 OGLSYOBOMBXPEB-MXYBEHONSA-N 390.115 4.292 50 1 GIGF Cc1ccc(N/C=C2\C=C3C(=CC2=O)OC(N)=C(C#N)[C@H]3c2ccccc2)cc1 100538072 FSXSVJRMDSBAAP-IOUNIBQOSA-N 381.435 4.192 50 3 GIGF CN(C)CCSSCCNC(=O)c1cccc(Oc2ccccc2)c1 618009260 USNRJERNNNOQHQ-UHFFFAOYSA-N 376.547 4.152 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(F)cc(Br)c2[nH]1 586971680 WJLRRHKBFDPZKA-JTQLQIEISA-N 380.055 4.326 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N=C=O)c2)N1 587742590 SHTHEQPLEWSXAB-VOJFVSQTSA-N 375.241 4.353 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3cc(C)on3)c1C)O2 587371059 CQGGLDCQXDDDDF-OAQYLSRUSA-N 399.878 4.381 50 1 GIGF ClC[C@]1(c2cscn2)c2ccccc2C[C@@H]2CN(c3ccccc3)CCN21 962627923 IIBMQCCPCRSMCQ-DENIHFKCSA-N 395.959 4.372 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](Oc3ccc(F)cc3)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43426930 QBWAUDCKUYPUNV-YBVSZUDCSA-N 378.440 4.413 50 1 GIGF C[C@@H]1CC[C@@H]2[C@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 253647245 SBCGDCBRWXAAIF-KFUGMGASSA-N 386.488 4.398 50 1 GIGF C[C@@H]1CCCc2sc(-n3cccc3)c(-c3nc4cc(C(=O)NN)ccc4[nH]3)c21 587031988 XGBDGBWNMIMRMQ-GFCCVEGCSA-N 391.500 4.125 50 1 GIGF O=C1c2ccc(O)cc2OC2(CC(CBr)C2)[C@@H]1c1ccc(F)cc1 587319885 DILQSHRSEKVBFH-KRXUMFTQSA-N 391.236 4.434 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1c[nH]c3nccc(Cl)c13)O2 587374303 VTRRRSPMGLITBD-SFHVURJKSA-N 376.243 4.206 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1coc4ccccc14)[C@@H](C2)C3=O 587414411 VDWMVXBFFFPXCS-VBKZILBWSA-N 399.240 4.479 50 1 GIGF O=C1c2ccccc2[C@@]2(NCCc3c(Cl)cc(Cl)cc32)[C@H]1Br 963127247 ZYJCWPUCXJYVCQ-IRXDYDNUSA-N 397.099 4.343 50 1 GIGF CC[C@H](Br)[C@@H]1C/C=C/C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 238785327 ZFUYDSOHVJVQNB-ITBPCXSDSA-N 392.131 4.485 50 1 GIGF COC(=O)c1ccc(CBr)cc1C#Cc1cc(Cl)ccc1OC 587897960 BRTFFGRRZISUBU-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF CCO[C@@H]1N=C(c2ccccc2)c2cc(Cl)ccc2N(CCCl)C1=O 26162308 MSHMORPBEMXHDK-SFHVURJKSA-N 377.271 4.125 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2C2(CC(CBr)C2)N1 587674681 ZFZAVWDBCAWLMN-JUXJKVCFSA-N 377.095 4.123 50 1 GIGF Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc(C)c1N=C=O 587880678 XGIYERHEGBZZCS-UHFFFAOYSA-N 387.266 4.288 50 1 GIGF O=C(O)c1ccc(C(=O)N/N=C/c2c(-c3cccs3)[nH]c3ccccc23)cc1 1772630630 JBLPKKPYXSJZEA-WSDLNYQXSA-N 389.436 4.359 50 1 GIGF CC(=O)OCC(=CCCC(C=O)=CC=O)CCC=C(C)[C@@H](O)CC=C(C)C 2356648033 MDPQKRFXKXCPOC-QFIPXVFZSA-N 376.493 4.024 50 1 GIGF Cc1c(C(=O)NN(C(=O)c2ccccc2)C(C)(C)C)ccc2c1CC(C)(C)O2 103204012 NNJWIMKSDALCRA-UHFFFAOYSA-N 380.488 4.294 50 1 GIGF O=C(O)CCC/C=C\C[C@@H]1[C@H](Cl)C[C@H](O)[C@@H]1/C=C\[C@H](O)C1CCCCC1 261192079 ZOQXTNLUBHPZOZ-WVPAUNRBSA-N 384.944 4.289 50 1 GIGF in-vitro ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H](Cl)[C@@H]4O[C@@H]4[C@@H]3[C@@]1(Cl)C2(Cl)Cl 169355127 ZXFXBSWRVIQKOD-OSJCTDODSA-N 389.320 4.453 50 1 GIGF Clc1ccc([C@H](Cl)Cn2ncc3c(NCc4ccccn4)ncnc32)cc1 71297052 IMBPFCCEWUQKON-QGZVFWFLSA-N 399.285 4.467 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]2Br)N1 587683777 PANADNMCIQWHOZ-FDLBOYPASA-N 377.095 4.265 50 1 GIGF N#CC(C#N)=C[C@@H](C(=O)N1c2ccccc2Sc2ccccc21)[n+]1ccccc1 95594027 HOHBQNAWFCWUFJ-FQEVSTJZSA-N 395.467 4.318 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@@H](C)Br)O2 587385587 UERFHZGKPSJKDX-ZMZPIMSZSA-N 378.241 4.360 50 1 GIGF COc1ccc2c(c1)c(CC(=O)NN)c(C)n2C(c1ccccc1)c1ccccc1 13445933 LOOVUGMCMSNBDI-UHFFFAOYSA-N 399.494 4.128 50 1 GIGF COc1ccc(-c2cc(NC(=S)NNC(=O)c3ccc(C)cc3)cs2)cc1 169350472 MXUNLNSYPZPCTG-UHFFFAOYSA-N 397.525 4.364 50 1 GIGF CCOc1ccc([C@@]2(CBr)CC(=O)c3cc(C)cc(N)c3O2)cc1 587371514 FHIAKEQZXWEHTA-IBGZPJMESA-N 390.277 4.232 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1ccc(O)cc1 587543458 KNQSZMXNLZVWEH-RXVVDRJESA-N 382.799 4.194 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1F)([C@H](C)Br)O2 587384799 IZJJHQOVKMNEAX-BBATYDOGSA-N 378.241 4.360 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](Br)Cc1ccccc1F)O2 587385119 MAJNDUSSUZXSPQ-HKUYNNGSSA-N 392.268 4.446 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(-c3ccc(Cl)cc3)c(NC(=O)CCl)c2c1 587648720 GLJDDSBUISXZPX-UHFFFAOYSA-N 397.283 4.069 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)([C@H](C)Br)[C@@H](C2)C3=O 587415526 UJNNDPPWXHHJDF-SLSDUTBNSA-N 387.273 4.430 50 1 GIGF CC1(C)CCC[C@@]2(C)[C@H]1CC(OC(=O)C=Cc1ccc(O)cc1)=C(C=O)[C@@H]2C=O 2356705164 YVIMZBRWYFADCK-ZCVJKFOLSA-N 396.483 4.453 50 1 GIGF COc1ccc([C@@]2([C@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 587375493 SWOSJJJKNUTLAL-BUXKBTBVSA-N 390.277 4.230 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587541908 DTIWKVCMRZUCJM-RXVVDRJESA-N 398.846 4.147 50 1 GIGF Cc1cc([C@]2(CBr)NCCc3c(C(=O)O)cccc32)ccc1Cl 963131694 NPYGRUZEJMACIE-SFHVURJKSA-N 394.696 4.131 50 1 GIGF CC=C(C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@]2(O)[C@H](Cl)CC[C@H](C)[C@@]12C 2356565019 LIIUXOSINVLFRM-OHDNZHKMSA-N 380.868 4.110 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(CCc1ccccc1)[C@@H](C2)C3=O 587413297 GOAAJPFWJKCIKI-OXJNMPFZSA-N 387.273 4.209 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 101273413 SBCGDCBRWXAAIF-NFUOUCJGSA-N 386.488 4.398 50 1 GIGF Cc1ccccc1/C=C1\CN(C)CC2=C1OC(N)=C(C#N)[C@@H]2c1ccccc1C 40605950 DRBHVAYLZITACG-MKXOMJGDSA-N 383.495 4.394 50 1 GIGF COc1cccc([C@]2(CCCCCCCl)c3c(cnn3C)CCN2C)c1 963956551 YDZCBIAXOJCLNQ-OAQYLSRUSA-N 375.944 4.350 50 1 GIGF CC1(C)C[C@H]2[C@H](C=C(C=O)[C@]3([C@H]4NCCc5c(C(=O)O)cccc54)C[C@]23C)C1 963132776 CHZIQWGNKNBAMU-ZDVFPZLXSA-N 379.500 4.159 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1O)c1cccc([C@@H](O)c2ccc(C#N)cc2)c1 38145364 WGJZTXMGXRLQBF-PPCHASGVSA-N 399.475 4.289 50 1 GIGF N#C/C(=C\c1ccccc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O 587189130 YKSLDQJKCVGZOO-NTCAYCPXSA-N 375.387 4.402 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1F)([C@@H](C)Br)O2 587384894 KNYCDLPDSKBVPP-MGNBDDOMSA-N 396.231 4.500 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C(=O)Cl)(c1c[nH]c3ccccc13)CC2=O 587458025 FHHDCGMQTTVADN-NRFANRHFSA-N 383.831 4.452 50 1 GIGF N#CC(C#N)=C1C(=O)c2ccccc2[C@@]12NCCc1cccc(-c3ccccc3)c12 962659367 CCIOVCWHCIDEAH-SANMLTNESA-N 387.442 4.283 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2cccc3c2C[C@H](C)O3)C(C)(C)C)c1 103215905 BUNWEWRCVFOTMK-INIZCTEOSA-N 380.488 4.213 50 1 GIGF CC=C(C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@]2(O)[C@H](Cl)CC[C@@H](C)[C@]12C 2356565018 LIIUXOSINVLFRM-NQBUOGDUSA-N 380.868 4.110 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)c(F)c1)O2 587380503 AEGZNGXCWDQURP-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF Cc1oncc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587330062 ZZRIINUQRDDZHO-AZUAARDMSA-N 387.794 4.321 50 1 GIGF N#C/C=C/c1ccc([C@H](NC2CC2)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 169350607 KRGHLQAVTNUKAV-AMSXYPHBSA-N 392.466 4.470 50 1 GIGF COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@@H]3O[C@@H](O)[C@H]1[C@@]32C 238780350 SRJIDFQIECGKBW-CWZKNBAESA-N 382.928 4.209 50 1 GIGF C#CCn1c(-c2ccc(C(=O)N/N=C/c3cccs3)cc2)nc2ccccc21 1772650376 DSKCSGOLOOOOJJ-HZHRSRAPSA-N 384.464 4.162 50 1 GIGF CC(C)(C)c1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc(C(C)(C)C)c1O 28821131 SBTMABPLJXEUMX-WYMPLXKRSA-N 396.487 4.480 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)[C@@H]2CCC[C@@H]3O[C@@H](C)C[C@@H]32)C(C)(C)C)c1 103215924 WDYHWAPYSQDGTB-NBYUQASBSA-N 386.536 4.169 50 1 GIGF CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@@H]1Cl 587327873 HZTZXISCFQCGMB-HNBVOPMISA-N 376.811 4.045 50 1 GIGF O=C(CCl)Nc1cc(CO)cc(Nc2ccnc3cc(Cl)ccc23)c1 26726398 LPQJUIWQICQIPN-UHFFFAOYSA-N 376.243 4.301 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(C(=O)Cl)c1ccc(F)cc1 587573734 XCIWTDWDPCOOEU-UTKZUKDTSA-N 398.773 4.154 50 1 GIGF COc1cccc(/C=N/NC(=O)c2ccc(-c3cc(=O)c4ccccc4o3)cc2)c1 653764477 VUWHZXOHTRBYOY-MFKUBSTISA-N 398.418 4.233 50 1 GIGF C/C(CCC(=O)Nc1ccccc1F)=N\NC(=O)c1ccc(-n2cccc2)cc1 1772619490 UTOIFWVQKJVDTK-PCLIKHOPSA-N 392.434 4.141 50 1 GIGF C[C@H](Br)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587540063 ZUJSYPHKOOKTPF-MAAWUACBSA-N 389.245 4.286 50 1 GIGF COc1cc2occ(O)c2cc1[C@@]1(CCl)CC(=O)c2cc(C)cc(N)c2O1 587374417 XZSINGZXMDAGRJ-FQEVSTJZSA-N 387.819 4.137 50 1 GIGF C[C@H](C(=O)NNC(=O)NCc1ccccc1)c1cccc(Oc2ccccc2)c1 84603009 XGDRWRDHMAFDBI-KRWDZBQOSA-N 389.455 4.113 50 1 GIGF O=C(NCCCl)Nc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1 34800059 YGKHBSOOIDIVBR-UHFFFAOYSA-N 376.247 4.387 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1oc3ccccc3c1NC(=O)CCl)O2 587373824 TVTYGVRPJMMTED-NRFANRHFSA-N 398.846 4.381 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)N[C@H](C)Cc3cc(Br)c(F)cc32)o1 587683418 HAMVRJHAQFEWGE-BCTVWOGZSA-N 387.680 4.210 50 1 GIGF C=CC[n+]1c(-c2ccc(OC)cc2)csc1NNC(=O)Nc1ccccc1 1958654 JAADJIYHZHDCSG-UHFFFAOYSA-O 381.481 4.046 50 3 GIGF aggregator Cc1c(C(=O)NN)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 13474266 JTJORYHEPQPVJK-UHFFFAOYSA-N 395.677 4.411 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 103167313 DKLRKSZQSVUEJP-HOTGVXAUSA-N 388.210 4.492 50 1 GIGF CSc1ccc(/C=N/N(C(=O)c2ccccc2)C(=O)c2ccncc2)cc1 103170659 GUYUQQVGFHLZHU-HZHRSRAPSA-N 375.453 4.120 50 1 GIGF Cc1cccc(-c2ccc(Cl)cc2)c1-c1nc2ccc(C(=O)NN)cc2[nH]1 587073885 NJFDSYNQRWQJPF-UHFFFAOYSA-N 376.847 4.462 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(NC(=O)C(C)C)cc1)[C@@H](C2)C3=O 587417353 LUASJFLOLUXTEC-JTSKRJEESA-N 399.874 4.171 50 1 GIGF CC1(C)C=C(/C=N/Nc2ccc(Br)cc2)C(C#N)=C(O)C1(C#N)C#N 31861960 GWGPJUFXUQBOOE-NUGSKGIGSA-N 396.248 4.182 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cccc(F)c1F)[C@@H](C2)C3=O 587425973 JCKOJOCHJGVBDL-KPZWWZAWSA-N 395.199 4.011 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@H]2Br)N1 587683779 PANADNMCIQWHOZ-UGQGEIBHSA-N 377.095 4.265 50 1 GIGF C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)C(C)=CC)cc2[C@@H]1OC(=O)C(C)=CC 2356639416 PDBXOOAXGJDJOB-CZAAIQMYSA-N 398.455 4.324 50 1 GIGF O=C(CCc1ccc(C(F)(F)F)cc1)N[C@@H](Cc1ccccc1)C(=O)CCl 26155813 HXSFNHKRHGFCAR-KRWDZBQOSA-N 397.824 4.173 50 1 GIGF CC(C)[C@H](NC(=O)CCl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 587102065 OMNHFYVJVZWEMM-NRFANRHFSA-N 378.859 4.498 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1[nH]c(C)c(C(C)=O)c1C)([C@H](C)Cl)[C@@H](C2)C3=O 587417684 OJEPAGDGLXMDEA-QOKQMOMRSA-N 387.863 4.113 50 1 GIGF O=CN1CCc2cc([C@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 587499562 VOPFJTIGIZPCNY-HSZRJFAPSA-N 395.886 4.184 50 1 GIGF Cc1nc(C)c([C@@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)o1 587498956 KJJPJCONUSHCFV-IBGZPJMESA-N 390.277 4.426 50 1 GIGF COc1ccc2c(c1OC)[C@](C)(C(C#N)=C1Nc3ccccc3N1)N(C)[C@H](C)C2 962571952 PKROLCKRNMHEEB-FATZIPQQSA-N 390.487 4.068 50 1 GIGF O=CC1=COc2cc(F)ccc2[C@]12c1ccsc1CCN2Cc1ccco1 962713220 URDBQXXDUOKFOZ-NRFANRHFSA-N 381.428 4.257 50 1 GIGF CCOc1ccc(C2=C(C#N)C(=O)N[C@@](C)(c3ccc(OCC)cc3)C2)cc1 1772626207 FBPPRGORVMUQSL-HSZRJFAPSA-N 376.456 4.196 50 1 GIGF COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]3C[C@H]4OO[C@@]3(C=C4C(C)(C)OO)CC[C@@H]21 2356765306 JTMNVWQNMNACAS-LPLZUFFLSA-N 380.481 4.050 50 1 GIGF CC(C)=CCO[C@@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 101265185 WPACVSREXXEVRJ-HZEGPAAWSA-N 394.533 4.091 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CBr)(c1nccs1)CC2=O 587495094 NGRMAEVEJWRFKG-INIZCTEOSA-N 382.279 4.057 50 1 GIGF C[C@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Cc2ccccc2)c1 84597030 KKMJRJNRGYMHNY-SFHVURJKSA-N 393.531 4.292 50 1 GIGF N#C/C(=C1/Nc2ccccc2S1)c1ccnc(NCCc2ccc(O)cc2)n1 13647768 UPHXJSRGSJCUTC-CAPFRKAQSA-N 387.468 4.247 50 1 GIGF CCCC(=O)Nc1ccc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 587372953 OIDZSCOJGRZGRS-OAQYLSRUSA-N 386.879 4.415 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1sccc1Br)[C@@H](C2)C3=O 587452759 PCLAYEVDMMNLGP-QFYYESIMSA-N 399.693 4.401 50 1 GIGF O=C(Cl)Cc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl 587879330 BKZFDHKCPWVYTL-UHFFFAOYSA-N 394.685 4.012 50 1 GIGF O=CC1=C(Cl)[C@H]([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCC1 587555236 ZKQCODYJQZDHKX-SOIKWTOOSA-N 384.815 4.214 50 1 GIGF CCCCC1(CCCC)C[C@@H](CNCCCn2ccnc2)[C@](C)(OC)OO1 1857610801 ZRJTUXPFSLFBIV-VQTJNVASSA-N 381.561 4.313 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(NC(=O)C(C)C)cc1)O2 587372400 KZDMVNQYRJTHSX-OAQYLSRUSA-N 386.879 4.271 50 1 GIGF Cc1cccc(Nc2ncnc3ccc(N(C)C(=O)N(CCCl)N=O)cc23)c1 34800069 NFRDLORGBPIOJT-UHFFFAOYSA-N 398.854 4.460 50 1 GIGF Cc1nc(C)c([C@]2(CCl)N[C@@H](C)Cc3cc(Br)c(F)cc32)o1 587683421 HAMVRJHAQFEWGE-ZKANADHPSA-N 387.680 4.210 50 1 GIGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc(-c2ccccc2)c(F)c1 95808913 SRCBQZTWYDPPJB-LFVJCYFKSA-N 384.451 4.456 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)C(C)(C)CC(=O)N3)O2 587373093 PQSKUAZKXSAPLY-QFIPXVFZSA-N 398.890 4.297 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C)(c1cccc(NC(=O)CCl)c1)CC2=O 587458418 BHRNYJDVLYFLQK-NRFANRHFSA-N 387.863 4.403 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@H](Cl)c1ccccc1)CC2=O 587460049 RBSXMBWHQRBSJQ-TZIWHRDSSA-N 388.847 4.202 50 1 GIGF O=C1C(c2ccc(CN3C(=O)[C@H]4C=C[C@H]3OO4)cc2)=Cc2cccc3cccc1c23 1857551140 MFUZYLCJEIVVKE-FGZHOGPDSA-N 395.414 4.132 50 1 GIGF C=C1[C@@H]2CC=C(C=O)[C@@H](C=O)[C@@]2(C)[C@@H](OC(=O)C=Cc2ccccc2)C[C@H]1C 2356437410 RIGSJIIZCIKSKY-NFINYFSDSA-N 378.468 4.174 50 1 GIGF N#C/C(=C\c1ccccc1OCCN1CCCCC1)c1noc2ccc(O)cc12 40554610 GXDJDMYMDBKGMW-NBVRZTHBSA-N 389.455 4.462 50 1 GIGF C=C1CC/C=C(\C)C[C@@H]2OC(=O)C(=C)[C@H]2C/C=C(\COC(C)=O)CC[C@@H]1OO 238783763 LCYYYCIAJNWGOB-WPXLHAHZSA-N 390.476 4.289 50 1 GIGF O=C(/C=C/c1ccccc1Cl)Nc1cc2c3c(cccc3c1)C(=O)OC2=O 95582105 KLVDRZSOVYSBFG-CMDGGOBGSA-N 377.783 4.456 50 1 GIGF Cn1ccc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 587328097 SWYOPZDCLHNTJH-PZJWPPBQSA-N 385.822 4.363 50 1 GIGF C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)Nc2nnc(-c3ccc(OC)cc3)o2)C1 95581786 ABKBQZADEOTGAE-HDHZYAPQSA-N 381.436 4.155 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)cc1C)[C@@H](C2)C3=O 587413606 HRILLZVZRWEYBF-OXJNMPFZSA-N 387.273 4.350 50 1 GIGF CC(C)[C@@H](NC(=O)CCl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 587102066 OMNHFYVJVZWEMM-OAQYLSRUSA-N 378.859 4.498 50 1 GIGF N#C/C(=C\c1cccc(Br)n1)C(=O)N[C@@H](c1ccccc1)C1CC1 73159683 TZISYUGHDFOMLF-OTMARIDSSA-N 382.261 4.019 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(OCCCCl)c(OC)c1)[C@@H](C2)C3=O 587423637 VDMRFQJEOSQKGH-BTYIYWSLSA-N 388.847 4.200 50 1 GIGF Cc1ccc([C@]2([C@@H](C)Br)NCCc3c2c(C(C)C)nn3C)cc1 962923083 UUAZJOJCFXLMRN-KUHUBIRLSA-N 376.342 4.025 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)c(F)c1)[C@@H](C2)C3=O 587426103 KZSQVSOZIPMXLU-IFXJQAMLSA-N 391.236 4.181 50 1 GIGF CCCc1c(O)ccc2c1O[C@](/C(C#N)=C\N(C)C)(c1cccs1)CC2=O 587495735 SFXHMQRFFRMWND-DZFTYQQFSA-N 382.485 4.236 50 1 GIGF CC(C)(C)N(NC(=O)c1ccc2c(c1Cl)CCCO2)C(=O)c1ccccc1 29037235 DHOUKZMAWPRUNW-UHFFFAOYSA-N 386.879 4.251 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 100868042 WDTIPJZJXSSSGU-ISBFPKGDSA-N 391.895 4.288 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(CBr)cc1F)[C@@H](C2)C3=O 587425954 ISSZMTDGSTYDAY-UGSOOPFHSA-N 377.209 4.218 50 1 GIGF CO[C@H]1O[C@@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@]13OO2 100863480 JYSURLKCEQBUMV-OHNKGQGDSA-N 380.456 4.348 50 1 GIGF O=C(Cc1ccccc1)N/N=C1\C(=O)N(CCC2CCCCC2)c2ccccc21 40379925 DNLAJKUSVDDLAN-RWEWTDSWSA-N 389.499 4.067 50 1 GIGF CCc1c2c(n(C)c1CC)CCC/C2=N\N(C)C(=O)Nc1ccc(OC)cc1 40576181 NVKQMBUZZNVGDO-HKOYGPOVSA-N 382.508 4.363 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O 587427910 JRXPIEBYXHRSEA-KBXCAEBGSA-N 395.199 4.011 50 1 GIGF O=C(NNC(=S)Nc1ccccc1Cl)c1cc2cc(Cl)ccc2[nH]1 1857585492 KUEJSIFSLVRBBZ-UHFFFAOYSA-N 379.272 4.106 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@H]1C(C=O)=CC[C@H]2C(C)(C)CCC[C@@]12C 2356510004 KLGPVOFVVYHEGO-DXIQSLLYSA-N 376.493 4.319 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C#N)=COc1ccccc12 587738986 FHNSJGJFNFUVSP-WLRWDXFRSA-N 385.236 4.166 50 1 GIGF CCC[C@@H]1C[C@H](OC(C)=O)C(Cl)=C(C(Br)Br)O1 2356792337 JPGOTFWANJGLNW-SFYZADRCSA-N 390.499 4.073 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1c(F)cccc1F)O2 587381302 GPOXFFPFJHJOGT-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C)([C@H](Cl)C(=O)Nc1ccccc1)CC2=O 587458071 FUXNBZHEYMIAQV-TZIWHRDSSA-N 387.863 4.315 50 1 GIGF COC(=O)C1=CN(c2c(C)cc(C)cc2C)C(N)=C(C#N)[C@@H]1c1cccc(F)c1 95569345 JMOZXIFTTPHGEH-FQEVSTJZSA-N 391.446 4.106 50 3 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CBr)CC1CC1 587539767 YCAVLHWLXFJORH-LPHOPBHVSA-N 389.245 4.288 50 1 GIGF C[C@](Br)(CCl)[C@@H]1C[C@H](Cl)[C@@](C)(C=CBr)O1 2356477516 YTOJCYQLVTZXDI-AATLWQCWSA-N 380.935 4.442 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cnc(N3CCCCC3)s1)O2 587415163 XYQDHKRHXSMZAF-LJQANCHMSA-N 391.924 4.124 50 1 GIGF C[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N/C1=C\C(=O)Sc1ccccc1 205829837 DWMPNCPXQARGKK-UCTFBUJFSA-N 377.582 4.346 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CBr)CC1CC1 587539771 YCAVLHWLXFJORH-QFBILLFUSA-N 389.245 4.288 50 1 GIGF Cc1ccc2c(c1)[C@@]1(N[C@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 587740873 LELJGNXYJOYUAR-MPBGBICISA-N 399.263 4.474 50 1 GIGF CC1(C)CCC[C@]2(C)[C@H](C=O)C(C=O)=C(OC(=O)C=Cc3ccc(O)cc3)C[C@H]12 2356705165 YVIMZBRWYFADCK-ZILOHOTNSA-N 396.483 4.453 50 1 GIGF C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 195297148 MUCWOBDSQXBTNM-UCKPTORISA-N 394.584 4.493 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43967655 IGHHGSMGNAAZGN-CGBIMEHRSA-N 385.504 4.067 50 1 GIGF COC(C)(C)[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587324324 QGRNBLGWTUHIJL-PXNSSMCTSA-N 378.827 4.293 50 1 GIGF CC1(C)C[C@@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 36378449 CWCXONZIEDNVKI-VCKMKGKSSA-N 399.325 4.010 50 3 GIGF in-vitro CCCNc1nc(SC)nc2c1cnn2C[C@H](Cl)c1ccc(F)cc1 40980251 PLGTYHJNZDEORQ-AWEZNQCLSA-N 379.892 4.489 50 1 GIGF NC(=O)N/N=C/c1c(-c2ccccc2)n(CC(=O)c2ccccc2)c2ccccc12 103224022 FGHMAMUUFUHROR-CVKSISIWSA-N 396.450 4.193 50 1 GIGF CC(C)[C@]1(CBr)N[C@@H](C)Cc2ccc(F)c(Br)c21 587671762 ANMYOZRURBUUBM-XPTSAGLGSA-N 379.111 4.369 50 1 GIGF COc1cccc2c3c(cnc12)CCN[C@]3(CCl)c1c[nH]c2ccc(F)cc12 963060808 XCOSQFLILOTGQB-JOCHJYFZSA-N 395.865 4.492 50 1 GIGF CC(=O)OC/C(=C\CC/C(C=O)=C\C=O)CC/C=C(\C)[C@H](O)CC=C(C)C 238779193 MDPQKRFXKXCPOC-YFUOILSCSA-N 376.493 4.024 50 1 GIGF Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1cc(Cl)cc(Cl)c1O 261137701 MKOPGRMSHHCCTE-UHFFFAOYSA-N 390.226 4.426 50 1 GIGF O=C1NC(=O)[C@]2(C3CCC3)Cc3ccccc3[C@@]3(CCCCCC[C@H]3Cl)N12 962661669 IANVPEFUYPMOGB-STZQEDGTSA-N 386.923 4.490 50 1 GIGF O=C1/C(=C/c2ccccc2)CN(C(=O)C(Cl)Cl)C/C1=C\c1ccccc1 1911580867 NAHKEXWMYDXIBU-JYFOCSDGSA-N 386.278 4.369 50 1 GIGF CC(C)[C@@H]1C[C@@H]2[C@H]3[C@H]4[C@](C)(CC[C@]13C[C@H]2O)[C@@H](Br)CC[C@@]4(C)O 197878104 QYWKYBMMQNPDJT-LMYFXKEHSA-N 385.386 4.370 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(C(=O)CCl)cc1 587884443 LQPWEZFJAJQOIQ-UHFFFAOYSA-N 394.685 4.125 50 1 GIGF C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](I)[C@@H]2O 5764475 SSYGGPAGDDGXAF-ZXXIGWHRSA-N 398.284 4.023 50 1 GIGF O=[N+]([O-])c1ccc([S@](=O)c2ccc(N(CCCl)CCCl)cc2)cc1 27409448 AJMOZVPMFOZZNF-DEOSSOPVSA-N 387.288 4.046 50 1 GIGF CCOC(=O)C(=O)[C@@H](Cl)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 586993757 NMIOEUICEAQGBC-SFHVURJKSA-N 393.826 4.167 50 1 GIGF C[C@@H](C(=O)NNC(=S)NC1CCCCC1)c1ccc(-c2ccccc2)c(F)c1 103198677 NQFQFQNLSOQZFN-OAHLLOKOSA-N 399.535 4.424 50 1 GIGF Cc1cc(Cl)cc(C(=O)NNCc2ccc(F)cc2)c1NC(=O)C(C)(C)C 103213296 GDMCUXNDBGQROZ-UHFFFAOYSA-N 391.874 4.207 50 1 GIGF COc1ccc(/C=C/C(=O)N2C[C@@H](CCl)c3c2cc(O)c2ncccc32)cc1 38394658 VOSGPGDJAFYOIZ-RZIFZGNASA-N 394.858 4.331 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2nc(Br)c[nH]c-2n1 586974280 UVDXLPGTWBLODW-MRVPVSSYSA-N 396.086 4.114 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 587687834 IPPPISCJUHSUCY-VPTHRUTESA-N 387.680 4.210 50 1 GIGF CCCCN(CCCC)Cc1cccc(/C(C)=N\NC(=O)c2ccncc2)c1O 28528018 GXCBBALIXDYHDN-BWAHOGKJSA-N 396.535 4.343 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1ccccc1NC(=O)CCCCl)[C@@H](C2)C3=O 587423111 SBRNZJYPBNOKBF-KSFYIVLOSA-N 399.874 4.316 50 1 GIGF O=C(NNCCCN1c2ccccc2Sc2ccccc21)c1ccncc1 1857644379 RMNSJARKTLPDQB-UHFFFAOYSA-N 376.485 4.009 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@H]1C(C=O)=CC[C@H]2C(C)(C)CCC[C@]12C 2356510007 KLGPVOFVVYHEGO-XQBPLPMBSA-N 376.493 4.319 50 1 GIGF CC1(C)C[C@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 36378450 CWCXONZIEDNVKI-GMWFLKEVSA-N 399.325 4.010 50 3 GIGF in-vitro C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(C#N)cc2)N1 587689741 VILSVEQLIIPKGS-ZMZPIMSZSA-N 393.687 4.476 50 1 GIGF CC(=O)SCC[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 587843196 HNRHVNXHXXNXNO-PSLIRLAXSA-N 394.737 4.226 50 1 GIGF CN1C(=O)CC[C@@]2(C)[C@@H]1CC[C@H]1[C@H]3CC[C@@](O)(C#CCCCl)[C@@]3(C)CC[C@H]12 26004130 SUSIRKQQOODCLS-ZQPKRWIZSA-N 391.983 4.213 50 1 GIGF CO[C@H]1O[C@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@]13OO2 38158727 JYSURLKCEQBUMV-DIZVHYTASA-N 380.456 4.348 50 1 GIGF COC(=O)C=C(CC[C@@H]1C(C=O)=CC[C@H]2C(C)(C)CCC[C@]12C)COC(C)=O 2356427555 DWQLMTINEJBFII-ZRCGQRJVSA-N 390.520 4.407 50 1 GIGF COc1cccc2c1cc1n2C(=O)[C@@H](SSCc2ccccc2)N(C)C1=O 27187509 LHSHXLIQINTOOF-HXUWFJFHSA-N 398.509 4.283 50 1 GIGF O=C(O)c1csc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 587533133 UMQKWLWQGLPHTD-LJQANCHMSA-N 376.861 4.425 50 1 GIGF O=C(c1ccccc1CCl)c1c(CO)oc2cc(Br)cnc12 587275605 FCEGRQCBQJVYKL-UHFFFAOYSA-N 380.625 4.052 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CBr)(C2CC2)N1 587674310 VYKJBTOEQBXTNJ-XLKFXECMSA-N 377.095 4.123 50 1 GIGF COc1ccc(Cl)c2c1CCN[C@@]2(CBr)CC[C@H]1CCCO1 963269540 KLFPNSPZRFCNTE-SJKOYZFVSA-N 388.733 4.044 50 1 GIGF CN(C(=O)Cc1ccccc1N=C=S)[C@H](CN1CCCC1)c1ccccc1 13738409 KESWGPUNXUMNMF-OAQYLSRUSA-N 379.529 4.259 50 1 GIGF Cc1ccc2c(c1)[C@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C(C#N)=CO2 587572540 PSQFVWDDAAFZJG-XUZZJYLKSA-N 397.386 4.358 50 1 GIGF O=C(N/N=C/c1ccccc1O)c1cc(-c2ccccc2)nn1Cc1ccccc1 40847615 AQLWGBDGVJNVBC-PCLIKHOPSA-N 396.450 4.068 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1sccc1Cl)[C@@H](C2)C3=O 587454195 WYJDGNGTSBRQSR-QFYYESIMSA-N 399.693 4.448 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587541900 DTIWKVCMRZUCJM-GHTZIAJQSA-N 398.846 4.147 50 1 GIGF C[C@@H](C(=O)c1ccc(NC(=O)CCl)cc1)N1CCC(Cc2ccccc2)CC1 29043782 RCYWAXIDQNVCBO-KRWDZBQOSA-N 398.934 4.390 50 1 GIGF CC(C)(NC(=O)CCl)c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 587009523 JNIDBNWBVSOTQJ-UHFFFAOYSA-N 387.711 4.191 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CBr)(C2CC2)[C@H]1c1ccc(F)cc1 587324397 YPSQUTBAJQZABS-HKUYNNGSSA-N 391.236 4.434 50 1 GIGF O=C(Cn1c(C2CC2)nc2cc(Cl)c(Cl)cc21)N/N=C/c1ccccc1 1772638692 WVFIURBSPQPTCE-LSHDLFTRSA-N 387.270 4.371 50 1 GIGF COC(=O)C1=CC[C@H]2[C@]3(C)[C@H](C[C@@H](Cl)[C@@]2(C)CCC=C(C)C)O[C@H](O)[C@H]13 2356572932 SRJIDFQIECGKBW-QWVKJRFASA-N 382.928 4.209 50 1 GIGF FC(F)(F)c1cccc(NC2=NC[C@@H](CI)S2)c1 1649989 OAPJXVNUDRFACE-SECBINFHSA-N 386.180 4.024 50 1 GIGF CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NCc1ccccc1Cl)[C@@H](Br)C2=O 103113725 DGRQQFSPTYGWLX-KKXDTOCCSA-N 398.728 4.115 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 586974514 XEGSLGKWPFDLAV-NSHDSACASA-N 384.277 4.494 50 1 GIGF Cc1ccc(-c2cc(C(=O)N/N=C\C(Br)=C\c3ccccc3)[nH]n2)o1 15961307 NECFKNBGKKRENB-YGPUYHGRSA-N 399.248 4.130 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@]1(C)[C@H](C)CC[C@@]2(C)C(C=O)=CCC[C@@H]21 2356458399 MPESIRKGUJLXPE-PYYHNFOQSA-N 376.493 4.319 50 1 GIGF O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@@H]1Br 40420249 YZSQCBLLDFMPON-TXMMPKFLSA-N 381.122 4.493 50 1 GIGF CSc1ccc(Cl)c(C(=O)NCCCSSCCN(C)C)c1 618007766 HSFVQWJEAGPRRE-UHFFFAOYSA-N 379.016 4.125 50 1 GIGF COc1cc(/C=C/c2ccc(NC(=O)NCCCl)cc2)cc(OC)c1OC 473104941 QIUGSQOYQJHXAQ-SNAWJCMRSA-N 390.867 4.243 50 1 GIGF CC(=O)SCC[C@@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587612663 KJCZJCGFGUMCLS-APWZRJJASA-N 392.860 4.001 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)([C@@H](C#N)c1nc(C)cs1)CC2=O 587493448 HOLJPPTTZDSIFD-IFXJQAMLSA-N 390.892 4.360 50 1 GIGF CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c(N)cc4nc5ccccc5nc4c32)cc1 1772583319 FVPZDGZCEPJRBS-HXUWFJFHSA-N 393.450 4.146 50 1 GIGF COc1ccc2ccccc2c1/C=N/NC(=O)CCn1c(C)nc2ccccc21 96929705 HGWFSCAUYJPHQY-BUVRLJJBSA-N 386.455 4.047 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cscn2)N1 587853046 KNKXQKJMTOCZHA-RMLUDKJBSA-N 375.694 4.061 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1cccs1)([C@H](C)Br)[C@@H](C2)C3=O 587451956 PMPHHZULGVSZAB-OVSFNBESSA-N 379.275 4.183 50 1 GIGF COc1ccc2c(c1OC)[C@H](c1ccc(CCl)cc1)NCC21CCOCC1 963186183 GXUGWEPGHCYNQN-FQEVSTJZSA-N 387.907 4.183 50 1 GIGF O=C(N/N=C\c1cccs1)c1cccc(NC(=O)c2ccc(Cl)cc2)c1 15974312 RVUHHOFBEURPGQ-MTJSOVHGSA-N 383.860 4.418 50 1 GIGF Cc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 31904889 LBPVNXBZELTUHJ-AGIMELGASA-N 383.495 4.394 50 1 GIGF COc1ccc([C@H]2[C@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772642953 QKYATZBPHAXODG-ROUUACIJSA-N 388.254 4.415 50 1 GIGF CS(=O)(=O)/C(C#N)=C/c1cc(Cc2cccc(C(F)(F)F)c2)ccc1F 1857545779 WINIRGQQMURXDT-MHWRWJLKSA-N 383.366 4.344 50 1 GIGF O=C=Nc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1Cl 587881348 VHRMLQAIRUANFX-UHFFFAOYSA-N 393.657 4.325 50 1 GIGF C/C(=N/NC(=O)c1ccc(O)cc1)c1cccc(NC(=O)c2ccccc2C)c1 15934181 DBHPCUIDYNYCGR-XYGWBWBKSA-N 387.439 4.107 50 1 GIGF CC(=O)SCC[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 587843199 HNRHVNXHXXNXNO-VFZGTOFNSA-N 394.737 4.226 50 1 GIGF C[C@@H](N=C=O)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 587883369 ILXYUDZNGRPIAG-CQSZACIVSA-N 387.266 4.101 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 2356695038 QTXOFCZHIZFJCA-IBPRQYQWSA-N 380.484 4.398 50 1 GIGF CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1ccccc1Cl)[C@@H](Br)C2=O 106022302 QFNRBQIMRXBWHH-ZLIFDBKOSA-N 384.701 4.437 50 1 GIGF C[C@H](O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3)C(F)(F)F 101299193 HRGYFLQSKXKWJJ-KYZTZCHCSA-N 380.403 4.162 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2cccc(F)c2)c1 38145350 LZNITGYIYIZNLQ-YUIBMZAKSA-N 391.471 4.433 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(c2cscn2)[C@@H]1c1ccc(F)cc1 587374567 PDZQOWQDWTWUOR-MJGOQNOKSA-N 389.835 4.481 50 1 GIGF C=C1C[C@H](OC(C)=O)[C@H](Br)C(C)(C)[C@]12CC=C(C)C[C@@H]2OC(C)=O 13379293 UFKFDTHMWZFEOE-LSTDLKDCSA-N 399.325 4.326 50 1 GIGF biogenic Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCCBr)cc1)O2 587371662 FLUXACQOOWCTOE-QGZVFWFLSA-N 376.250 4.057 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)c(C)c1)O2 587381357 HYDCFOGYBWHLQB-GOSISDBHSA-N 378.241 4.280 50 1 GIGF CC(=O)SCC[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 587843197 HNRHVNXHXXNXNO-RFAUZJTJSA-N 394.737 4.226 50 1 GIGF COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)ccc1CBr 587898837 SFJSQLULMSQBTF-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCC(F)(F)F)C(=O)O[C@@H]3O[C@@]4(C)CC[C@H]1[C@]32OO4 43379892 PLQRQNZEPLAUHQ-AIBJOSQFSA-N 378.387 4.108 50 1 GIGF O=P(c1ccccc1)(c1ccccc1)N(Cc1ccccn1)Cc1ccccn1 95596156 DQLNXKOHYMLNQF-UHFFFAOYSA-N 399.434 4.408 50 1 GIGF O=C([C@H](Cl)[C@]1(C2CC2)c2c(F)cccc2C[C@@H]2CCCN21)C(F)(F)F 963094697 CRAQFGJCIMXNFR-NUTKFTJISA-N 375.793 4.190 50 1 GIGF CC(C)=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@@]4(O)C(C=O)=CC[C@@H]23)O1 2356400890 MNTJKNWRCITJMY-BNXATKIBSA-N 398.543 4.328 50 1 GIGF COC(=O)c1ccc(C#Cc2cc(Cl)ccc2OC)c(CBr)c1 587897974 CNLBRSCUWXHJQK-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1ccc(C)cc1)CC2=O 587469181 LBLBHTMISSFETQ-UFIOJNINSA-N 390.483 4.483 50 1 GIGF CCCC(=O)Nc1ccc([C@]2(CCl)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 587418236 SWEQWIAOZQSBKH-VGSWGCGISA-N 399.874 4.316 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(C#N)cc2)N1 587690006 YPIDIOZBVUEGNZ-ZMZPIMSZSA-N 393.687 4.476 50 1 GIGF CCOC(=O)c1cnc2c(cnn2C[C@@H](Cl)c2ccccc2)c1N1CCCC1 13491826 JYZVRXBAEBBEHF-GOSISDBHSA-N 398.894 4.188 50 1 GIGF CC1(C)[C@]2(C)CC[C@]1(C(=O)NCc1ccccc1Cl)[C@@H](Br)C2=O 103113719 DGRQQFSPTYGWLX-MORSLUCNSA-N 398.728 4.115 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cn(C)c3ccccc13)O2 587370293 ADBFSKSZOFSMPU-HXUWFJFHSA-N 399.288 4.325 50 1 GIGF N#CSC[C@@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 587532733 OBJJIIOVIQCHQZ-OAQYLSRUSA-N 381.453 4.052 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cscn2)N1 587853048 KNKXQKJMTOCZHA-RTHLEPHNSA-N 375.694 4.061 50 1 GIGF C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCCSSCCN(C)C 618009038 PTUOUUJUTKOZLX-MRXNPFEDSA-N 392.590 4.056 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccc(O)cc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 2356491748 OOBNDBQPMFZTTD-IBPRQYQWSA-N 396.483 4.104 50 1 GIGF COc1ccc([C@@]2(C(F)(F)F)CC(c3ccc(C)cc3)=C(C#N)C(=O)N2)cc1 1772634056 JWJSLVALDGJEQA-HXUWFJFHSA-N 386.373 4.259 50 1 GIGF N#CC1=C(N)Oc2ccc3ccccc3c2[C@@H]1c1cccc(C#CCCCO)c1 73195815 YVKLFXFOUNBXBO-HSZRJFAPSA-N 380.447 4.182 50 1 GIGF CC(C)=CCOc1ccc([C@H]2C[C@@H]2C(=O)NNc2nncc3ccccc23)cc1 49067071 VCYCXVVUFLVCEQ-RTWAWAEBSA-N 388.471 4.222 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(OC)c(C(=O)CBr)c1 587898347 JEGZETBROZXBGQ-UHFFFAOYSA-N 393.664 4.335 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N=C=O)cc2)N1 587742053 PTQFFJYJIKZGFC-ZMZPIMSZSA-N 375.241 4.353 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(Cl)s1)[C@@H](C2)C3=O 587452730 OTRXHSRJCCMNBC-MGPLVRAMSA-N 399.693 4.448 50 1 GIGF CN(C)C[C@@H](Br)c1ccc(Br)c(Br)c1 169345658 OCKZIWPUWODXOH-SNVBAGLBSA-N 385.925 4.209 50 1 GIGF O=CC1=C(Cl)[C@H]([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCC1 587555232 ZKQCODYJQZDHKX-DAESXHAQSA-N 384.815 4.214 50 1 GIGF COC[C@H](C)n1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587370739 BKIGSNFEYPUVEY-QKKBWIMNSA-N 390.911 4.302 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)C(C)(C)CC(=O)N3)O2 587373089 PQSKUAZKXSAPLY-JOCHJYFZSA-N 398.890 4.297 50 1 GIGF O=C(O)CCC/C=C/C[C@H]1[C@@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@H](O)C1CCCCC1 33985173 ZOQXTNLUBHPZOZ-ZLJFYLKPSA-N 384.944 4.289 50 1 GIGF CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1cccc(Cl)c1)[C@@H](Br)C2=O 103113691 DXTKBFJYTILFLZ-JCURWCKSSA-N 384.701 4.437 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(F)ccc1C(=O)CBr 587916570 NBCRYOYXRPTRDU-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF O=C(O)CCCCCCC(=O)N/N=C/c1ccc(-c2cccc(Cl)c2)o1 95809004 XIGVFIMJTFOYRG-FYJGNVAPSA-N 376.840 4.475 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2C2(CC(CBr)C2)N1 587674682 ZFZAVWDBCAWLMN-NQTXRORDSA-N 377.095 4.123 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@H]2Br)N1 587687225 YITULHSMSBQIHV-WZYXQFPFSA-N 377.095 4.265 50 1 GIGF CC1(C)CCC[C@@]2(C)[C@H]1CC(OC(=O)/C=C\c1ccc(O)cc1)=C(C=O)[C@@H]2C=O 238777546 YVIMZBRWYFADCK-ZJLVEJBASA-N 396.483 4.453 50 1 GIGF Cc1ccc2c([C@]3(CCl)N[C@H](C(=O)O)Cc4cc(F)ccc43)c(C)[nH]c2c1 962898877 PDRIYBFOHVVZCB-GHTZIAJQSA-N 386.854 4.005 50 1 GIGF C[C@@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)c1ccc(C2CCCCC2)cc1 26568749 GEAZNLFXOQNWHT-NPNYCVGBSA-N 383.536 4.093 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1OCCBr)O2 587375444 SMGLQVBYUYZYCG-LJQANCHMSA-N 390.277 4.232 50 1 GIGF COc1cccc([C@@]2(C(F)(F)F)CC(c3ccc(C)cc3)=C(C#N)C(=O)N2)c1 1772623170 VAIQMICSZYVISL-HXUWFJFHSA-N 386.373 4.259 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@H](O[C@H](C)C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 169372006 HRGYFLQSKXKWJJ-GZPOAYHGSA-N 380.403 4.162 50 1 GIGF CC(=O)NN=C1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C 2356581754 JTSYJYALWDMECW-HKZQYKGFSA-N 388.552 4.453 50 1 GIGF Cc1ncc2cc(-c3c(Cl)cccc3Cl)c(NC(=O)CCl)nc2n1 27407468 XXAVCCFWBZHDQT-UHFFFAOYSA-N 381.650 4.484 50 1 GIGF Cc1nc2ccccc2n1CCCC(=O)N/N=C/c1c(O)ccc2ccccc12 96929692 IWLWWTMHDPIUND-BUVRLJJBSA-N 386.455 4.134 50 1 GIGF CC(=O)SCC[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 587844581 LOUWEQBIHMILFZ-RFAUZJTJSA-N 394.737 4.226 50 1 GIGF N#CC1=C(N)OC(c2ccccn2)=C([S@](=O)c2ccccc2)[C@@H]1c1ccccc1 1857641746 YLORRRPESSBODW-ACSYHNTCSA-N 399.475 4.066 50 1 GIGF CC(C)[C@@H](Br)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl 26501454 ANQVULZQKYIFNP-SNVBAGLBSA-N 384.053 4.059 50 1 GIGF CNc1oc(-c2ccc(C)cc2)nc1P(=O)(c1ccccc1)c1ccccc1 8398878 OUNDFXNOOKXWCF-UHFFFAOYSA-N 388.407 4.331 50 3 GIGF aggregator CC1(C)CCC[C@@]2(C)[C@H]1CC(OC(=O)/C=C/c1ccc(O)cc1)=C(C=O)[C@@H]2C=O 238777555 YVIMZBRWYFADCK-FCAZTKOBSA-N 396.483 4.453 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(Cc1c(F)cccc1Cl)[C@@H](C2)C3=O 587424364 NQOBZGITLPRKDB-ORAYPTAESA-N 381.230 4.455 50 1 GIGF C/C=C(\C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]2(O)[C@@H](Cl)CC[C@H](C)[C@@]12C 238750503 LIIUXOSINVLFRM-QBZYGJHMSA-N 380.868 4.110 50 1 GIGF CC(C)[C@@]1(CBr)N[C@H](C)Cc2cc(Br)c(F)cc21 587674282 VTCATSSIECJJRH-YMTOWFKASA-N 379.111 4.369 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@H](CBr)[C@]3(C)O[C@H]3C[C@@H]12 2356392780 PDQNHDCJWUTAFX-FCNPYSRZSA-N 396.163 4.286 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cc(F)ccc1F)[C@@H](C2)C3=O 587424994 ZRPCWQNQUPFLIL-UGSOOPFHSA-N 395.199 4.011 50 1 GIGF Cc1cc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2cc1C 587009857 WERNTLNMTJJBPF-IBGZPJMESA-N 380.879 4.300 50 1 GIGF Cc1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)[nH]1 587541567 CIMUFAPOJSPJKK-GHTZIAJQSA-N 383.831 4.433 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2ccc3c(c2)O[C@H](C)C3)C(C)(C)C)c1 103215825 CALDISSJISJPMY-MRXNPFEDSA-N 380.488 4.213 50 1 GIGF CC(=O)SCC[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 587844579 LOUWEQBIHMILFZ-PSLIRLAXSA-N 394.737 4.226 50 1 GIGF N#C/C=C1/CCN(C[C@@H]2CCCCN2C(=O)Cc2ccc(Cl)c(Cl)c2)C1 53057254 WKJMMBKITNREGG-GQMMIMOESA-N 392.330 4.073 50 1 GIGF C=C(CCl)[C@H]1CCC2=C[C@@H](OC2=O)[C@H](C(=C)C)c2cc(C(=O)OC)c(o2)C1 2356579834 FUFZHVAAHGBANZ-IRWQIABSSA-N 390.863 4.325 50 1 GIGF C[C@@H]1CC[C@H]2[C@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 43888685 SBCGDCBRWXAAIF-OVJLRRITSA-N 386.488 4.398 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4cc(OC)ccc14)[C@@H](C2)C3=O 587423082 RWHSUIQHRIZPNP-YCRPNKLZSA-N 383.831 4.067 50 1 GIGF Br[C@@H]1C=C[C@@]2(C1)c1ccccc1C[C@H]1CN(c3ccccc3)CCN12 962626708 CFRUFDDERVFBIU-KAGYGMCKSA-N 395.344 4.352 50 1 GIGF CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@@H]3[C@@H](CC(=O)O)C(=O)O[C@]23C1 169301966 CWCXONZIEDNVKI-FAXAIPQWSA-N 399.325 4.010 50 1 GIGF Fc1ccc(Cn2c(NC3CCN(CCCl)CC3)nc3ccccc32)cc1 29566044 ZUUFTKUMGIXWEM-UHFFFAOYSA-N 386.902 4.339 50 1 GIGF O=C1Oc2ccc([N+](=O)[O-])cc2N/C1=C\C(=O)c1ccc(-c2ccccc2)cc1 1857641507 MDVXVCHIGMACSA-UYRXBGFRSA-N 386.363 4.360 50 1 GIGF COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3C[C@H]4OO[C@@]3(C=C4C(C)(C)OO)CC[C@H]21 2356765305 JTMNVWQNMNACAS-BANPUBCTSA-N 380.481 4.050 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 101276652 IGHHGSMGNAAZGN-IDERAPFOSA-N 385.504 4.067 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CBr)(c1ccc(O)cc1)CC2=O 587455994 IJJGFJRQARIQER-LJQANCHMSA-N 391.261 4.306 50 1 GIGF CCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(=O)O 42920218 BLPMBDMRCJRRQE-SJORKVTESA-N 397.562 4.371 50 1 GIGF COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@@H]3O[C@H](O)[C@H]1[C@@]32C 238732216 SRJIDFQIECGKBW-MUCQQEEJSA-N 382.928 4.209 50 1 GIGF Cc1ccc(C)c2[nH]c([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)nc12 587009963 YCWLZABXPPBGMA-KRWDZBQOSA-N 380.879 4.300 50 1 GIGF NNC(=O)c1ccc2[nH]c(-c3ccc(OCc4cccc(Cl)c4)cc3)nc2c1 587071048 LBUNPUIRTYYYSK-UHFFFAOYSA-N 392.846 4.066 50 1 GIGF COc1ccc2oc(C(=O)N3C[C@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 1859582 QXOZQTZJASWELT-LBPRGKRZSA-N 386.791 4.332 50 1 GIGF O=P(c1ccccc1)(c1ccccc1)N(Cc1ccccn1)c1cccnc1 95595953 OGXXKPFHNVXBOY-UHFFFAOYSA-N 385.407 4.412 50 1 GIGF COc1ccc2[nH]c(C(=O)N3C[C@@H](CCl)c4c3cc(O)c3[nH]ccc43)cc2c1 43201729 LUCSVWOHANBHCS-GFCCVEGCSA-N 395.846 4.346 50 1 GIGF in-vivo CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(OC)cc1OC)CC2=O 587461013 VVPFKZNXULBMBU-NRFANRHFSA-N 390.863 4.461 50 1 GIGF O=C(O)CCC/C=C/C[C@@H]1[C@@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 169692719 ZOQXTNLUBHPZOZ-XVHZGXDASA-N 384.944 4.289 50 1 GIGF COC(=O)c1sc(-c2ccccc2)nc1C(Br)Br 72172255 YLXXZWDBBFLBNY-UHFFFAOYSA-N 391.084 4.385 50 1 GIGF N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2ccccc2F)[C@@H]2CCCC=C12 169348509 CWDBAZIZODRAIK-QVKFZJNVSA-N 398.437 4.451 50 1 GIGF O=C(CCl)Nc1cc(C(=O)Nc2cccnc2Cl)cc(C(F)(F)F)c1 1857652231 UWUQAMSJLAOKON-UHFFFAOYSA-N 392.164 4.183 50 1 GIGF CCC[C@@H]1C[C@@H](OC(C)=O)C(Cl)=C(C(Br)Br)O1 2356792335 JPGOTFWANJGLNW-HTQZYQBOSA-N 390.499 4.073 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H](Br)C(=O)CC3 587102183 RWLJLPLIUVSXOV-SFHVURJKSA-N 378.225 4.398 50 1 GIGF Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)on1 587326651 MGUAQMPYMLJDTC-QUCCMNQESA-N 387.794 4.321 50 1 GIGF CCCc1c(O)ccc2c1O[C@](/C(C#N)=C\N(C)C)(c1ccc(F)cc1)CC2=O 587465092 AGDHDFUVZXIWGE-QHASNUMTSA-N 394.446 4.314 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@H](O)[C@@]2(C)[C@H]1C=O 2356730841 KSXULPOQIKTIMP-JAYAMIOFSA-N 382.928 4.052 50 1 GIGF C[C@]1([C@H](Br)CO)CC=C2[C@@H](C1)[C@H](O)C[C@@H]1[C@@]3(C)C[C@H]3CC[C@@]21C 238763441 IGLIAOHRQDMKEI-FRRBHXSNSA-N 383.370 4.292 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1ccc(NC(=O)CCCCl)cc1)[C@@H](C2)C3=O 587419586 FGNFGDUZYZOBRE-JTSKRJEESA-N 399.874 4.316 50 1 GIGF COc1ccc2c(=O)cc([C@@H](C)Br)oc2c1CBr 73197776 PMNNIKBGAHQHRV-SSDOTTSWSA-N 376.044 4.152 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cccc(F)c1F)[C@@H](C2)C3=O 587425974 JCKOJOCHJGVBDL-SGTLLEGYSA-N 395.199 4.011 50 1 GIGF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@@](CCCCCl)(c2ccc(F)c(F)c2)N1 962906811 RDNZWCOLWVQWNI-AZUAARDMSA-N 397.824 4.356 50 1 GIGF COc1ccc(Br)cc1C(=O)N/N=C(\C)c1cc2ccccc2[nH]1 95564045 DRWUQHCIYDZWQW-SRZZPIQSSA-N 386.249 4.093 50 1 GIGF COc1ccc2c(c1)c(CC(=O)NN)c(C)n2Cc1cccc(-c2ccccc2)c1 13445876 SRIFRURXNOUDKU-UHFFFAOYSA-N 399.494 4.206 50 1 GIGF CCN(CC)CCOc1ccccc1/C=C(\C#N)c1noc2ccc(O)cc12 40639632 WBSOXPNDVRNOKJ-GHRIWEEISA-N 377.444 4.318 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cc(F)ccc1F)([C@H](C)Br)O2 587380989 DQGJCBZSGHTMBT-YPMLDQLKSA-N 396.231 4.500 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@@H](Cl)c1ccccc1)CC2=O 587460046 RBSXMBWHQRBSJQ-FPOVZHCZSA-N 388.847 4.202 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(OC)cc1OC)CC2=O 587461014 VVPFKZNXULBMBU-OAQYLSRUSA-N 390.863 4.461 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 587687850 IWOAQEFGLVRYGA-VPTHRUTESA-N 387.680 4.210 50 1 GIGF N#CC1=C2SCN(c3ccc(F)cc3)CN2C(=O)C[C@@H]1c1cccc(F)c1 4923482 ONUHLYCFPJAGTC-QGZVFWFLSA-N 383.423 4.184 50 3 GIGF aggregator COC(C)(C)[C@@H](Br)c1nc2cc(Br)c(F)cc2[nH]1 586971045 KXKGVLFJIPESJL-JTQLQIEISA-N 380.055 4.326 50 1 GIGF CC(=O)NN=C1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@@]12C 2356581756 JTSYJYALWDMECW-WUUBBFJUSA-N 388.552 4.453 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 135739182 UZRHATKYSCLMQF-UQVLRELKSA-N 380.403 4.163 50 1 GIGF COC[C@@H](C)n1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587370743 BKIGSNFEYPUVEY-SZNDQCEHSA-N 390.911 4.302 50 1 GIGF CC1(C)C(Br)=C[C@H]2O[C@]2(C)[C@@]12C[C@H](Br)[C@]1(C)C[C@H]2O1 2356851373 QGZVAFYBURCCNT-MDNLKKFLSA-N 392.131 4.164 50 1 GIGF CC(C)[C@H]1C[C@@H](O)[C@@H]2C[C@]13CC[C@@]1(C)[C@H](Br)CC[C@](C)(O)[C@@H]1[C@@H]23 238743153 XIMOIAZZHIMGIZ-BTZQUWHESA-N 385.386 4.370 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1OCCBr)O2 587371685 FONHFZCUGBEQFF-KRWDZBQOSA-N 376.250 4.057 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)([C@H](C)Br)[C@@H](C2)C3=O 587427509 IIJVMJFMIGUIAM-WBUIGNHESA-N 391.236 4.261 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(NC(=O)CCl)c1)CC2=O 587458419 BHRNYJDVLYFLQK-OAQYLSRUSA-N 387.863 4.403 50 1 GIGF N#CC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 587570514 JEEJKQNHVJZZGR-NZQKXSOJSA-N 383.359 4.049 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)cc1C)[C@@H](C2)C3=O 587413605 HRILLZVZRWEYBF-JXFKEZNVSA-N 387.273 4.350 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@@H](C#N)c1nc3ccccc3s1)O2 587415756 WVRXFPYDACGLFD-RBZFPXEDSA-N 397.887 4.437 50 1 GIGF C[C@H](Br)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587540066 ZUJSYPHKOOKTPF-YARKZXGKSA-N 389.245 4.286 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@H](Cl)c1ccccc1)CC2=O 587460044 RBSXMBWHQRBSJQ-CTNGQTDRSA-N 388.847 4.202 50 1 GIGF C=C1CC[C@H]([C@]2(C)CC[C@H](C(C)(C)NC)O2)[C@@H]2[C@@H]1CC[C@](C)(O)[C@@H]2N=C=S 2356809137 ANRLMRLBKAVEHS-RXDRQJMTSA-N 392.609 4.137 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3nc(O)[nH]c3c1)CC2=O 587459243 HDXNSOIQZLUDEV-HXUWFJFHSA-N 386.835 4.026 50 1 GIGF C[C@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)c1ccc(C2CCCCC2)cc1 26568752 GEAZNLFXOQNWHT-LWYOUWALSA-N 383.536 4.093 50 1 GIGF C=C(c1ccc(OC)cc1)[C@H]1COC2(CCC(=C(C)C(=O)OCC)CC2)OO1 43523742 AFMRTAPPWLTVCR-PSDZMVHGSA-N 388.460 4.205 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 587086934 JMMOQJUADBTXBN-SECBINFHSA-N 394.038 4.208 50 1 GIGF O=C(N/N=C/c1ccc(CSc2nc3ccccc3o2)cc1)c1cccnc1 1857648992 LGOQCZAEHRILCG-FSJBWODESA-N 388.452 4.279 50 1 GIGF CCCC[C@@H](/C=N/NC(=O)N1CCCc2ccccc21)NC(=O)OC(C)(C)C 28570355 BEHFWCMFOMSYBI-HINJULBWSA-N 388.512 4.218 50 1 GIGF CC(C)(C)N(NC(=O)c1cccc(Cl)c1)C(=O)c1coc2ccccc2c1=O 28645871 BDMRMWSLXAEQBY-UHFFFAOYSA-N 398.846 4.032 50 1 GIGF COC(=O)C=C(C)CC[C@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=C(C=O)C[C@H]12 2356680715 RYBWQXGDQMJOIS-MDPATALOSA-N 390.520 4.405 50 1 GIGF C[C@H](Br)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587322425 MJCDRGGGNMIKAG-FEMPBKKVSA-N 379.225 4.432 50 1 GIGF CC1(C)C[C@H](OCCI)[C@]23CC[C@@H](O)[C@@](C)(CC[C@@H]12)C3 103218412 DWWDBBCNFHDCPE-AUOOEQCUSA-N 392.321 4.184 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)[C@H](C)Cl)c1C)[C@@H](C2)C3=O 587417695 ONBQUIWCUSTKTO-ZFDMUXSDSA-N 387.863 4.113 50 1 GIGF Cc1nc(C)c([C@]2(CCl)N[C@@H](C)Cc3ccc(F)c(Br)c32)o1 587685723 RJQRYONLMFYIMU-ZKANADHPSA-N 387.680 4.210 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 587541600 CKNDESCMYNYDBT-UZLBHIALSA-N 385.803 4.093 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccccc1F)([C@H](C)Br)[C@@H](C2)C3=O 587426748 POOJCHPPTVZWLZ-RBXYMLTMSA-N 391.236 4.261 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@@H]1c2ccsc2CCN1Cc1cccnc1 963000691 WQIMOTNZPVUGAK-FQEVSTJZSA-N 386.952 4.343 50 1 GIGF C[C@H]1CC[C@@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 169320641 SBCGDCBRWXAAIF-LMIMMQQRSA-N 386.488 4.398 50 1 GIGF CSC1=Nc2c(c(C)c(-c3ccccc3)n2CCCCl)C2=NC(=O)CN12 102988483 GAHLXAXWZNPBLQ-UHFFFAOYSA-N 386.908 4.045 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] 103189205 OZFLQFKFMRZOMP-HZPDHXFCSA-N 385.832 4.127 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(OC(=O)Cl)cc1 587886248 MRNHNQVOAFCSET-UHFFFAOYSA-N 396.657 4.441 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](Br)C(=O)CC3 586985370 GDTQXBVXYLSHLV-SFHVURJKSA-N 394.224 4.103 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(N(C)C=O)cc1)CC2=O 587459957 JIWDTBUSWBQACW-NRFANRHFSA-N 387.863 4.037 50 1 GIGF COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N/N=C/c2ccccc2)cc1 1857588394 FAKYPQXWUOKAPU-PCLIKHOPSA-N 396.450 4.312 50 1 GIGF CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)c(F)c2)c(C(=O)OC)c1 101459836 YHCVBMQPNXWGEN-SDXDJHTJSA-N 386.354 4.103 50 1 GIGF C[C@@H]1CC[C@@H]2[C@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@@]4(C)CC[C@H]1[C@]32OO4 253647249 SBCGDCBRWXAAIF-YKVNRIEVSA-N 386.488 4.398 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCCCCCl)(C(=O)OCC)CC2=O 587460684 OOOUSMPQZCUTGE-HXUWFJFHSA-N 382.884 4.411 50 1 GIGF COC(=O)[C@]1([C@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496164 BRKBEROTFHAGET-IFMALSPDSA-N 384.859 4.423 50 1 GIGF COc1cc(/C=C/CO)cc(OC)c1OC/C=C(\C)C/C=C/C(C)(C)OO 140444981 RVCISGRHDQEYDW-GFPCQFAFSA-N 378.465 4.249 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@H](C)Br)O2 587385586 UERFHZGKPSJKDX-VOJFVSQTSA-N 378.241 4.360 50 1 GIGF COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1C(=C(C)C=O)CC[C@@]1(C)O3 2356334032 ZSKLSJMYNRFZJZ-JOCHJYFZSA-N 380.396 4.096 50 1 GIGF C[C@]1(CC(=O)NCc2ccc(OC(F)(F)F)cc2)CC2(CCCCC2)OO1 49677829 QIMHTADQASRTKL-KRWDZBQOSA-N 387.398 4.405 50 1 GIGF CCOC(=O)c1c(NC(=O)CCl)oc(C)c1-c1cc2c3c(cccc3n1)CC2 587209840 ZYKPEMSDTGBNPY-UHFFFAOYSA-N 398.846 4.256 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OCCBr)c1)O2 587372232 HXCWRXITVXKRCK-QGZVFWFLSA-N 376.250 4.057 50 1 GIGF Cc1ccnc2c1CCN[C@]2(c1cc(C)n(Cc2ccco2)c1C)[C@@H](C)Cl 963084549 DYDTZAIPNYCRCR-VGSWGCGISA-N 383.923 4.466 50 1 GIGF Cn1cccc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587326551 LVVAEQWABRPGJT-TZIWHRDSSA-N 385.822 4.363 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 587687833 IPPPISCJUHSUCY-PWJLMRLQSA-N 387.680 4.210 50 1 GIGF CC1=C(C)SC(=C(C#N)c2nnc(N3CCOCC3)n2-c2ccccc2)S1 3211209 CMMQTVVASVUKLY-UHFFFAOYSA-N 397.529 4.027 50 3 GIGF C[C@H](Br)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587322420 MJCDRGGGNMIKAG-BMIZZYGASA-N 379.225 4.432 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@H](Cl)N=O)[C@@H](C2)C3=O 587417051 IRVBKNPRCUTLRB-MORSLUCNSA-N 378.211 4.323 50 1 GIGF CC(=O)OC/C=C(/CCl)CC[C@@H](Br)C(C)(C)Br 1638723 CGRDTJCHEFNOHQ-CDCCAWJDSA-N 390.543 4.432 50 1 GIGF O=C(CCCCCCC(=O)Nc1ccccc1O)N/N=C/C=C/c1ccccc1 95808510 GOAOODKMEMAENX-JERWTEEISA-N 393.487 4.487 50 1 GIGF CC[C@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@H]2C/C=C\C[C@@H]1Br 238747000 MFIOGNKPHIMUQN-KUHGRPSNSA-N 392.131 4.485 50 1 GIGF CC(C)[C@]1(CBr)N[C@@H](C)Cc2cc(Br)c(F)cc21 587674281 VTCATSSIECJJRH-XPTSAGLGSA-N 379.111 4.369 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 586971796 YYHRRWBUPAVCPJ-MRXNPFEDSA-N 389.297 4.255 50 1 GIGF C[C@@H]1CC[C@@H]2[C@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 253647239 SBCGDCBRWXAAIF-HBKRCHSNSA-N 386.488 4.398 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 586973387 JLMRMFVJFMVDTD-GFCCVEGCSA-N 386.293 4.311 50 1 GIGF O=C1C[C@@](CCl)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 587498343 NDUMXKMJAXNJTP-JOCHJYFZSA-N 384.859 4.436 50 1 GIGF O=C(O)CCC/C=C/C[C@H]1[C@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 5133656 ZOQXTNLUBHPZOZ-OPWSBXINSA-N 384.944 4.289 50 1 GIGF N#Cc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587541266 AIZAROIFIAUIHJ-UGKGYDQZSA-N 391.810 4.360 50 1 GIGF C[C@](Br)(CCl)[C@@H]1C[C@@H](Cl)[C@@](C)(C=CBr)O1 2356477518 YTOJCYQLVTZXDI-XFWSIPNHSA-N 380.935 4.442 50 1 GIGF COc1cc(/C=C(\C#N)C(N)=O)cc(CSc2cccc3ccccc23)c1O 40498260 IRGAHACBXIFFNJ-CXUHLZMHSA-N 390.464 4.239 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N=C=O)c2)N1 587743861 YGAVWHGESVDARM-BBATYDOGSA-N 375.241 4.353 50 1 GIGF CCc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1N=C=O 587880927 GWNVCAVGDRREQC-UHFFFAOYSA-N 387.266 4.234 50 1 GIGF C=C(C)[C@@H]1CC[C@](C)([C@@H]2CC[C@](C)(N=C=S)[C@@H]3CC[C@](C)(O)[C@@H](NC)[C@@H]32)O1 2356874899 ZWINEQINZVLQEU-MBUUOGHZSA-N 392.609 4.137 50 1 GIGF C[C@]1(CC(=O)NCc2ccccc2OC(F)(F)F)CC2(CCCCC2)OO1 49678931 QDHOZPCLAACLAH-KRWDZBQOSA-N 387.398 4.405 50 1 GIGF CO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)O[C@@H](C)/C1=C/C(=O)N1CCCCC1 194842494 GTNZJWJNZLZURK-KDJCRMJDSA-N 383.605 4.097 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc(N=C=O)cc1)[C@@H](C2)C3=O 587430170 SBYPONHXWJDXQJ-RDPSFJRHSA-N 383.403 4.354 50 1 GIGF CC[C@@H](Br)[C@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@@H]2O1 238730644 ZFUYDSOHVJVQNB-PYRWRBCASA-N 392.131 4.485 50 1 GIGF CN(C)c1ccc(/C=N/NC(=O)c2ccc(-c3nc4ccccc4[nH]3)cc2)cc1 58519465 HMJYZMZGQDESNC-BUVRLJJBSA-N 383.455 4.060 50 1 GIGF Fc1ccc(CN(CCBr)CCn2cnc3ccccc32)c(F)c1 169327037 JSBOEIFSHUVUPW-UHFFFAOYSA-N 394.263 4.212 50 1 GIGF CC1=CC[C@H]([C@](C)(Cl)CCl)O[C@@H]1C(Br)Br 86036145 FVPHWLFPVMYUFV-KHQFGBGNSA-N 380.935 4.442 50 1 GIGF C=CCC[C@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539303 VGLKGXCSVHWPKG-QFBILLFUSA-N 389.245 4.454 50 1 GIGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@]2(N1)C(C=O)=COc1ccc(Cl)cc12 962950583 NRYSCDAGRYHCQH-QRQCRPRQSA-N 378.859 4.464 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccc(O)cc2)[C@]2(C)[C@H](C=O)C(C=O)=CC[C@H]12 2356491749 OOBNDBQPMFZTTD-IUBSTNSRSA-N 396.483 4.104 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cccc(F)c1F)O2 587384419 CXAKAFZQHAHADA-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF CCCC(=O)Nc1ccc([C@@]2(CCl)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 587418234 SWEQWIAOZQSBKH-VGOFRKELSA-N 399.874 4.316 50 1 GIGF C=C[C@@]1(OC(=O)NCC)CCC[C@]2(C1)OOC1(O2)C2CC3CC(C2)CC1C3 621477537 AIJJIYDVNHJCLH-ZWYXMNJBSA-N 377.481 4.058 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@@H](OC(=O)C=Cc2ccccc2)C1 2356566370 FRHWTFAYHKXVPQ-CDNNERCOSA-N 378.468 4.318 50 1 GIGF FC(F)(F)c1cccc(NC2=NC[C@H](CI)S2)c1 3160363 OAPJXVNUDRFACE-VIFPVBQESA-N 386.180 4.024 50 1 GIGF CC(C)=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@]4(O)C(C=O)=CC[C@H]23)O1 2356400892 MNTJKNWRCITJMY-IXYPPXTMSA-N 398.543 4.328 50 1 GIGF CC(C)[C@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539440 WJIYLLSREKNPAF-YJBOKZPZSA-N 377.234 4.144 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2Br 587543530 KTDXELDQKBBWHD-BXWFABGCSA-N 389.245 4.430 50 1 GIGF COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1/C(=C(\C)C=O)CC[C@]1(C)O3 84710413 ZSKLSJMYNRFZJZ-LEQVUBRHSA-N 380.396 4.096 50 1 GIGF O=C(CCCl)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)CCCl)ccc1-2 96938169 HLDIGGDKXHSJGM-UHFFFAOYSA-N 391.254 4.033 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(c2ccccn2)[C@H]1c1ccc(F)cc1 587329456 XVPVZUOUAGWUBT-PZJWPPBQSA-N 383.806 4.420 50 1 GIGF COc1cc(C=C(C#N)c2nc3ccc(C)cc3[nH]2)c(Br)cc1O 1857624247 PNKALLUVKOKYHZ-UHFFFAOYSA-N 384.233 4.412 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1ccc(CCBr)cc1)[C@@H](C2)C3=O 587413740 PRMQNZWNHWKTOR-OXJNMPFZSA-N 387.273 4.295 50 1 GIGF CCO/C(O)=C1\C(C[S@@](=O)c2ccccc2)=NC(C)=C(C#N)[C@@H]1c1ccco1 40810745 RFSFTDZEDALWJG-XRLRHBSOSA-N 396.468 4.229 50 1 GIGF Cc1ccc2c([C@]3(CCl)NC[C@@H]4CC(=O)N(C)c5cccc3c54)c[nH]c2c1 963017525 BUBPCRWIPQKIQT-RCDICMHDSA-N 379.891 4.012 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1O)c1cccc([C@H](O)c2ccc(C#N)cc2)c1 38145363 WGJZTXMGXRLQBF-UPPUFSLMSA-N 399.475 4.289 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(C#N)cc2)N1 587689738 VILSVEQLIIPKGS-ADLMAVQZSA-N 393.687 4.476 50 1 GIGF CC1(C)c2ccccc2N2C(=O)[C@]3(C)SS[C@@]21C(=O)N3Cc1ccccc1 169347712 ZWJIYXOZYPXDIZ-LEWJYISDSA-N 396.537 4.161 50 1 GIGF CCOC(=O)[C@H](c1nc(C)cs1)[C@]1(CCl)NCCc2c1sc(C)c2C 963019407 HBVGEBVOAJMOCO-KSSFIOAISA-N 398.981 4.057 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](C)[C@@H](O[C@@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 102999748 AKXUGEWGUZMDGE-MWHAYUHZSA-N 399.487 4.476 50 1 GIGF CCc1cc(C(=O)N[C@@H](CCl)c2ccc(Oc3ccccc3)cc2)n(C)n1 103173194 MULDAQREHBMAIX-IBGZPJMESA-N 383.879 4.485 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3c(c1)CCC(=O)N3)CC2=O 587461946 VGGZFJQWILIJHK-JOCHJYFZSA-N 399.874 4.329 50 1 GIGF CC(=CCl)[C@@H]1CC(Cl)=C(C)[C@](O)(C(Br)Br)O1 2356457839 CVIPXLIMSIYMFK-WCBMZHEXSA-N 394.918 4.235 50 1 GIGF C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@H](I)[C@@H]2O 25966324 SSYGGPAGDDGXAF-ZMSHIADSSA-N 398.284 4.023 50 1 GIGF [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 169703244 YCAXYDWVXDZEAN-OALUTQOASA-N 386.386 4.010 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(C(=O)Cl)c(F)c1 587894467 LEVAZIANEGIFLY-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1C(=C(C)C=O)CC[C@]1(C)O3 2356334033 ZSKLSJMYNRFZJZ-QFIPXVFZSA-N 380.396 4.096 50 1 GIGF CC1(C)CCC[C@]2(C)[C@H](C=O)C(C=O)=C(OC(=O)C=Cc3ccc(O)cc3)C[C@@H]12 2356705162 YVIMZBRWYFADCK-NHCICSSKSA-N 396.483 4.453 50 1 GIGF COc1cc(/C=C(/C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)ccc1O 39933149 OLUAYFHPYSVHRC-NSIKDUERSA-N 378.409 4.317 50 1 GIGF COc1cc2c3c(c1)O[C@]1(c4ccsc4CC[C@@H]1Br)[C@@H](C2)C3=O 587453638 RNLWFFQZXCQRPQ-XLWVJDPXSA-N 391.286 4.109 50 1 GIGF COC(C)(C)[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587324325 QGRNBLGWTUHIJL-XLIONFOSSA-N 378.827 4.293 50 1 GIGF COc1cccc2cc3c(nc12)[C@](CBr)(c1ccccc1)NCC3 963066902 MDNFCVXWSVNCRN-FQEVSTJZSA-N 383.289 4.028 50 1 GIGF O=C(CCCC[C@H]1CCSS1)N1CCN(CCCc2ccccc2)CC1 95582732 SISJAACCMAHCII-FQEVSTJZSA-N 392.634 4.478 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N=C=O)cc2)N1 587741704 OQMNJPYUFJCVDE-BBATYDOGSA-N 375.241 4.353 50 1 GIGF COC(=O)C=C(C)CC[C@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=C(C=O)C[C@@H]12 2356680717 RYBWQXGDQMJOIS-OTWHFAOWSA-N 390.520 4.405 50 1 GIGF COc1cc2c3c(c1)O[C@]1(c4ccccc4CC[C@H]1Br)[C@@H](C2)C3=O 587417537 NRVDRSRSCGPKDX-XAUMDUMWSA-N 385.257 4.048 50 1 GIGF COc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587545608 RTRGHEUTOUSZJO-KNQAVFIVSA-N 396.826 4.497 50 1 GIGF COc1ccc2c(c1)c(CC(=O)NN)c(C)n2Cc1ccccc1-c1ccccc1 1484230 JOJPBKJFEZKOTF-UHFFFAOYSA-N 399.494 4.206 50 1 GIGF O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1C[C@@H]1c1ccccc1 16007054 UGOFNVAWWWTSKR-AKVUPHRLSA-N 375.384 4.109 50 1 GIGF CCOc1cccc(-c2ccc(NC(=O)/C(C#N)=C(\O)CC)cc2C(=O)OC)c1 101459844 WUPLBVXSBHSLCA-VXPUYCOJSA-N 394.427 4.223 50 1 GIGF CCc1ccc(C(=O)NN(C(=O)c2cc(C)cc(COC)c2)C(C)(C)C)cc1 103185858 NEJGDOAOZLPIRA-UHFFFAOYSA-N 382.504 4.290 50 1 GIGF CS(=O)(=O)Nc1ccc(-c2csc(/C(C#N)=C\c3cccs3)n2)cc1 587924367 UWOOULTZMQOZLJ-LCYFTJDESA-N 387.511 4.307 50 1 GIGF CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1cccs1)CC2=O 587495737 SFXHMQRFFRMWND-QZMUEMGWSA-N 382.485 4.236 50 1 GIGF C[C@](Cl)(C=O)C=C[C@H](Br)[C@](C)(Cl)C=CBr 2356306752 JDUDNUKHKRTULQ-IVZWLZJFSA-N 378.919 4.409 50 1 GIGF CC(=O)O[C@@H]1C[C@@H](Br)C(C)(C)[C@@H](Cl)C1=CCBr 2356729696 BURJCSPPDZTXBA-MXWKQRLJSA-N 388.527 4.040 50 1 GIGF CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1cccc(Cl)c1)[C@@H](Br)C2=O 103113696 DXTKBFJYTILFLZ-ZLIFDBKOSA-N 384.701 4.437 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O 587417344 LQMNLQARPISJGP-DJJJIMSYSA-N 379.239 4.239 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O 587417347 LQMNLQARPISJGP-ORAYPTAESA-N 379.239 4.239 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(C(Cl)Cl)N1 587689424 SHLKSUAKGUFMOI-QTTZVWFDSA-N 375.496 4.360 50 1 GIGF Cc1[nH]nc2c1[C@](c1cc(Cl)cc(Cl)c1)(C1CCC1)C(C#N)=C(N)O2 1777699091 SPNNZCKKJSFKKB-SFHVURJKSA-N 375.259 4.197 50 1 GIGF C[C@@](O)(c1ccccc1)c1cccc(/C(C#N)=C(\N)Sc2ccccc2N)c1 38145373 XCACMUUUJDXIGW-MFSSEKOKSA-N 387.508 4.468 50 1 GIGF CC/C=C/C[C@H](Br)[C@H]1C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 145384913 MALGKLBGBZTMPV-RTQCFFNUSA-N 392.131 4.485 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cc(C)ccc1C)[C@@H](C2)C3=O 587414628 NUZBHIPIJRASGE-JXFKEZNVSA-N 387.273 4.350 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(C(=O)CBr)c(F)c1 587916476 MTIKRZFCBCLERP-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccccc1F)([C@@H](C)Br)[C@@H](C2)C3=O 587426747 POOJCHPPTVZWLZ-MPSXMAJESA-N 391.236 4.261 50 1 GIGF CC1CCC(C(=O)N(c2cc(C#CC(C)(C)C)sc2C(=O)O)N(C)C)CC1 84712493 LATMUSXHHVOIII-UHFFFAOYSA-N 390.549 4.480 50 1 GIGF in-vitro Cc1ccc2c(c1)[C@@]1(N[C@@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 587744414 ZTAARCZUDVSLBY-YUNKPMOVSA-N 399.263 4.474 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(SC#N)ccc1NC(=O)CCl 587918936 CCIVKDOOUYSRRQ-UHFFFAOYSA-N 391.279 4.499 50 1 GIGF COC(=O)c1cccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 587499443 TUYGLZWXAUNIKN-JOCHJYFZSA-N 384.859 4.452 50 1 GIGF O=C([C@H]1Cc2ccccc2[C@](CCl)(c2ccc(F)c(F)c2)N1)C(F)(F)F 962762517 JHWMGBABYYQWAT-WBVHZDCISA-N 389.751 4.093 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O[C@H](C)C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 169372007 HRGYFLQSKXKWJJ-RMCUZESISA-N 380.403 4.162 50 1 GIGF NNC(=O)c1ccc2[nH]c(-c3ccc(COc4ccccc4Cl)cc3)nc2c1 587063824 YUIIDPHZQKZHLX-UHFFFAOYSA-N 392.846 4.066 50 1 GIGF Cn1ccc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 587328099 SWYOPZDCLHNTJH-TZIWHRDSSA-N 385.822 4.363 50 1 GIGF N#CC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 587570519 JEEJKQNHVJZZGR-REWPJTCUSA-N 383.359 4.049 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)Cc2ccccc2)c1 38145316 CYPLUVFABKJRCT-VWXXCCROSA-N 387.508 4.488 50 1 GIGF COc1ccc(-c2[nH]c3ccc(C)cc3c2/C=N/NC(=O)c2ccncc2)cc1 42923148 RVTVOGDJQMPPSX-AFUMVMLFSA-N 384.439 4.311 50 1 GIGF C[C@H](O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3)C(F)(F)F 101299198 HRGYFLQSKXKWJJ-KHQAYJDYSA-N 380.403 4.162 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@H]2Br)N1 587683780 PANADNMCIQWHOZ-XPLICSAQSA-N 377.095 4.265 50 1 GIGF CC(C)=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@]4(O)C(C=O)=CC[C@@H]23)O1 2356400891 MNTJKNWRCITJMY-BQKPCUMKSA-N 398.543 4.328 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@]1(C)[C@H](C)CC[C@]2(C)C(C=O)=CCC[C@@H]21 2356458396 MPESIRKGUJLXPE-BDRMCPCVSA-N 376.493 4.319 50 1 GIGF C=C(c1ccc(Cl)cc1)[C@H]1COC2(CCC(=CC(=O)OCC)CC2)OO1 43130465 UAXRCALAHXTHNY-QSVWIEALSA-N 378.852 4.460 50 1 GIGF COc1ccccc1N1C(=O)CS[C@H]1c1cccc(CBr)c1 169342673 AAODJDXVXQLFHO-KRWDZBQOSA-N 378.291 4.369 50 1 GIGF Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)on1 587326646 MGUAQMPYMLJDTC-AZUAARDMSA-N 387.794 4.321 50 1 GIGF CC(=O)OCC(=CC(=O)O)CC[C@@]1(C)[C@@H]2CCC=C(C=O)[C@]2(C)CC[C@H]1C 2356458402 MPESIRKGUJLXPE-XOHCFOMMSA-N 376.493 4.319 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 195304539 SBCGDCBRWXAAIF-CDHQLHBISA-N 386.488 4.398 50 1 GIGF NC(=O)CCc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587496544 DUWUKPLECYOQNL-QHCPKHFHSA-N 397.902 4.083 50 1 GIGF CC[C@@H]1C[C@@H]1[C@@H]1OC(=O)CCCC=CCC=C[C@@H]2[C@H](O)[C@@H](Br)C[C@H]21 2356793908 KULVVWPMIUGXPG-NCWAAQMGSA-N 397.353 4.391 50 1 GIGF C[C@@H]1CC[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 195252365 WDTIPJZJXSSSGU-PCLCJBNISA-N 391.895 4.288 50 1 GIGF N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@H]1c1cccc(Cl)c1 1772639539 JLFJCTAQIBQKJD-SFHVURJKSA-N 399.841 4.237 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(O)cc2)N1 587682978 FFPGKMUGZSLIGA-BMLIUANNSA-N 384.676 4.310 50 1 GIGF COc1ccc(OC)c2c1C[C@H](C)N[C@@]2(C)c1cc(F)cc(CCl)c1O 963641797 XTKVEOBKZZVZGM-YBTHPKLGSA-N 379.859 4.085 50 1 GIGF N#Cc1ccc([C@@H]2[C@@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772609146 OLHLJZLZSVHXKP-QZTJIDSGSA-N 383.238 4.278 50 1 GIGF COc1ccc(C(=O)NNC(=S)Nc2csc(-c3ccccc3)c2)cc1 169350774 SUZJYLAYYMQLPG-UHFFFAOYSA-N 383.498 4.055 50 1 GIGF CC[C@H](Br)[C@@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 238773171 ZFUYDSOHVJVQNB-HLGYDTPJSA-N 392.131 4.485 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@@H]2Br 587547118 ZGSLKKVFLVKROA-MPGHIAIKSA-N 375.218 4.040 50 1 GIGF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@](CCCCCl)(c2ccnc(Cl)c2)N1 962906889 RKKIIAOLAGOQCG-LPHOPBHVSA-N 397.277 4.126 50 1 GIGF CCC[C@H](NC(=O)/C(C#N)=C/c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 73168977 YLOAKMJMGAAZFX-FYXHJSOBSA-N 394.387 4.068 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 85911689 NFCOJBIECSQMAM-HEZJUZQZSA-N 384.472 4.149 50 1 GIGF in-man Cc1cc(C)c2[nH]c([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)nc2c1 587009381 CKFQZRULNUXQJV-SFHVURJKSA-N 380.879 4.300 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(c2ccccn2)[C@H]1c1ccc(F)cc1 587329454 XVPVZUOUAGWUBT-FPOVZHCZSA-N 383.806 4.420 50 1 GIGF COc1ccc2cc([C@@H](C)C(=O)NCCSSCCN(C)C)ccc2c1 618008235 CFPNYCAZXMOETG-OAHLLOKOSA-N 392.590 4.011 50 1 GIGF C=C(C)C[C@H](OCc1ccc(OC)cc1)[C@H](O[Si](C)(C)C(C)(C)C)C(N)=O 621431321 DAXQGOHEZSHCAN-OALUTQOASA-N 393.600 4.422 50 1 GIGF CCc1ccc([C@H]2C(C#N)=C(N)Oc3c(N)cc4nc5ccccc5nc4c32)cc1 1772583318 FVPZDGZCEPJRBS-FQEVSTJZSA-N 393.450 4.146 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2ccc(C#N)cc2)c1 34035547 NOQLUDGEWWSKIF-UPPUFSLMSA-N 398.491 4.165 50 1 GIGF C=CCO/C(O)=C1\C(C)=NC(SCC)=C(C#N)[C@@H]1c1ccc(O)c(OC)c1 104087857 SBKDARPCKZFYFS-ONZPZFSWSA-N 386.473 4.419 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(C(=O)CBr)ccc1OC 587897905 AGVKVTDEMJHBEU-UHFFFAOYSA-N 393.664 4.335 50 1 GIGF N#Cc1c(-n2cc(CCCCl)nn2)c2ccccc2n2c1nc1ccccc12 1857612284 IRIGYCCXBKMART-UHFFFAOYSA-N 386.846 4.264 50 1 GIGF COc1cc2c3c(c1)O[C@](CSC#N)(c1sccc1Cl)[C@@H](C2)C3=O 587454450 ZEBNEFLKDVDRLZ-GTNSWQLSSA-N 377.874 4.267 50 1 GIGF O=C(N/N=C/c1ccc(CSc2nc3ccccc3o2)cc1)c1ccncc1 1857650348 ZORICQZSZDASHL-YDZHTSKRSA-N 388.452 4.279 50 1 GIGF Cc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C(\O)c1ccc(C(F)(F)F)cc1 101499899 LOGFIGZNOIGDHG-PEZBUJJGSA-N 391.305 4.353 50 1 GIGF CC[C@]1(CBr)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587322868 PJRVYGSNAUMQAV-FUHWJXTLSA-N 379.225 4.434 50 1 GIGF CCCCC1(CCCC)C[C@@H](CNCCCn2ccnc2)[C@@](C)(OC)OO1 1857606234 ZRJTUXPFSLFBIV-PMACEKPBSA-N 381.561 4.313 50 1 GIGF CC(C)C[C@H]1C[C@@H](CCl)[C@]2(C(=O)Nc3ccccc32)N1C(=O)c1ccccn1 1772655248 OZZUCMKNQDRXRT-WCJKSRRJSA-N 397.906 4.045 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O[C@@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 102999750 AKXUGEWGUZMDGE-MPGVNOLKSA-N 399.487 4.476 50 1 GIGF O=C(Nc1cc2c3c(cccc3c1)C(=O)OC2=O)c1ccc(C(F)(F)F)cc1 95583480 HYTPHFWTBFXNJN-UHFFFAOYSA-N 385.297 4.422 50 1 GIGF O=C(N/N=C(\C=C\c1ccccc1O)c1ccccc1O)Nc1ccc(F)cc1 103200925 LRTKSLOZISEZHM-CCDJVQBGSA-N 391.402 4.476 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587087776 UCYMZFFMLFKEEW-VIFPVBQESA-N 395.026 4.418 50 1 GIGF CC(C)[C@H](Br)[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587537262 CEKNCSKZUKVDLQ-RLFYNMQTSA-N 377.234 4.142 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccccc2)[C@]2(C)[C@@H](C=O)C(C=O)=CC[C@H]12 2356695041 QTXOFCZHIZFJCA-SEDAZVQISA-N 380.484 4.398 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2ccsc2)c1 38145394 LRMZIIZKIYGYSJ-YTVAGWOFSA-N 379.510 4.355 50 1 GIGF C=C(c1ccc(Cl)cc1)[C@@H]1COC2(CCC(=CC(=O)OCC)CC2)OO1 43130467 UAXRCALAHXTHNY-LROBGIAVSA-N 378.852 4.460 50 1 GIGF COc1ccc([C@@H]2[C@H](C)C(=O)C[C@H](c3ccc(F)cc3)N2C(=O)CCl)cc1 299858458 RXXAPBCIJIFNMW-GIWSNZPPSA-N 389.854 4.293 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@@H]2Br 587543546 KTDXELDQKBBWHD-TXPKVOOTSA-N 389.245 4.430 50 1 GIGF N#Cc1ccc([C@H]2[C@@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772609145 OLHLJZLZSVHXKP-MSOLQXFVSA-N 383.238 4.278 50 1 GIGF C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@]2(O)C#CCBr 13835233 PJRJUHWLIAZCLV-MJCUULBUSA-N 389.333 4.378 50 1 GIGF N#C/C(=C\c1cccc(Br)n1)C(=O)N[C@H](c1ccccc1)C1CC1 43129413 TZISYUGHDFOMLF-HAZIXKIPSA-N 382.261 4.019 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 103167317 DKLRKSZQSVUEJP-CVEARBPZSA-N 388.210 4.492 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] 103189201 OZFLQFKFMRZOMP-JKSUJKDBSA-N 385.832 4.127 50 1 GIGF COCCCN1CCc2ccc(OC)cc2[C@]1(C(C)C)[C@H](C)Br 961321641 KCXGARHINWPQFR-KXBFYZLASA-N 384.358 4.225 50 1 GIGF COc1ccc2[nH]c(C(=O)N3C[C@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 1859586 ZHGAQKHGMIEBNJ-LBPRGKRZSA-N 385.807 4.068 50 1 GIGF CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@H]12)C(=O)OC4=O 84690973 GGBLSHLZOFDPSY-CYKJOMKPSA-N 376.493 4.032 50 1 GIGF CC(=O)SCC[C@@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587612664 KJCZJCGFGUMCLS-LPHOPBHVSA-N 392.860 4.001 50 1 GIGF CC(C)(C)OC(=O)n1c2c(c3ccccc31)[C@H](C(F)(F)F)C(C#N)=C(N)O2 1857648142 GVJGWUMSDSMNSK-CYBMUJFWSA-N 379.338 4.157 50 1 GIGF CCc1cc(C(=O)N[C@H](CCl)c2ccc(Oc3ccccc3)cc2)n(C)n1 103173196 MULDAQREHBMAIX-LJQANCHMSA-N 383.879 4.485 50 1 GIGF CN(C)CCSSCCNC(=O)C(C)(c1ccccc1)c1ccccc1 618008464 GUZMOIHXFACUBI-UHFFFAOYSA-N 388.602 4.052 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3c(c1)OCCO3)CC2=O 587460701 OVXPFVBYKOFTEE-NRFANRHFSA-N 388.847 4.215 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2ccc(Br)c(C)c2[nH]1 586970875 LIULJVQASYKWBY-LLVKDONJSA-N 376.092 4.495 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1F)([C@H](C)Br)O2 587384800 IZJJHQOVKMNEAX-VOJFVSQTSA-N 378.241 4.360 50 1 GIGF CC[C@H](O[Si](C)(C)C(C)(C)C)[C@](C)(O)[C@@H](O)[C@H](C)COC(=O)C(C)(C)C 2356699299 MIABMGRTXDZCFD-OLPIVMHESA-N 390.637 4.124 50 1 GIGF COC(=O)C1=CC[C@H]2[C@](C)([C@@H](O)C[C@@H](Cl)[C@@]2(C)CCC=C(C)C)[C@@H]1C=O 2356730840 KSXULPOQIKTIMP-HCNLZUIDSA-N 382.928 4.052 50 1 GIGF C[C@@H](C(=O)NNC(=O)NCc1ccccc1)c1cccc(Oc2ccccc2)c1 84603010 XGDRWRDHMAFDBI-QGZVFWFLSA-N 389.455 4.113 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587541906 DTIWKVCMRZUCJM-NQIIRXRSSA-N 398.846 4.147 50 1 GIGF Cc1ccc(C=NNC(=O)c2cc(Cl)ccc2C(=O)NC2CCCCC2)o1 472791608 TYTNUNFSLXNMEU-UHFFFAOYSA-N 387.867 4.068 50 1 GIGF Cc1nc(C)c([C@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)o1 587498957 KJJPJCONUSHCFV-LJQANCHMSA-N 390.277 4.426 50 1 GIGF C[C@]1([C@@H](Br)CO)CC=C2[C@@H](C1)[C@H](O)C[C@@H]1[C@@]3(C)C[C@H]3CC[C@@]21C 34405784 IGLIAOHRQDMKEI-UBXGAJKGSA-N 383.370 4.292 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(c2ccccn2)[C@@H]1c1ccc(F)cc1 587329457 XVPVZUOUAGWUBT-TZIWHRDSSA-N 383.806 4.420 50 1 GIGF O=C([C@H]1Cc2ccccc2[C@@](CCl)(c2ccc(F)c(F)c2)N1)C(F)(F)F 962762515 JHWMGBABYYQWAT-NVXWUHKLSA-N 389.751 4.093 50 1 GIGF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@](CCCCCl)(c2ccc(F)c(F)c2)N1 962906820 RDNZWCOLWVQWNI-ICSRJNTNSA-N 397.824 4.356 50 1 GIGF CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccccc1Br 49035303 RTQDJLBGMRLHHR-NTUHNPAUSA-N 377.245 4.458 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(C(=O)O)oc1C)CC2=O 587459289 HPCCOVRDHOXDOU-LJQANCHMSA-N 378.808 4.044 50 1 GIGF CC1(C)Oc2nc3ccc(Br)cc3c(O)c2C[C@@H]1Br 28253985 YGIIMRSDLDGREM-NSHDSACASA-N 387.071 4.180 50 1 GIGF CC(=O)OC/C(=C\CC/C(C)=C\CO)CCC[C@H](C)C(=O)/C=C/C(C)(C)OO 85944893 VFWLLWIEDAKQNA-HFGGDSHXSA-N 396.524 4.395 50 1 GIGF CN(C)/C=C(/C#N)[C@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 587529619 AGVZBDKYNOMXPU-OZDVPOGGSA-N 378.497 4.457 50 1 GIGF C[C@H](Br)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587540064 ZUJSYPHKOOKTPF-UTLVKMTRSA-N 389.245 4.286 50 1 GIGF CC=CC[C@@H]1O[C@H]([C@@H]2C[C@H](Br)[C@H](CC)O2)C[C@H]1Br 2356782370 DXFOROLMOVEIQX-ZFSZKFIGSA-N 382.136 4.205 50 1 GIGF O=C(Oc1ccc2c(c1Cl)CCCN2C(=O)C(Cl)Cl)c1ccco1 77946426 XAJKVLQIIPSZKK-UHFFFAOYSA-N 388.634 4.235 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2cccc(I)c2[nH]1 587087912 YSAOTVSTLPZBFR-SECBINFHSA-N 397.029 4.352 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)[C@H](C)Cl)c1C)[C@@H](C2)C3=O 587417692 ONBQUIWCUSTKTO-GUEQVVBPSA-N 387.863 4.113 50 1 GIGF C[C@H](Br)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587322426 MJCDRGGGNMIKAG-HIIUDZQISA-N 379.225 4.432 50 1 GIGF O=P(NCc1cccnc1-c1cccnc1)(c1ccccc1)c1ccccc1 95595214 YNZQNBOSAUGHEZ-UHFFFAOYSA-N 385.407 4.162 50 1 GIGF C[C@H]1CC[C@@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]32OO4 194892187 SBCGDCBRWXAAIF-DUXKNNISSA-N 386.488 4.398 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@@H](Br)C3 586986229 POUJZEMDGREAIU-SNVBAGLBSA-N 380.241 4.404 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(C2CCOCC2)[C@@H]1c1ccc(F)cc1 587325040 BQUSEKLCEXCKES-TZIWHRDSSA-N 390.838 4.294 50 1 GIGF CC[C@H](Br)[C@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 587376730 XZFBJUPWHAXEMT-YJBOKZPZSA-N 375.266 4.006 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N=C=O)cc2)N1 587741708 OQMNJPYUFJCVDE-ZMZPIMSZSA-N 375.241 4.353 50 1 GIGF COc1ccc([C@@H]2[C@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772642954 QKYATZBPHAXODG-ZWKOTPCHSA-N 388.254 4.415 50 1 GIGF COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CC[C@]13C=C(C(C)(C)OO)[C@H](C[C@H]21)OO3 95913662 JTMNVWQNMNACAS-ZOLGCQAOSA-N 380.481 4.050 50 1 GIGF biogenic,in-vitro N#CC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 587570516 JEEJKQNHVJZZGR-OFNKIYASSA-N 383.359 4.049 50 1 GIGF CC(=O)SCC[C@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587612666 KJCZJCGFGUMCLS-VQIMIIECSA-N 392.860 4.001 50 1 GIGF C=C1CC[C@H]([C@]2(C)CC[C@H](C(C)(C)NC)O2)[C@@H]2[C@@H]1CC[C@@](C)(O)[C@@H]2N=C=S 2356809135 ANRLMRLBKAVEHS-FMSQMDLGSA-N 392.609 4.137 50 1 GIGF CCOC(=O)c1cc(N=C/C(C#N)=C(\O)OCC)c2ccc(OC)c(OC)c2c1 299846767 WJEGIHQZGQUQQX-VQXDDHKOSA-N 398.415 4.066 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(C2CCOCC2)[C@@H]1c1ccc(F)cc1 587325030 BQUSEKLCEXCKES-CTNGQTDRSA-N 390.838 4.294 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CBr)(c1ccc(O)cc1)CC2=O 587455993 IJJGFJRQARIQER-IBGZPJMESA-N 391.261 4.306 50 1 GIGF CC1(C)C(Br)=C[C@@H]2O[C@@]2(C)[C@@]12C[C@H](Br)[C@]1(C)C[C@H]2O1 2356851374 QGZVAFYBURCCNT-UBHGWVTLSA-N 392.131 4.164 50 1 GIGF COc1cc2c3c(c1)O[C@@]1(c4ccccc4CC[C@@H]1Br)[C@@H](C2)C3=O 587417534 NRVDRSRSCGPKDX-KNBMTAEXSA-N 385.257 4.048 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(C#N)cc2)N1 587690005 YPIDIOZBVUEGNZ-VOJFVSQTSA-N 393.687 4.476 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)([C@H](C)NC(=O)OC(C)(C)C)CC2=O 587458610 CNADUWJOBTTXCO-FKIZINRSSA-N 397.899 4.201 50 1 GIGF Cc1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)[nH]1 587541580 CIMUFAPOJSPJKK-RXVVDRJESA-N 383.831 4.433 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](C)[C@@H](O[C@@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@H]1[C@]32OO4 102999743 AKXUGEWGUZMDGE-DLCNRWQMSA-N 399.487 4.476 50 1 GIGF CC1=CC[C@H]([C@@](C)(Cl)CCl)O[C@H]1C(Br)Br 257420469 FVPHWLFPVMYUFV-MRTMQBJTSA-N 380.935 4.442 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12c1ccccc1C[C@H]2Cl 587550972 WQWSKRWPSGWGBF-DXIQSLLYSA-N 378.811 4.413 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCBr)(c1ccc(F)cc1)[C@@H](C2)C3=O 587427606 JBQMQIWXBMTZHU-KXBFYZLASA-N 391.236 4.262 50 1 GIGF Cc1c(O)ccc2c1[C@](C)(CCCO[Si](C)(C)C(C)(C)C)N[C@H](C(=O)O)C2 963509533 OBNOOPUYTBYDKB-KKSFZXQISA-N 393.600 4.317 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 169371573 IGHHGSMGNAAZGN-DHDRQPPESA-N 385.504 4.067 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4cc(OC)ccc14)[C@@H](C2)C3=O 587423080 RWHSUIQHRIZPNP-BTYIYWSLSA-N 383.831 4.067 50 1 GIGF O=C(O)[C@@H]1Cc2c(Cl)cc(F)c(F)c2[C@](CCCl)(c2cccs2)N1 962998180 SKTSMGCZTYITKE-ZBEGNZNMSA-N 392.254 4.151 50 1 GIGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@](CBr)(c2cncc(F)c2)N1 962938945 ATJSFIINZXLUQW-LIRRHRJNSA-N 388.284 4.265 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2ccc(C#N)cc2)c1 34035548 NOQLUDGEWWSKIF-PPCHASGVSA-N 398.491 4.165 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C/N(C)C)(c1ccccc1Cl)O2 587376014 BMBHMEKGTLZSOQ-OSJHKOOESA-N 381.863 4.060 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] 103176499 XDXFIYWDJSSSPE-JKSUJKDBSA-N 388.210 4.492 50 1 GIGF CC1=CC[C@H]([C@](C)(Cl)CCl)O[C@H]1C(Br)Br 86036153 FVPHWLFPVMYUFV-NQMVMOMDSA-N 380.935 4.442 50 1 GIGF COc1cc2c3c(c1)O[C@@H]([C@@]14C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C4C=O)[C@@H](C2)C3=O 587444599 FDZXGJGWLLKEIR-PCALSQJKSA-N 392.495 4.399 50 1 GIGF COc1ccc(-c2cc(N)c(C(=O)NN=Cc3ccc(Cl)cc3)s2)cc1 958021757 FDPALAITAQFBKR-UHFFFAOYSA-N 385.876 4.423 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 103196250 XMVQHNUPHYJXOS-HZPDHXFCSA-N 385.832 4.127 50 1 GIGF CCOC(=O)c1c(O[C@@H]2CCCC[C@@H]2Cl)cc(Cc2ccccc2)[nH]c1=O 95591839 BJKWBSFFJGSPLK-DLBZAZTESA-N 389.879 4.071 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(C1(c3ccccc3)CC1)O2 587375430 SFDQQELWUVCZRS-HXUWFJFHSA-N 386.289 4.408 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](CCBr)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103104880 HKYZQQBQIMALCA-VBGZEHGNSA-N 375.303 4.022 50 1 GIGF COc1ccc(-c2nc(C(=O)NN=C(C)C)cc3c2[nH]c2ccccc23)cc1O 73162644 ZASNKNHGMUMCDU-UHFFFAOYSA-N 388.427 4.223 50 1 GIGF C[C@@H]1CC[C@H]2[C@H](CSc3ccccc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]32OO4 43422844 OCZSYYGYYJECSV-ZHFGFOILSA-N 390.501 4.167 50 1 GIGF COCCCn1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587373472 QYAQWCGUVISMIG-OAQYLSRUSA-N 390.911 4.132 50 1 GIGF CC1(C)[C@]2(C(=O)Nc3cccc(Cl)c3)CC[C@@]1(C)C(=O)[C@@H]2Br 13139213 DXTKBFJYTILFLZ-AFAVFJNCSA-N 384.701 4.437 50 1 GIGF N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2ccccc2F)[C@@H]2CCC=C12 169348511 QIGXXVYUIXDNPL-JLTOFOAXSA-N 384.410 4.061 50 1 GIGF Cc1ccc(/C=C(\C#N)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 587189063 ZOLYMSQRIDNDNQ-MDWZMJQESA-N 391.374 4.229 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](Br)Cc1ccccc1F)O2 587385128 MAJNDUSSUZXSPQ-MJGOQNOKSA-N 392.268 4.446 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1cc(F)ccc1CBr)[C@@H](C2)C3=O 587426484 ORHWXDCGASUJSP-KSSFIOAISA-N 377.209 4.218 50 1 GIGF CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1cccc(Br)c1 49067315 LZTLVDAYXRDRKI-VGOFMYFVSA-N 377.245 4.458 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cccc(Cl)c1)[C@@H](C2)C3=O 587414873 PEERMUPVQQSLTG-KBXCAEBGSA-N 393.664 4.386 50 1 GIGF Br[C@@H]1C=C[C@]2(C1)c1ccccc1C[C@@H]1CN(c3ccccc3)CCN12 962626721 CFRUFDDERVFBIU-UZKOGDIHSA-N 395.344 4.352 50 1 GIGF CC1(C)CC[C@@H](OC(=O)/C=C/c2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 139780085 QTXOFCZHIZFJCA-YVQPOPCBSA-N 380.484 4.398 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)N[C@@H](C)Cc3ccc(F)c(Br)c32)o1 587685719 RJQRYONLMFYIMU-PWJLMRLQSA-N 387.680 4.210 50 1 GIGF CC1(C)[C@H](Br)CC[C@@]2(C)O[C@H](CBr)[C@@]3(C)O[C@H]3C[C@H]12 238755001 PDQNHDCJWUTAFX-HAJOPNNUSA-N 396.163 4.286 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(C)cc(Br)c2[nH]1 586970226 BYJUCLXJCSFEIC-NSHDSACASA-N 376.092 4.495 50 1 GIGF C[C@H](NC(=O)OC(C)(C)C)[C@]1(CCl)CC(=O)c2ccc3c(c2O1)CCCC3 587496899 GTAGBJXNVBSZJN-YEJXKQKISA-N 393.911 4.421 50 1 GIGF Cc1cccc(C)c1NC(=O)N/N=C/c1c(F)cc(Br)cc1F 169335074 OORWPXWITKQLBC-DNTJNYDQSA-N 382.208 4.500 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 103167898 HLXWDFOMGZVXTL-HZPDHXFCSA-N 388.210 4.492 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C#N)=COc1ccccc12 587743097 VEYDRGCHNQLRRS-WLRWDXFRSA-N 385.236 4.166 50 1 GIGF CC(=CCl)[C@H]1CC(Cl)=C(C)[C@](O)(C(Br)Br)O1 2356457833 CVIPXLIMSIYMFK-PSASIEDQSA-N 394.918 4.235 50 1 GIGF CCOC(=O)[C@@H](Cl)[C@@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 587494778 ABWPWTFMCCAAMB-TZIWHRDSSA-N 378.896 4.486 50 1 GIGF Cn1cc(C(=O)N/N=C\c2c[nH]c3ccccc23)c2cc(Br)ccc21 1857561580 GYIPRXMIWAZVII-YVNNLAQVSA-N 395.260 4.186 50 1 GIGF C[C@@H]1CC[C@H]2[C@H](CSc3ccccc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 100961504 OCZSYYGYYJECSV-PXHONOBZSA-N 390.501 4.167 50 1 GIGF CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@H](CC(=O)O)C(=O)O[C@@]32C1 299848051 CWCXONZIEDNVKI-VDRZSPDHSA-N 399.325 4.010 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(F)cc1C(=O)Cl 587894295 XQDXWSASVCGHSV-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C\N(C)C)(c1ccccc1Cl)O2 587376006 BMBHMEKGTLZSOQ-KGXYIWNSSA-N 381.863 4.060 50 1 GIGF Cc1cc(C)c(C)c([C@@]2(CCl)NCCc3ccc(C(=O)N(C)C)cc32)c1C 962934118 JUYWSOGTABVUDJ-QHCPKHFHSA-N 384.951 4.250 50 1 GIGF COc1ccc(O[C@@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 103105630 FEPLYIUDBNDUQK-KUKAFERESA-N 390.476 4.282 50 1 GIGF C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 299818384 MUCWOBDSQXBTNM-VBNFAEQJSA-N 394.584 4.493 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@H](C)Br)O2 587385585 UERFHZGKPSJKDX-BBATYDOGSA-N 378.241 4.360 50 1 GIGF COc1ccc2c(Cl)c(C(=O)N/N=C\c3ccc4c(c3)OCO4)sc2c1 33323451 SMDIQTDXDQNQEP-ZBKNUEDVSA-N 388.832 4.056 50 1 GIGF CC(C)=CC/C=C(/C)C/C=N/NC(=O)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 95583019 ACBZKGXVOLNRPX-CZTLLUBRSA-N 398.423 4.445 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(C(=O)Cl)c1F 587893871 IFFIDFVYWZNMRK-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF Cc1ccc([C@@]2([C@@H](C)Br)NCCc3c2c(C(C)C)nn3C)cc1 962923081 UUAZJOJCFXLMRN-AUUYWEPGSA-N 376.342 4.025 50 1 GIGF O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C12C[C@H]3C[C@@H](C1)CC(C1CCCC1)(C3)C2 653887838 SLCNIKDVSDPJMD-WGVGXIRESA-N 385.464 4.415 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2cccs2)c1 38145326 KVBKSLWDDPQZCU-AZGFIHASSA-N 379.510 4.355 50 1 GIGF CO[C@H]1O[C@@]2(C)OO[C@@]13[C@H](CCOCc1ccccc1)CCC[C@@H]3C[C@@H]2C 38158735 XCVQTZNHQAJEIO-BGOZWBLRSA-N 376.493 4.455 50 1 GIGF COc1ccc(O[C@H]2O[C@@H]3O[C@@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 43946966 FEPLYIUDBNDUQK-MAWUFDTGSA-N 390.476 4.282 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc3c4c(c1)cc(O)n4CCC3)O2 587371164 DPWBBGQYIKTBRB-QFIPXVFZSA-N 396.874 4.283 50 1 GIGF O=C(c1cccnc1)N(/N=N/c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 1772598975 VWXGPEFIUGNJPF-QZQOTICOSA-N 392.331 4.244 50 1 GIGF CCOc1cc(/C(=C/C#N)c2ccc(OC)c(OC(=O)N(C)C)c2)ccc1OC 84541542 CJDUNKLUUVJWIS-BOPFTXTBSA-N 396.443 4.118 50 1 GIGF CC[C@]1(CBr)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587322869 PJRVYGSNAUMQAV-SJLPKXTDSA-N 379.225 4.434 50 1 GIGF ClC[C@@]1(c2cscn2)c2ccccc2C[C@@H]2CN(c3ccccc3)CCN21 962627932 IIBMQCCPCRSMCQ-KNQAVFIVSA-N 395.959 4.372 50 1 GIGF CC(C)[C@@H]1C[C@@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O 101945149 BDIHJSNVMBYIDA-WBYQPROMSA-N 385.386 4.370 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(F)ccc1C(=O)Cl 587893797 DNINWDGPVQYVGT-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF COc1ccc(/C=N\NC(=O)c2cccc(F)c2)cc1COc1ccccc1 33333610 JAOZBKDGBXPXRA-OYKKKHCWSA-N 378.403 4.177 50 3 GIGF CC/C(=N\NC(=O)c1cc(Br)ccc1O)c1cc2ccccc2[nH]1 95564104 HSTMQYAJCULWHK-KGENOOAVSA-N 386.249 4.180 50 1 GIGF Cn1oc2cc3c(c4cccc(c1=O)c24)[C@H](CCl)CN3C(=O)OC(C)(C)C 95602926 PJFGCGIILHLKJD-LLVKDONJSA-N 388.851 4.362 50 1 GIGF CCNC(=O)c1ccc(C(C#N)=C2C[C@H]3CC[C@H](C2)N3Cc2ccoc2)cc1 101017459 BKCDCSOAOQZEDS-NHCUHLMSSA-N 375.472 4.133 50 1 GIGF C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N/C1=C\C(=O)Sc1ccccc1 195883120 DWMPNCPXQARGKK-FVGVYWHSSA-N 377.582 4.346 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2ccc(Br)c(C)c2[nH]1 586970876 LIULJVQASYKWBY-NSHDSACASA-N 376.092 4.495 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C/N(C)C)(c1ccc(Cl)cc1)O2 587377951 LBNSVSPSIJLRLI-NKSQBSFPSA-N 381.863 4.060 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(C(=O)Cl)c1 587882693 KDOIXYBOVGUWDA-UHFFFAOYSA-N 380.658 4.083 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1ccc(Br)cc1)[C@@H](C2)C3=O 587419022 RGPNWOFYBVVUHI-KBXCAEBGSA-N 393.664 4.339 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccccc2)[C@]2(C)[C@H](C=O)C(C=O)=CC[C@@H]12 2356695040 QTXOFCZHIZFJCA-MDAIXWLXSA-N 380.484 4.398 50 1 GIGF CN1C(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#CCCCl)[C@@H]3CC[C@@H]12 58614451 SUSIRKQQOODCLS-WNGCJKCESA-N 391.983 4.213 50 1 GIGF C[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C(=O)CBr)[C@H]1CCC2=O 253697017 AGHFYYSPGSRXOM-OIUNUZSUSA-N 393.321 4.032 50 1 GIGF C[C@H]1Oc2ccc(Cl)cc2[C@@H]2[C@@H]1C=C(C=O)[C@@H](C)[C@]21C(=O)Nc2ccccc21 1772615606 NLTYLDSERPRVAI-XBJPQDNYSA-N 393.870 4.486 50 1 GIGF Cc1ccc(C(=O)Nc2cccc(C(=O)N/N=C\c3ccc(F)cc3)c2)cc1 33295631 AJLDVRUELJEYKQ-OYKKKHCWSA-N 375.403 4.150 50 1 GIGF CC(=O)SCC[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 587844582 LOUWEQBIHMILFZ-VFZGTOFNSA-N 394.737 4.226 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(CN(C)C(=O)[C@@H](C)Cl)cc1 587905876 LJSMNLPMYAKNLI-CQSZACIVSA-N 376.283 4.334 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N=C=O)cc2)N1 587742050 PTQFFJYJIKZGFC-VOJFVSQTSA-N 375.241 4.353 50 1 GIGF C/C(Nc1ccc([N+](=O)[O-])cc1)=C(/C#N)C(=O)Nc1ccc(C(F)(F)F)cc1 40461348 KSTWSNRLDOBWBJ-LFIBNONCSA-N 390.321 4.462 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccsc2CC[C@H]1Br 587414559 NAMYMKISRXBPJZ-NVXWUHKLSA-N 378.291 4.209 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(Br)cc(F)c2[nH]1 586971588 UCVQMQJQNDDBEY-JTQLQIEISA-N 380.055 4.326 50 1 GIGF CCc1ccc(CC)c([C@]2(CCl)N[C@H](C(=O)O)Cc3cc(F)ccc32)c1 962892549 GGBMMQWNIMXTPA-PZJWPPBQSA-N 375.871 4.032 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@]2(C)[C@@H](OC(=O)C=Cc2ccccc2)C1 2356566371 FRHWTFAYHKXVPQ-GRSYGWAWSA-N 378.468 4.318 50 1 GIGF CC(=O)NCc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587496345 CLLYQMWPRXEWHN-HSZRJFAPSA-N 397.902 4.301 50 1 GIGF C[C@@H]1CC[C@H]2[C@]3(CC[C@H]3C[Si](C)(C)C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 299818386 MUCWOBDSQXBTNM-WHEBEGSLSA-N 394.584 4.493 50 1 GIGF NC(=O)CCc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587496543 DUWUKPLECYOQNL-HSZRJFAPSA-N 397.902 4.083 50 1 GIGF CC/C=C/C[C@@H](Br)[C@H]1C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 136350951 MALGKLBGBZTMPV-NASZVTRNSA-N 392.131 4.485 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(F)cc(C(=O)Cl)c1 587893927 KAGBCSCBZXOEJV-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF O=C(CCc1ccc(Cl)c(Cl)c1)N[C@@H](Cc1ccccc1)C(=O)CCl 26158933 QLOZGTZEJDNWFT-KRWDZBQOSA-N 398.717 4.461 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1cc(CBr)ccc1F)[C@@H](C2)C3=O 587424562 PEZPMPGRUGRDCH-SCLBCKFNSA-N 377.209 4.218 50 1 GIGF CN(C(=O)Cc1ccc(N=C=S)cc1)[C@H](CN1CCCC1)c1ccccc1 13738411 HFZVNQMPSGSXHS-OAQYLSRUSA-N 379.529 4.259 50 1 GIGF C/C(=N/NC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1)c1ccncc1 15961517 RGPNMWFLDDVKBB-QFEZKATASA-N 392.846 4.141 50 1 GIGF C=C1C[C@H](OC(C)=O)[C@H](Br)C(C)(C)[C@]12CC=C(C)C[C@H]2OC(C)=O 13379291 UFKFDTHMWZFEOE-MJQMVNBJSA-N 399.325 4.326 50 1 GIGF biogenic CC(C)[C@H](Br)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl 26501457 ANQVULZQKYIFNP-JTQLQIEISA-N 384.053 4.059 50 1 GIGF CCC[C@H]1C[C@H](OC(C)=O)C(Cl)=C(C(Br)Br)O1 2356792338 JPGOTFWANJGLNW-YUMQZZPRSA-N 390.499 4.073 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(C(=O)CBr)ccc1F 587916620 PEMOFZKXASSPBM-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cccc(C(=O)CBr)c1F 587916772 TZNRGIJFGHUUEQ-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 586974161 RUZQCWZYCIHATN-MRVPVSSYSA-N 385.187 4.370 50 1 GIGF C[C@H](Cl)C(=O)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587495860 ALKGMFXWOKISHM-WNSKOXEYSA-N 397.902 4.170 50 1 GIGF Cc1ccc2c(c1CC[C@H](Br)C(C)(C)O)C(=O)C(=O)C(C(C)C)=C2 26652474 REGVXHGIAQRHEZ-INIZCTEOSA-N 393.321 4.267 50 1 GIGF COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)c(C)c2)c1=O 169325937 ZPOOQILWHVXHRV-FOKLQQMPSA-N 392.484 4.423 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(C(Cl)Cl)N1 587689423 SHLKSUAKGUFMOI-PWCHPLFNSA-N 375.496 4.360 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(O)c(C(=O)CBr)c1 587898714 PFCVBQMESJLDBR-UHFFFAOYSA-N 379.637 4.032 50 1 GIGF CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)cc2C)c(C(=O)OC)c1 101459830 OIPUTBUJAIRBAM-HNENSFHCSA-N 382.391 4.272 50 1 GIGF O=P(Nc1cc(F)ccc1-n1cccn1)(c1ccccc1)c1ccccc1 95593577 BXDCBYARCQQTBD-UHFFFAOYSA-N 377.359 4.352 50 1 GIGF CCCN1[C@@H](C)Cc2ccccc2[C@@]1(CBr)c1cccc(OC)n1 963237694 YXXGGXIORTYJHY-YWZLYKJASA-N 389.337 4.385 50 1 GIGF Cc1ccc([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)[C@]23C(=O)Nc2ccccc23)cc1 169348681 OBGZVHYYLHROOS-WSUBETFTSA-N 381.479 4.445 50 1 GIGF Cc1ccc([C@@]2([C@H](C)Br)NCCc3c2c(C(C)C)nn3C)cc1 962923082 UUAZJOJCFXLMRN-IFXJQAMLSA-N 376.342 4.025 50 1 GIGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@]2(N1)C(C=O)=COc1ccc(Cl)cc12 962950572 NRYSCDAGRYHCQH-NYHFZMIOSA-N 378.859 4.464 50 1 GIGF C[C@@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Cc2ccccc2)c1 84597031 KKMJRJNRGYMHNY-GOSISDBHSA-N 393.531 4.292 50 1 GIGF COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)cc2)c1=O 169330743 UMCJZLUBGYOXLU-SSDVNMTOSA-N 378.457 4.115 50 1 GIGF COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]1CC[C@@]13C=C(C(C)(C)OO)[C@@H](C[C@@H]12)OO3 2356765307 JTMNVWQNMNACAS-PLVDSEAXSA-N 380.481 4.050 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 103196261 DWAVMDSJIRPCPO-HZPDHXFCSA-N 385.832 4.127 50 1 GIGF O=C(NN=Cc1cccs1)c1cc(Cl)ccc1C(=O)NC1CCCCC1 472791548 BBJSSSCFQISVKA-UHFFFAOYSA-N 389.908 4.228 50 1 GIGF C[C@H](N=C=O)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 587883368 ILXYUDZNGRPIAG-AWEZNQCLSA-N 387.266 4.101 50 1 GIGF COc1cccc([C@]2(C(F)(F)F)CC(c3ccc(C)cc3)=C(C#N)C(=O)N2)c1 1772623169 VAIQMICSZYVISL-FQEVSTJZSA-N 386.373 4.259 50 1 GIGF CSc1ccc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2c1 587009618 NOAUVMOYUPMJSR-SFHVURJKSA-N 398.919 4.405 50 1 GIGF Cc1ccc(-c2nc3ccccc3n2CC(=O)N/N=C/c2ccccc2Cl)o1 1857630434 UGUNGFJEQSITIX-FSJBWODESA-N 392.846 4.408 50 1 GIGF CCOC(=O)C[C@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 587498399 GXTKFMDNFNUFKT-BLVKFPJESA-N 395.293 4.006 50 1 GIGF COc1ccc2c(c1OC)[C@@](C)(C(C#N)=C1Nc3ccccc3N1)N(C)[C@@H](C)C2 962571957 PKROLCKRNMHEEB-LFVRLGFBSA-N 390.487 4.068 50 1 GIGF O=C(c1ccc(OCCCCBr)c([N+](=O)[O-])c1)C(Cl)Cl 1857656031 OBKVZZCMRKLOOJ-UHFFFAOYSA-N 385.041 4.135 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C/N(C)C)(c1ccccc1Cl)O2 587376016 BMBHMEKGTLZSOQ-ZISLFAKRSA-N 381.863 4.060 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccccc1Cl)O2 587373580 MERJEBBIFSSVBQ-KRWDZBQOSA-N 380.669 4.486 50 1 GIGF CC(C)(NC(=O)CCl)c1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 587009606 NESSTBSMPBHCOV-UHFFFAOYSA-N 384.892 4.430 50 1 GIGF [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 169703246 YCAXYDWVXDZEAN-MOPGFXCFSA-N 386.386 4.010 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(NC(=O)CCCCl)cc1)O2 587377586 XCPIVKDVUOTSNW-NRFANRHFSA-N 386.879 4.415 50 1 GIGF Cc1ccc(SCc2n[nH]c3c2[C@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1 4168397 QHPLVOGJTWERNY-KRWDZBQOSA-N 378.457 4.130 50 3 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N=C=O)c2)N1 587742588 SHTHEQPLEWSXAB-BBATYDOGSA-N 375.241 4.353 50 1 GIGF CCC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@@H](C=C=CBr)C[C@@H]2O1 2356545020 MALGKLBGBZTMPV-MEXNZXMWSA-N 392.131 4.485 50 1 GIGF CCO/C(O)=C1\C(C[S@](=O)c2ccccc2)=NC(C)=C(C#N)[C@H]1c1ccco1 40810746 RFSFTDZEDALWJG-XBWCCTEBSA-N 396.468 4.229 50 1 GIGF Cc1ccc(C2=C(C#N)C(=O)N[C@](c3ccc(N(C)C)cc3)(C(F)(F)F)C2)cc1 1772593899 QPVBOLUSJHWRPQ-OAQYLSRUSA-N 399.416 4.316 50 1 GIGF CC(=O)NC1=C(C#N)[C@@H](c2ccccc2)C2=C(C[C@@H](c3ccccc3)CC2=O)O1 64549312 LPTXCIPKWKYQCQ-PGRDOPGGSA-N 384.435 4.072 50 1 GIGF COC(=O)CCCCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 95809804 LZZPPZJIEGUMAL-HAVVHWLPSA-N 382.460 4.443 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(Cl)s1)[C@@H](C2)C3=O 587452734 OTRXHSRJCCMNBC-QFYYESIMSA-N 399.693 4.448 50 1 GIGF N#C/C=C1\CCN(C[C@@H]2CCCCN2C(=O)Cc2ccc(Cl)c(Cl)c2)C1 13449213 WKJMMBKITNREGG-CVDFKLHSSA-N 392.330 4.073 50 1 GIGF C=CC[n+]1c(-c2ccc(OCC)cc2)csc1NNC(=O)Nc1ccccc1 5165399 ZZRIVSNHSYUJLZ-UHFFFAOYSA-O 395.508 4.436 50 3 GIGF aggregator O=C(OCc1cc(Cl)ccc1O)c1cc2cc(CCl)ccc2oc1=O 28703744 CYUGLVMYPGBIKF-UHFFFAOYSA-N 379.195 4.248 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] 103189202 OZFLQFKFMRZOMP-HOTGVXAUSA-N 385.832 4.127 50 1 GIGF O=C(N/N=C/c1cc(O)ccc1O)c1ccc(-c2nc3ccccc3s2)cc1 299868136 QYUHQBLIAPERAR-WSDLNYQXSA-N 389.436 4.138 50 1 GIGF COc1ccc(-c2nn(C[C@@H](Cl)c3ccccc3)c3ncnc(N)c23)cc1 473135970 LZFMMPRNKIQRAF-MRXNPFEDSA-N 379.851 4.064 50 1 GIGF O=C1CC(CBr)(CBr)Oc2c1ccc1c2CCCC1 587500154 QWUFXKIPCWZHCL-UHFFFAOYSA-N 388.099 4.059 50 1 GIGF COc1ccc(Cl)c2c1CCNC21CC(C)(C)N(C(=O)CCl)C(C)(C)C1 963256152 AQGVNQPPXTXDHI-UHFFFAOYSA-N 399.362 4.108 50 1 GIGF C[C@](Cl)(C=CBr)[C@@H](Br)C=C[C@@](C)(Cl)C=O 2356306748 JDUDNUKHKRTULQ-AEJSXWLSSA-N 378.919 4.409 50 1 GIGF C/C(=N\NC(=O)CCn1c(C)nc2ccccc21)c1c(O)ccc2ccccc12 96929691 PGNUIPGCOSZEHO-MFKUBSTISA-N 386.455 4.134 50 1 GIGF BrC/C=C/c1nc2c(Br)ccc(Br)c2[nH]1 586972650 YOSPYASITWJESE-OWOJBTEDSA-N 394.892 4.496 50 1 GIGF COc1ccc(C(/C=C/c2ccc(C)cc2)=N\NC(=O)c2snnc2C)cc1 299838935 OZUZYCMRXPIBJC-VBYNVFIDSA-N 392.484 4.011 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cscn2)N1 587852730 ICQQGSAQFSFEQY-CLAHSXSESA-N 375.694 4.061 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 103196248 XMVQHNUPHYJXOS-HOTGVXAUSA-N 385.832 4.127 50 1 GIGF COc1ccc([C@@H]2[C@H](C)C(=O)C[C@@H](c3ccc(F)cc3)N2C(=O)CCl)cc1 169352128 RXXAPBCIJIFNMW-MPKWNAGQSA-N 389.854 4.293 50 1 GIGF Cn1c(=O)oc2cc([C@@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 587496547 DVIQDKGDAMNQKN-QFIPXVFZSA-N 397.858 4.110 50 1 GIGF COc1ccc2c(c1OC)[C@@](C)(C(C#N)=C1Nc3ccccc3N1)N(C)[C@H](C)C2 962571962 PKROLCKRNMHEEB-QKFKETGDSA-N 390.487 4.068 50 1 GIGF Cc1ccc(/C=C(/C#N)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 587189061 ZOLYMSQRIDNDNQ-JYRVWZFOSA-N 391.374 4.229 50 1 GIGF COc1ccc(C=NNC(=O)c2sc(-c3ccc(Cl)cc3)cc2N)cc1 958021766 IVQMXUWNVQSDML-UHFFFAOYSA-N 385.876 4.423 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)Cc2ccccc2)c1 38145317 CYPLUVFABKJRCT-YVNGDZKUSA-N 387.508 4.488 50 1 GIGF CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@@H]1C)C(=O)[C@H](C)Cl 40430139 ZIGNETWTEBLFNH-HOTGVXAUSA-N 387.911 4.141 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@H]([C@@]13C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C3C=O)O2 587406595 SRYQHKAMGWEENG-MGTIMDFZSA-N 379.500 4.499 50 1 GIGF C[C@@H]1CC[C@H]2C(CN=[N+]=[N-])=C(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103187413 OODIOESRULHYLW-MOJIGAAESA-N 375.347 4.359 50 1 GIGF CCC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H](C=C=CBr)C[C@H]2O1 2356545018 MALGKLBGBZTMPV-FCCLRMGUSA-N 392.131 4.485 50 1 GIGF C=C(C)[C@@H]1c2cc(C(=O)OC)c(o2)C[C@H](C(=C)CCl)CCC2=C[C@H]1OC2=O 2356579836 FUFZHVAAHGBANZ-XVSDVWIESA-N 390.863 4.325 50 1 GIGF CCCCCOc1ccc([C@@H](CCl)NC(=O)c2cc(CC)nn2C)cc1 103173198 FSRGKPPSPDQHPX-GOSISDBHSA-N 377.916 4.261 50 1 GIGF CN(C)CCSSCCNC(=O)c1ccccc1Oc1ccccc1 618008488 HLZMCINCAXGQHT-UHFFFAOYSA-N 376.547 4.152 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)([C@@H](C)Br)[C@@H](C2)C3=O 587427508 IIJVMJFMIGUIAM-RSXSOOJNSA-N 391.236 4.261 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccccc1Cl)[C@@H](C2)C3=O 587412947 FKMUCEXRHSZODA-SCLBCKFNSA-N 393.664 4.386 50 1 GIGF COc1ccc(/C=C/C(=O)c2ccc(NC(=O)[C@@H](C)Br)cc2)cc1 73197329 IDCHLRZKCZCVGB-YQJFHSMKSA-N 388.261 4.313 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cscn2)N1 587852731 ICQQGSAQFSFEQY-RMLUDKJBSA-N 375.694 4.061 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1ccc(C)cc1)CC2=O 587469180 LBLBHTMISSFETQ-MMYRTMNYSA-N 390.483 4.483 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4cccc1c24)C(=O)[C@@H](Br)CC3 587101785 MREAEADTURXOCL-AWEZNQCLSA-N 378.225 4.339 50 1 GIGF Cc1ccc(-c2cc(C(=O)N/N=C\c3cnn(C)c3C)c3ccccc3n2)c(C)c1 15989775 CQJLEERVPSWZLT-MXAYSNPKSA-N 397.482 4.324 50 3 GIGF Cc1ccc(S(=O)(=O)N2CC[C@@H](Br)C[C@@H]2c2ccccc2)cc1 28704310 FURHTLFHWSFENE-SJLPKXTDSA-N 394.334 4.284 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CSC#N)(c1ccc(OC)cc1)CC2=O 587493076 QHJWDBWKEACRBV-OAQYLSRUSA-N 383.469 4.428 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CSc3ccccc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]32OO4 43422845 OCZSYYGYYJECSV-MCJRFYRHSA-N 390.501 4.167 50 1 GIGF CCc1ccc([C@@]2(CBr)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 587411022 AZPUYYJAFIFQBV-OXQOHEQNSA-N 387.273 4.295 50 1 GIGF CC(=O)NC1=C(C#N)[C@H](c2ccccc2)C2=C(C[C@H](c3ccccc3)CC2=O)O1 64549309 LPTXCIPKWKYQCQ-GCJKJVERSA-N 384.435 4.072 50 1 GIGF N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@@H]1c1cccc(Cl)c1 1772639537 JLFJCTAQIBQKJD-GOSISDBHSA-N 399.841 4.237 50 1 GIGF COc1ccc([C@]2([C@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 587375495 SWOSJJJKNUTLAL-HXPMCKFVSA-N 390.277 4.230 50 1 GIGF O=C(Cl)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587542218 GDBZKCCZYAMKKQ-PXNSSMCTSA-N 380.783 4.474 50 1 GIGF COc1cccc2cc3c(nc12)[C@@](CBr)(c1ccccc1)NCC3 963066904 MDNFCVXWSVNCRN-HXUWFJFHSA-N 383.289 4.028 50 1 GIGF COc1ccccc1N1C(=O)CS[C@@H]1c1cccc(CBr)c1 169342672 AAODJDXVXQLFHO-QGZVFWFLSA-N 378.291 4.369 50 1 GIGF CCOc1ccc([C@]2([C@H](C)Cl)NC[C@H]3CC(=O)N(C)c4cccc2c43)cc1 963033867 VLMXLRWJZAOZAB-KIMHZCHSSA-N 384.907 4.010 50 1 GIGF CCC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H](C=C=CBr)C[C@@H]2O1 2356545022 MALGKLBGBZTMPV-MPUDVABHSA-N 392.131 4.485 50 1 GIGF CCOc1ccc(C2=C(C#N)C(=O)N[C@](C)(c3ccc(OCC)cc3)C2)cc1 1772626209 FBPPRGORVMUQSL-QHCPKHFHSA-N 376.456 4.196 50 1 GIGF N#CC1=CC2(c3ccccc3Nc3ccccc32)N(/N=C/c2ccccc2)C1=O 1857653851 ICVVMYVKTKFEAS-WGOQTCKBSA-N 376.419 4.313 50 1 GIGF CN1C(=O)CC[C@@]2(C)[C@@H]1CC[C@@H]1[C@H]3CC[C@@](O)(C#CCCCl)[C@@]3(C)CC[C@H]12 26004145 SUSIRKQQOODCLS-DJAYXGLKSA-N 391.983 4.213 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](Oc3ccc(F)cc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 101663196 QBWAUDCKUYPUNV-DLJUDYGDSA-N 378.440 4.413 50 1 GIGF CC(=O)O[C@H]1C[C@@H](Br)C(C)(C)[C@H](Cl)/C1=C\CBr 85951749 BURJCSPPDZTXBA-ASUSNTEUSA-N 388.527 4.040 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)[C@@H](C)Cl)c1C)[C@@H](C2)C3=O 587417693 ONBQUIWCUSTKTO-JTWCOAEXSA-N 387.863 4.113 50 1 GIGF Cc1ccc2c(c1)[C@@]1(N[C@@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 587740872 LELJGNXYJOYUAR-FKIZINRSSA-N 399.263 4.474 50 1 GIGF Cc1ccc2c(c1)[C@@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C(C#N)=CO2 587572534 PSQFVWDDAAFZJG-QPPBQGQZSA-N 397.386 4.358 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(F)cc1CBr)[C@@H](C2)C3=O 587430023 YPIDJNJARIQNKV-KBXCAEBGSA-N 377.209 4.218 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cccc(Cl)c1)O2 587372622 JYBLCYHUGQLJJK-QGZVFWFLSA-N 380.669 4.486 50 1 GIGF N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2cccs2)[C@@H]2CCCC=C12 169350442 OYLMAHKZDOCGAD-AUUYWEPGSA-N 386.476 4.374 50 1 GIGF C[C@@H]1CC[C@@H]2[C@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@H]1[C@]32OO4 253647236 SBCGDCBRWXAAIF-FWDIBVBWSA-N 386.488 4.398 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCC[C@H]2Br 587547122 ZGSLKKVFLVKROA-RVKKMQEKSA-N 375.218 4.040 50 1 GIGF COc1ccc2[nH]c(C(=O)N3C[C@@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 5923378 ZHGAQKHGMIEBNJ-GFCCVEGCSA-N 385.807 4.068 50 1 GIGF C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]2(O)[C@@H](Cl)CC[C@H](C)[C@@]12C 238785976 LIIUXOSINVLFRM-IFVLMOTPSA-N 380.868 4.110 50 1 GIGF CCOC(=O)C[C@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 587498402 GXTKFMDNFNUFKT-BUXKBTBVSA-N 395.293 4.006 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(O)cc2)N1 587682982 FFPGKMUGZSLIGA-BTDLBPIBSA-N 384.676 4.310 50 1 GIGF CC[C@@H](Br)[C@@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 587376707 XZFBJUPWHAXEMT-CRAIPNDOSA-N 375.266 4.006 50 1 GIGF CC(=O)Nc1cc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)ccc1O 587498791 ONCFPMQYANOXHU-QFIPXVFZSA-N 399.874 4.329 50 1 GIGF ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl 100899327 ZXFXBSWRVIQKOD-IGHIXMKGSA-N 389.320 4.453 50 1 GIGF in-vitro CCOC(=O)C1=C(O)C[C@@H](c2ccccc2)N(C(=O)CCl)[C@H]1c1ccccc1 100078276 OLZUOULUTZTBDG-UWJYYQICSA-N 399.874 4.315 50 1 GIGF O=C(Nc1ccccc1)[C@H](Cl)[C@]1(c2ccccc2)NCCc2ccc(O)cc21 963328394 FOOHQYKCZJLOQH-JTHBVZDNSA-N 392.886 4.028 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccc(O)cc2)[C@]2(C)[C@H](C=O)C(C=O)=CC[C@@H]12 2356491750 OOBNDBQPMFZTTD-MDAIXWLXSA-N 396.483 4.104 50 1 GIGF CC(=O)O[C@@H]1CC/C(=C\C=O)CO[C@@]1(C)CCC[C@@H](C)C(=O)CC=C(C)C 27890134 HVKGLFXDAZKVNN-GYOGCVQMSA-N 378.509 4.344 50 1 GIGF CCCC(=O)OCc1cc2c(c(COC(C)=O)c1CCCl)CC(C)(C)C2 144581743 JIWBAUQSVZNFSA-UHFFFAOYSA-N 380.912 4.499 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)cc1F)[C@@H](C2)C3=O 587425684 GGFXWVBNHYZIOA-SCLBCKFNSA-N 395.199 4.011 50 1 GIGF O=C(NCCCCl)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 139482681 HKVFZZGTQCMXPU-UHFFFAOYSA-N 382.851 4.371 50 1 GIGF COc1ccc(/C=N\NC(=O)C2=C(Cl)c3ccccc3CCC2)c(OC)c1 299820819 DTWZLPBIJVYOLD-QRVIBDJDSA-N 384.863 4.140 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1[nH]c(C)c(C(C)=O)c1C)([C@@H](C)Cl)[C@@H](C2)C3=O 587417685 OJEPAGDGLXMDEA-RKFVTTHHSA-N 387.863 4.113 50 1 GIGF C[C@@H]1CC[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 195252375 WDTIPJZJXSSSGU-LBRXCKCOSA-N 391.895 4.288 50 1 GIGF COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@H](O)[C@]2(C)[C@H]1C=O 238765880 KSXULPOQIKTIMP-JPRZGNOKSA-N 382.928 4.052 50 1 GIGF C=C1[C@@H](C)C[C@H]2O[C@@]2(C)[C@]12C[C@H](Br)[C@@](C)(Cl)C[C@H]2OC(C)=O 238775417 AUTRJIGXTTVLQH-WJKKNQFQSA-N 391.733 4.213 50 1 GIGF COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)cc2nc(CCl)oc12 587907951 XUTSOOUFOYEGNQ-UHFFFAOYSA-N 390.222 4.415 50 1 GIGF CC(=O)O[C@@H]1C[C@]2(O)C[C@@]3(C)CC[C@@]2(C[C@@H]3Cl)C(C)(C)[C@H]1Br 2356588702 DIJRDZRTBRINGF-KDYIVRDHSA-N 393.749 4.030 50 1 GIGF Cc1ccsc1/C=N/NC(=O)CCCCCCC(=O)Nc1ccccc1O 95808882 NCIRTJAKZRZMOH-KGENOOAVSA-N 387.505 4.192 50 1 GIGF Cc1cccc([C@]2([C@@H](C)Br)NCCc3c2c(C(C)C)nn3C)c1 962916093 IUCOPCHQLMXDRX-KUHUBIRLSA-N 376.342 4.025 50 1 GIGF N#CC1=C(N)Oc2c(ccc3ccccc23)[C@H]1c1cccc(C#CCCCO)c1 73195813 GGUAVXRXGABCFU-HSZRJFAPSA-N 380.447 4.182 50 1 GIGF CC[C@@]1(CBr)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587322865 PJRVYGSNAUMQAV-AEFFLSMTSA-N 379.225 4.434 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1cccc(CBr)c1F)[C@@H](C2)C3=O 587426460 OAJGUIDYFHLHDV-UGSOOPFHSA-N 377.209 4.218 50 1 GIGF CC[C@@]1(CCCCl)c2scnc2C[C@@H](C(=O)O)N1C(=O)OC(C)(C)C 963143131 KWICASSLUGSBDM-YVEFUNNKSA-N 388.917 4.014 50 1 GIGF O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)Oc1ccc([N+](=O)[O-])cc1 43409150 JLZZJRDRDVGIDJ-FQEVSTJZSA-N 390.395 4.062 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2c(Cl)c(Br)cnc2[nH]1 586971825 YIHLMMRJYQBLCF-QMMMGPOBSA-N 397.498 4.235 50 1 GIGF CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 36378446 CWCXONZIEDNVKI-ZGUVULONSA-N 399.325 4.010 50 3 GIGF in-vitro COc1cccc(Cc2cc3c(OC)cc(CBr)cc3oc2=O)c1 95578637 WENLBRLGGKESMP-UHFFFAOYSA-N 389.245 4.296 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1c(F)cccc1C(=O)Cl 587893564 XTLLYAWDPKUGME-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF CCOC(=O)c1c(O[C@H]2CCCC[C@@H]2Cl)cc(Cc2ccccc2)[nH]c1=O 95591840 BJKWBSFFJGSPLK-IRXDYDNUSA-N 389.879 4.071 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2cccc(C#N)c2)c1 1549349 PNGKHTXBXPGJKZ-UPPUFSLMSA-N 398.491 4.165 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@H](OC(=O)/C=C/c2ccccc2)C1 238734527 FRHWTFAYHKXVPQ-JYIDUVCFSA-N 378.468 4.318 50 1 GIGF C=C(C)[C@H](CCC(C)=CCOc1c(OC)cc(C=CCO)cc1OC)OO 2356648696 NEONTBMZDXWQFB-SFHVURJKSA-N 378.465 4.249 50 1 GIGF N#C/C=C/c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1F 587894141 BFKDGXUNJOVURL-DAFODLJHSA-N 387.241 4.380 50 1 GIGF O=C(N/N=C/c1ccc(CO)c2ccccc12)c1ccc(O)c(Cl)c1Cl 13492687 MVPLCQFKSRFCEV-LSFURLLWSA-N 389.238 4.108 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(Br)cc1)O2 587371803 MVIVRCNHUAGILU-QGZVFWFLSA-N 380.669 4.439 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1nnc(-c3ccccc3)o1)CC2=O 587458406 AZYJLPSBSHSTNB-NRFANRHFSA-N 398.846 4.494 50 1 GIGF CCOc1ccc2c(c1)[C@@]1(C(C=O)=CO2)c2cc(OC)ccc2CCN1C(C)C 962092273 PWWRSTXWSORPIB-XMMPIXPASA-N 393.483 4.079 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)c(C)c1)[C@@H](C2)C3=O 587415760 WVULMXFDOXIKQD-JXFKEZNVSA-N 387.273 4.350 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc(N=C=O)cc1)[C@@H](C2)C3=O 587430169 SBYPONHXWJDXQJ-GBXCKJPGSA-N 383.403 4.354 50 1 GIGF NC(=O)c1cc(Cc2ccc3ccccc3c2)cc(C(=O)CBr)c1 29055646 WPZAIXLSXZDEGY-UHFFFAOYSA-N 382.257 4.107 50 1 GIGF O=C(O)CCC/C=C/C[C@H]1[C@@H](Cl)C[C@@H](O)[C@H]1/C=C/[C@@H](O)C1CCCCC1 33985170 ZOQXTNLUBHPZOZ-QQEQXLPYSA-N 384.944 4.289 50 1 GIGF Cc1ccc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2c1C 587009445 GDIHXTYCGUUOHH-SFHVURJKSA-N 380.879 4.300 50 1 GIGF COc1cc2c3c(c1)O[C@](c1cccc(C)c1)([C@@H](C)Br)[C@@H](C2)C3=O 587412330 AKVMMTPDDKKPQB-QROBEVECSA-N 387.273 4.430 50 1 GIGF CC[C@H](O[Si](C)(C)C(C)(C)C)[C@](C)(O)[C@H](O)[C@H](C)COC(=O)C(C)(C)C 2356699297 MIABMGRTXDZCFD-ASKKUZCQSA-N 390.637 4.124 50 1 GIGF N#CC1=C(N)OC(c2ccccn2)=C([S@@](=O)c2ccccc2)[C@H]1c1ccccc1 1857641749 YLORRRPESSBODW-WRONEBCDSA-N 399.475 4.066 50 1 GIGF COc1cc([C@@H]2C(C#N)=C(C)N=C3CC(C)(C)CC(O)=C32)ccc1OCCO 2922932 XLUAYHIXAYOXEF-HXUWFJFHSA-N 382.460 4.034 50 1 GIGF O=C(Oc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc3ccccc3c2)CC1 49757533 PPRQYPUZIMEEKB-UHFFFAOYSA-N 391.427 4.065 50 1 GIGF CC1(C)Oc2nc3ccc(Br)cc3c(O)c2C[C@H]1Br 28253991 YGIIMRSDLDGREM-LLVKDONJSA-N 387.071 4.180 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 586970274 CSNJNHGNWWRQBH-LLVKDONJSA-N 387.075 4.058 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1c(F)cccc1F)O2 587381300 GPOXFFPFJHJOGT-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF Cc1ccc(N(C(=O)CCl)S(=O)(=O)c2cc(Cl)sc2Cl)cc1 95556547 HCRIQRFZXVVZBG-UHFFFAOYSA-N 398.720 4.324 50 1 GIGF CC1=NN(c2ccccc2)[C@]2(C1)[C@@H](Cl)C(=O)N2c1nc2ccccc2s1 5964603 BARPPGCSDZGDGV-QFBILLFUSA-N 382.876 4.233 50 1 GIGF C=C(CCl)[C@@H]1CCC2=C[C@@H](OC2=O)[C@@H](C(=C)C)c2cc(C(=O)OC)c(o2)C1 140022770 FUFZHVAAHGBANZ-OMWUSAIZSA-N 390.863 4.325 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1ccccc1NC(=O)CCCCl)[C@@H](C2)C3=O 587423110 SBRNZJYPBNOKBF-AOMKIAJQSA-N 399.874 4.316 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc4c(c1)CCC4)[C@@H](C2)C3=O 587410990 AQNIMHNMVACXPS-UWJYYQICSA-N 399.284 4.222 50 1 GIGF O=C(N/N=C/c1ccc(O)c2ccccc12)c1cc(Cl)c(O)c(Cl)c1 13864069 PAGAOVYMFMKTGG-ZVBGSRNCSA-N 375.211 4.322 50 1 GIGF Cc1ccc2c(c1)[C@]1(N[C@@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 587744411 ZTAARCZUDVSLBY-FKIZINRSSA-N 399.263 4.474 50 1 GIGF COC(=O)C=C(C)CC[C@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@]2(C)C(C)=C(C=O)C[C@@H]21 2356680716 RYBWQXGDQMJOIS-NPNODJHLSA-N 390.520 4.405 50 1 GIGF C/C(=N/NC(=O)c1ccc(C)s1)c1cccc(NC(=O)c2ccoc2C)c1 15895297 BHSFDRQPBZJNFT-XKZIYDEJSA-N 381.457 4.364 50 3 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 586974513 XEGSLGKWPFDLAV-LLVKDONJSA-N 384.277 4.494 50 1 GIGF COC[C@H](C)n1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587370734 BKIGSNFEYPUVEY-LHSJRXKWSA-N 390.911 4.302 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O 587427911 JRXPIEBYXHRSEA-KSSFIOAISA-N 395.199 4.011 50 1 GIGF CCOc1ccc2c(c1)[C@]1(C(C=O)=CO2)c2cc(OC)ccc2CCN1C(C)C 962092269 PWWRSTXWSORPIB-DEOSSOPVSA-N 393.483 4.079 50 1 GIGF Cc1cc2c(cc1O)[C@](C)(CCCO[Si](C)(C)C(C)(C)C)N[C@H](C(=O)O)C2 963509508 NUUBRFBMBHNTQH-UWJYYQICSA-N 393.600 4.317 50 1 GIGF CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)C=C1[C@@H](Br)CCl 136387780 QXFISWVHGXXPPG-AXFHLTTASA-N 388.527 4.040 50 1 GIGF CC[C@@H]1C[C@@H]1[C@@H]1OC(=O)CCCC=CCC=C[C@@H]2[C@H](O)[C@@H](Br)C[C@@H]21 2356793910 KULVVWPMIUGXPG-QVSCJOEQSA-N 397.353 4.391 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(OC)ccc1OC)CC2=O 587460554 UAGJKFQSLUKSQV-OAQYLSRUSA-N 390.863 4.461 50 1 GIGF CCOC(=O)[C@H](c1nc(C)cs1)[C@@]1(CCl)NCCc2c1sc(C)c2C 963019400 HBVGEBVOAJMOCO-KBXCAEBGSA-N 398.981 4.057 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@@H]1c1cccc(F)c1 1857585359 NVTMZYAWMZVFPI-GOSISDBHSA-N 383.382 4.451 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@H](OC(=O)/C=C\c2ccccc2)C1 238743381 FRHWTFAYHKXVPQ-FPJNVSHZSA-N 378.468 4.318 50 1 GIGF CC(=O)[C@@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C[C@](O)(CCl)[C@]12C 2356384224 LSUMZADQUYYJTQ-MZLYOWLHSA-N 378.940 4.303 50 1 GIGF NC(=O)Nc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587498948 REWLPTAXFREZSR-NRFANRHFSA-N 384.863 4.156 50 1 GIGF COCCCN1CCc2ccc(OC)cc2[C@@]1(C(C)C)[C@H](C)Br 961321640 KCXGARHINWPQFR-HNAYVOBHSA-N 384.358 4.225 50 1 GIGF CCOC(=O)[C@@H](c1nc(C)cs1)[C@]1(CCl)NCCc2c1sc(C)c2C 963019405 HBVGEBVOAJMOCO-KDOFPFPSSA-N 398.981 4.057 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1F)([C@H](C)Br)O2 587384896 KNYCDLPDSKBVPP-XTZNXHDOSA-N 396.231 4.500 50 1 GIGF C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)Nc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 95585891 MYWFTURLVFVPKG-HDOZFUISSA-N 396.407 4.055 50 1 GIGF COC(=O)[C@H](Br)c1cccc(C#Cc2cc(Cl)ccc2OC)c1 587898866 SURLMMRMOZFHTI-QGZVFWFLSA-N 393.664 4.357 50 1 GIGF O=CC1=COc2cc(F)ccc2[C@@]12c1ccsc1CCN2Cc1ccco1 962714123 URDBQXXDUOKFOZ-OAQYLSRUSA-N 381.428 4.257 50 1 GIGF C=C(CCl)[C@H]1CCC2=C[C@@H](OC2=O)[C@@H](C(=C)C)c2cc(C(=O)OC)c(o2)C1 2356579833 FUFZHVAAHGBANZ-BOFPYLFWSA-N 390.863 4.325 50 1 GIGF COc1ccccc1/C=N\NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 33343735 KULXDKAZKBPOBX-XKZIYDEJSA-N 390.468 4.168 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@H]([C@@]13C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C3C=O)O2 587406598 SRYQHKAMGWEENG-ZODKVXNGSA-N 379.500 4.499 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@@H](C#N)c1nc3ccccc3s1)O2 587415757 WVRXFPYDACGLFD-RNODOKPDSA-N 397.887 4.437 50 1 GIGF C=C1[C@@H](C)C[C@@H](OC(=O)/C=C/c2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 38238656 RIGSJIIZCIKSKY-PKCWWXAYSA-N 378.468 4.174 50 1 GIGF O=C(CCl)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2cccc(Cl)c2[nH]1 587009784 SLBCVMMDNOMXEP-INIZCTEOSA-N 387.270 4.336 50 1 GIGF CCCNNC(=O)c1ccc(CN(Cc2ccccc2)C(=O)OC(C)(C)C)cc1 1857602842 MVBJZEXEUAHMFY-UHFFFAOYSA-N 397.519 4.268 50 1 GIGF C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 195297125 MUCWOBDSQXBTNM-KIBIGZOQSA-N 394.584 4.493 50 1 GIGF Cc1ccc(C(=O)Nc2ccc(C(=O)NN/C=C3\C=Nc4ccccc43)cc2)cc1 15974313 HHNIRIPUXCHKDO-XDJHFCHBSA-N 396.450 4.239 50 3 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@@H](NC(=O)OC(C)(C)C)C(C)C)O2 587374344 XBVGHCDHRGNZNG-FXAWDEMLSA-N 396.915 4.069 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1csc(C(=O)Cl)c1 587897910 ZPCRTBIEUCPBRN-UHFFFAOYSA-N 386.687 4.144 50 1 GIGF O=C(N/N=C/c1ccc(F)cc1)c1ccc(-c2cc(=O)c3ccccc3o2)cc1 653764455 NDKSIAMONHAENV-AFUMVMLFSA-N 386.382 4.363 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(-c3ccc(F)cc3)c(CBr)c2c1 587648745 ALJHUPQQVIGLNY-UHFFFAOYSA-N 382.254 4.272 50 1 GIGF CCCCCCNC(=O)/C(C#N)=C/c1c(C)n(CCN(C)C)c2ccccc12 40972666 XPEXCLGCAXUOGG-KNTRCKAVSA-N 380.536 4.115 50 1 GIGF C[C@]1(CC(=O)NCc2cccc(Br)c2)CC2(CCCCC2)OO1 49694683 GCBIADPPDPBDLJ-KRWDZBQOSA-N 382.298 4.269 50 1 GIGF O=C(NNC(=S)NCc1ccc(-c2ccccc2)cc1)c1ccc(Cl)cc1 96285257 AFVPDILULRQOIN-UHFFFAOYSA-N 395.915 4.316 50 1 GIGF ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@]1(Cl)C2(Cl)Cl 113904628 ZXFXBSWRVIQKOD-RLKGUHOTSA-N 389.320 4.453 50 1 GIGF CCN1CCC2=C(C#N)C(=N)C(C#N)(C#N)[C@@H](c3cc(Cl)ccc3Cl)[C@@H]2C1 169688635 NJLUYILXKMUVGS-AEFFLSMTSA-N 398.297 4.306 50 1 GIGF CC(=O)O[C@@H]1C[C@@H](Br)C(C)(C)[C@H](Cl)C1=CCBr 2356729695 BURJCSPPDZTXBA-GMTAPVOTSA-N 388.527 4.040 50 1 GIGF C[C@@H](COC[C@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C 238764399 YTNMLZVAADXGMA-LSDHHAIUSA-N 394.733 4.089 50 1 GIGF O=C1c2ccc(O)cc2OC2(CC(CBr)C2)[C@H]1c1ccc(F)cc1 587319889 DILQSHRSEKVBFH-WILKRBQNSA-N 391.236 4.434 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(CN=C=S)cc1 587897020 STHHJHLGBCTZQC-UHFFFAOYSA-N 389.307 4.307 50 1 GIGF CC1(C)CC(NC(=O)[C@]23CC[C@@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 169304438 VEOCQHPHVDVKDX-VMDGZTHMSA-N 385.390 4.002 50 1 GIGF COc1cc2c3c(c1)O[C@@]1([C@@H](Br)[C@H]4CC[C@]1(C)C4(C)C)[C@@H](C2)C3=O 587411686 GADGSAZQNCDXGZ-ICLIJLJDSA-N 391.305 4.401 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCC[C@@H]2Br 587547120 ZGSLKKVFLVKROA-RLFYNMQTSA-N 375.218 4.040 50 1 GIGF Br[C@@H]1C=C[C@]2(C1)c1ccccc1C[C@H]1CN(c3ccccc3)CCN12 962626697 CFRUFDDERVFBIU-CBQOVEMMSA-N 395.344 4.352 50 1 GIGF Nc1ccc2[nH]c(C(=O)N3C[C@H](CCl)c4c3cc(N)c3ccccc43)cc2c1 5581978 PBDNTIFKUNPLTI-ZDUSSCGKSA-N 390.874 4.468 50 1 GIGF O=c1c(-c2ccc(O)cc2)coc2cc(OCCCBr)cc(O)c12 40955296 AJGLTUKQQZKQIE-UHFFFAOYSA-N 391.217 4.035 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CBr)(C2CC2)N1 587673525 NSZKOEBVPRYEQU-CLAHSXSESA-N 377.095 4.123 50 1 GIGF Cc1c(C(=O)N/N=C\c2cc(Cl)cc(Cl)c2O)oc2cccc(O)c12 1911583512 IXDLGSOYWMBVPK-SCDVKCJHSA-N 379.199 4.223 50 1 GIGF C=C1C(=O)O[C@@H]2C=C(C)CC=C[C@](C)(OO)CCC=C(C)[C@@H](OC(C)=O)C[C@H]12 2356799329 UIRWAUSAMAORJV-DYQZNNLLSA-N 390.476 4.287 50 1 GIGF CCOC(=O)/C(C#N)=C\Nc1ccc2ncnc(Nc3ccccc3Cl)c2c1 95605229 FUVTWICVSUGUFV-QBFSEMIESA-N 393.834 4.409 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(C(=O)O)cs1)CC2=O 587494718 NLHRDLUFTKHTTD-SFHVURJKSA-N 380.849 4.204 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N=C=O)cc2)N1 587741698 OQMNJPYUFJCVDE-ADLMAVQZSA-N 375.241 4.353 50 1 GIGF CC1(C)C[C@H]2[C@H](C=C(C=O)[C@]3([C@H]4N[C@H](C(=O)O)Cc5cc(F)ccc54)C[C@]23C)C1 962909416 MEVPYUDTHVGQTC-URLHMFPHSA-N 397.490 4.053 50 1 GIGF Cn1oc2cc3c(c4cccc(c1=O)c24)[C@@H](CCl)CN3C(=O)OC(C)(C)C 95601195 PJFGCGIILHLKJD-NSHDSACASA-N 388.851 4.362 50 1 GIGF CC(C)[C@H](Br)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587537264 CEKNCSKZUKVDLQ-VKJFTORMSA-N 377.234 4.142 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@H]1c1cccc(F)c1 1857585360 NVTMZYAWMZVFPI-SFHVURJKSA-N 383.382 4.451 50 1 GIGF C[C@@H](COC[C@@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C 2356519376 YTNMLZVAADXGMA-GJZGRUSLSA-N 394.733 4.089 50 1 GIGF CC(C)[C@]1(CBr)N[C@H](C)Cc2ccc(F)c(Br)c21 587671760 ANMYOZRURBUUBM-OTYXRUKQSA-N 379.111 4.369 50 1 GIGF COc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3SC)s2)cc1 1857654571 SHZIHXXBZSIGJX-UHFFFAOYSA-N 398.509 4.220 50 1 GIGF COc1cc(C=C(C#N)C#N)c(-c2ccccc2C=C(C#N)C#N)c(OC)c1OC 103228584 DXLBUGKPJRBCCZ-UHFFFAOYSA-N 396.406 4.241 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 587086897 IHCDIDQCABGBLV-SNVBAGLBSA-N 375.039 4.381 50 1 GIGF C=CCC[C@@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539302 VGLKGXCSVHWPKG-LPHOPBHVSA-N 389.245 4.454 50 1 GIGF CN(C)CCSSCCNC(=O)Cc1cccc(Oc2ccccc2)c1 618009121 SNPQNVMQRASPNM-UHFFFAOYSA-N 390.574 4.081 50 1 GIGF CC(=CCl)[C@@H]1CC(Cl)=C(C)[C@@](O)(C(Br)Br)O1 2356457843 CVIPXLIMSIYMFK-WPRPVWTQSA-N 394.918 4.235 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@H](Cl)N=O)[C@@H](C2)C3=O 587417052 IRVBKNPRCUTLRB-VHSSKADRSA-N 378.211 4.323 50 1 GIGF COC(=O)c1cccc(C#Cc2cc(Cl)ccc2OC)c1CBr 587898056 DWLGRGMGVJTXQE-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF CC(/C=N/Nc1ccc([N+](=O)[O-])cc1)=N\NC(=O)c1ccc(C(C)(C)C)cc1 1857642356 ZANDQTKXUFIFDG-JFMUQQRKSA-N 381.436 4.096 50 1 GIGF C[C@@]1(CC(=O)NCc2ccccc2N2CCCCC2)CC2(CCCCC2)OO1 49722711 ANYUTTCGGOBCGY-JOCHJYFZSA-N 386.536 4.497 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587087933 ZCWBCWGKHWMCAO-SECBINFHSA-N 395.026 4.418 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1sccc1Br)[C@@H](C2)C3=O 587452755 PCLAYEVDMMNLGP-MGPLVRAMSA-N 399.693 4.401 50 1 GIGF O=C1C[C@](CCl)(c2ccc3nc(O)[nH]c3c2)Oc2c1ccc1c2CCCC1 587498841 PUDPXTCFCPQAAO-NRFANRHFSA-N 382.847 4.247 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(C(Cl)Cl)N1 587689448 SMVLAUJDDRMUPI-QTTZVWFDSA-N 375.496 4.360 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cscn2)N1 587853050 KNKXQKJMTOCZHA-XLKFXECMSA-N 375.694 4.061 50 1 GIGF Cc1cccc(C(=O)N/N=C/C2=C3C(=O)O[C@@H](c4ccoc4)[C@]3(C)CCC2)c1 103288606 BHHBJRWCBRAOTN-VFJYRVFXSA-N 378.428 4.089 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc4c(c1)CCC4)[C@@H](C2)C3=O 587410978 AQNIMHNMVACXPS-LAUBAEHRSA-N 399.284 4.222 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O 587421896 BAKWGEZTYWZHBF-IFXJQAMLSA-N 391.236 4.181 50 1 GIGF N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@@H]1c1ccc(Cl)cc1 1772625977 IPPKJVIVSBVTQP-GOSISDBHSA-N 399.841 4.237 50 1 GIGF COc1cc([C@H]2C(C#N)=C(C)N=C3CC(C)(C)CC(O)=C32)ccc1OCCO 19760556 XLUAYHIXAYOXEF-FQEVSTJZSA-N 382.460 4.034 50 1 GIGF C[C@@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Oc2ccccc2)c1 84604011 HDHKONAQITXRKY-QGZVFWFLSA-N 395.503 4.493 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)([C@@H](C#N)c1nc(C)cs1)CC2=O 587493450 HOLJPPTTZDSIFD-LIRRHRJNSA-N 390.892 4.360 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43397051 WDTIPJZJXSSSGU-ULZVXDMSSA-N 391.895 4.288 50 1 GIGF O=C(N/N=c1/c(=O)c2c3ccccc3cc3cccc1c32)c1cccc(Cl)c1 102949964 NEVGITATZIDBSE-NJNXFGOHSA-N 384.822 4.281 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(Br)c(F)c(F)c2[nH]1 586970974 JKSCFZQUHRGOQW-JTQLQIEISA-N 398.045 4.465 50 1 GIGF O=C1C[C@](CBr)(c2nccs2)Oc2c1ccc1c2CCCC1 587536063 QREGXDYIKCMYHV-KRWDZBQOSA-N 378.291 4.278 50 1 GIGF C[C@@]1(C=CBr)O[C@H]([C@@](C)(Br)CCl)C[C@@H]1Cl 2356477519 YTOJCYQLVTZXDI-XKNYDFJKSA-N 380.935 4.442 50 1 GIGF COc1ccc(O[C@@H]2O[C@@H]3O[C@@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 43426974 FEPLYIUDBNDUQK-ZMJFZODZSA-N 390.476 4.282 50 1 GIGF C[C@H](C(=O)NNC(=S)NC1CCCCC1)c1ccc(-c2ccccc2)c(F)c1 103198675 NQFQFQNLSOQZFN-HNNXBMFYSA-N 399.535 4.424 50 1 GIGF N#C/C=C1\CCN(C[C@H]2CCCCN2C(=O)Cc2ccc(Cl)c(Cl)c2)C1 53057370 WKJMMBKITNREGG-GFGNLIMNSA-N 392.330 4.073 50 1 GIGF CCc1ccc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2c1 587009490 IFDZCKRBBCTGFV-IBGZPJMESA-N 380.879 4.245 50 1 GIGF C[C@H](C(=O)NNC(=O)NC1CCCCC1)c1cccc(Cc2ccccc2)c1 84597028 HMSZAPFLFNLPEK-KRWDZBQOSA-N 379.504 4.044 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(O)cc2)N1 587682986 FFPGKMUGZSLIGA-QGHHPUGFSA-N 384.676 4.310 50 1 GIGF COc1ccc(OC)c2c1C[C@H](C)N[C@]2(C)c1cc(F)cc(CCl)c1O 963641793 XTKVEOBKZZVZGM-PRWKNARSSA-N 379.859 4.085 50 1 GIGF Cc1ccc([C@H]2[C@@H]3CCC=C3C(C#N)=C(N)C23C(=O)c2ccccc2C3=O)cc1 169348504 DIEVRMNUPOJDCJ-UTKZUKDTSA-N 380.447 4.231 50 1 GIGF Cc1cccc(/C=N/NC(=O)c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c1 473169250 MSCGWKHJTNOYLG-ZVHZXABRSA-N 398.422 4.182 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C\N(C)C)(c1ccc(F)cc1)CC2=O 587465086 AGDHDFUVZXIWGE-DHPXZPKMSA-N 394.446 4.314 50 1 GIGF CC[C@@]1(CCCCl)c2scnc2C[C@H](C(=O)O)N1C(=O)OC(C)(C)C 963143128 KWICASSLUGSBDM-SJKOYZFVSA-N 388.917 4.014 50 1 GIGF COc1ccc(C(=O)NNC(=S)Nc2csc(-c3ccc(C)cc3)c2)cc1 169350775 HWTGXCIZGIOXTL-UHFFFAOYSA-N 397.525 4.364 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(O)cc2)N1 587682984 FFPGKMUGZSLIGA-DYZYQPBXSA-N 384.676 4.310 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(C(=O)CBr)cc1F 587916683 SDZILWBOKGIHTN-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF CC1=NN(c2ccccc2)[C@@]2(C1)[C@H](Cl)C(=O)N2c1nc2ccccc2s1 5964597 BARPPGCSDZGDGV-APWZRJJASA-N 382.876 4.233 50 1 GIGF Cc1cccc2nc(-c3ccc(C(=O)N/N=C/c4ccc([N+](=O)[O-])cc4)cc3)[nH]c12 299828166 LPFIDPBYTUXXPZ-YDZHTSKRSA-N 399.410 4.210 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 587687835 IPPPISCJUHSUCY-ZKANADHPSA-N 387.680 4.210 50 1 GIGF CC(C)c1ccc(C(=O)CCCC(=O)NCCSSCCN(C)C)cc1 618007567 AJRQRILLEOHUIO-UHFFFAOYSA-N 396.622 4.222 50 1 GIGF O=C(O)CCC/C=C/C[C@H]1[C@@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 33985172 ZOQXTNLUBHPZOZ-ZUOBXKOISA-N 384.944 4.289 50 1 GIGF Cc1ccc(C)c(SCC(=O)OC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)c1 101489013 XBEGFOHXDVZSGV-SDXDJHTJSA-N 393.468 4.308 50 1 GIGF Cc1cc2nc(-c3ccc(C(=O)N/N=C/c4cccc(O)c4)cc3)[nH]c2cc1C 1857570191 MXMKOFXIKAHMSD-ZMOGYAJESA-N 384.439 4.316 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@H](Br)C3 586986225 POUJZEMDGREAIU-JTQLQIEISA-N 380.241 4.404 50 1 GIGF CCOc1ccccc1[C@@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587374151 OHUWWPFUHWOCCG-IBGZPJMESA-N 390.277 4.232 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1c(F)cccc1F)[C@@H](C2)C3=O 587424998 ZUEWCZWEWBKOKW-VOJFVSQTSA-N 395.199 4.011 50 1 GIGF CC(C)[C@@H]1C[C@H]2[C@H](O)C[C@@]13CC[C@]1(C)[C@H](Br)CC[C@](C)(O)[C@@H]1[C@@H]23 2356671203 QYWKYBMMQNPDJT-JZSTXODBSA-N 385.386 4.370 50 1 GIGF C[C@@H](Cl)C(=O)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587495838 ALKGMFXWOKISHM-CMJOXMDJSA-N 397.902 4.170 50 1 GIGF CC(C)(Br)[C@H](Cl)C[C@H](Br)[C@](C)(Cl)[C@@H]1CO1 85951845 HGUFNQRFLLYYNW-ODHVRURNSA-N 382.951 4.317 50 1 GIGF Cc1ccc2c3c(c4c(nc13)[C@H](Br)C(=O)C4)-c1ccccc1C2=O 586992615 FDCNXMKYFVXERE-QGZVFWFLSA-N 378.225 4.316 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(C(=O)Cl)ccc1F 587894364 GOEHKFDZFUQXLH-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF COc1ccc(/C=C/C(=O)c2ccc(NC(=O)[C@H](C)Br)cc2)cc1 73197328 IDCHLRZKCZCVGB-YFTXEMMHSA-N 388.261 4.313 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)([C@H](C)NC(=O)OC(C)(C)C)CC2=O 587458613 CNADUWJOBTTXCO-YUNKPMOVSA-N 397.899 4.201 50 1 GIGF O=C(c1c(CO)oc2cc(Br)cnc12)[C@H](Cl)c1ccccc1 587275778 FRVXWAPXFNMHHM-CQSZACIVSA-N 380.625 4.245 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1cc(F)ccc1F)([C@H](C)Br)O2 587380987 DQGJCBZSGHTMBT-XTZNXHDOSA-N 396.231 4.500 50 1 GIGF CC(C)[C@@H]1[C@H](O)[C@H]2C[C@@H]3[C@H]4[C@](C)(CC[C@@]13C2)[C@H](Br)CC[C@@]4(C)O 2356469459 OLJYONZMSNKXBK-VOZPVISRSA-N 385.386 4.370 50 1 GIGF CCOC(=O)C[C@@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 587498404 GXTKFMDNFNUFKT-HXPMCKFVSA-N 395.293 4.006 50 1 GIGF O=C1C[C@@](CCl)(c2ccc3nc(O)[nH]c3c2)Oc2c1ccc1c2CCCC1 587498842 PUDPXTCFCPQAAO-OAQYLSRUSA-N 382.847 4.247 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@H]2Br 587547124 ZGSLKKVFLVKROA-VKJFTORMSA-N 375.218 4.040 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CBr)(C2CC2)[C@@H]1c1ccc(F)cc1 587324399 YPSQUTBAJQZABS-MJGOQNOKSA-N 391.236 4.434 50 1 GIGF CN(C)CCSSCCNC(=O)C(C)(C)Oc1ccc2ccccc2c1 618009542 ZLXGFQWGBMLKMR-UHFFFAOYSA-N 392.590 4.056 50 1 GIGF CCc1ccc(CC)c([C@]2(CCl)N[C@H](C(=O)O)Cc3cccc(F)c32)c1 962903219 WLYJCAYZJJKUJO-RXVVDRJESA-N 375.871 4.032 50 1 GIGF O=C(N/N=C/c1ccc(O)c(O)c1)c1ccc(-c2nc3ccccc3s2)cc1 299870099 VVPSHUOWLVJLFW-WSDLNYQXSA-N 389.436 4.138 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](C)[C@@H](O[C@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 103036654 AKXUGEWGUZMDGE-ZGBFIIHUSA-N 399.487 4.476 50 1 GIGF COc1ccc(Cl)c2c1CCN[C@]2(CBr)CC[C@@H]1CCCO1 963269538 KLFPNSPZRFCNTE-SJCJKPOMSA-N 388.733 4.044 50 1 GIGF N#CC1=C(N)Oc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2[C@H]1c1ccccn1 646930 BCSAKHYDYBSHNM-HXUWFJFHSA-N 391.434 4.357 50 1 GIGF COc1cc(/C=N/NC(=O)CSc2cc(C)nc3ccccc23)ccc1C 72110306 VUIYYNXQDPLTOK-WSDLNYQXSA-N 379.485 4.103 50 1 GIGF C[C@H]1[C@@H](O[C@@H](C#N)c2ccccc2)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]1[C@@]24OO3 102999746 AKXUGEWGUZMDGE-MFDBEXAWSA-N 399.487 4.476 50 1 GIGF CCCCC[C@H](O)/C=C/[C@H]1[C@H]2C[C@H](OO2)[C@@H]1C/C=C\CCCC(=O)NCCC 169622081 NBFLONVHOGNRHY-YNRDDPJXSA-N 393.568 4.462 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1sccc1Cl)[C@@H](C2)C3=O 587454194 WYJDGNGTSBRQSR-MGPLVRAMSA-N 399.693 4.448 50 1 GIGF CC(C)[C@]1(CBr)N[C@H](C)Cc2cc(Br)c(F)cc21 587674280 VTCATSSIECJJRH-OTYXRUKQSA-N 379.111 4.369 50 1 GIGF O=C(N/N=C(\c1ccccc1)c1ccc(Br)cc1)c1ccncc1 5515152 ZLNBFXADZTUEAW-RELWKKBWSA-N 380.245 4.027 50 1 GIGF CC[C@H](Br)[C@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@@H]2O1 238740982 ZFUYDSOHVJVQNB-BLQQEKTASA-N 392.131 4.485 50 1 GIGF COc1cccc(/C=N/NC(=O)c2ccc(-c3nc4cccc(C)c4[nH]3)cc2)c1 299827533 KULXKYURJSVKDK-ZVHZXABRSA-N 384.439 4.311 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CBr)(C2CC2)N1 587673528 NSZKOEBVPRYEQU-XLKFXECMSA-N 377.095 4.123 50 1 GIGF CC(C)[C@@H]1C[C@H](O)[C@H]2C[C@@]13CC[C@]1(C)[C@H](Br)CC[C@](C)(O)[C@@H]1[C@H]23 2356573701 XIMOIAZZHIMGIZ-NAKZKLBJSA-N 385.386 4.370 50 1 GIGF C=C(C)[C@@H]1CC[C@](C)([C@@H]2CC[C@](C)(N=C=S)[C@@H]3CC[C@](C)(O)[C@H](NC)[C@@H]32)O1 2356874898 ZWINEQINZVLQEU-IJKXCVAVSA-N 392.609 4.137 50 1 GIGF Clc1ccc([C@@H](Cl)Cn2ncc3c(NCc4ccccn4)ncnc32)cc1 71297051 IMBPFCCEWUQKON-KRWDZBQOSA-N 399.285 4.467 50 1 GIGF COc1ccc(COC[C@H](C)[C@H](O[Si](C)(C)C)[C@@H](C)[C@H]2OC(=O)[C@H]2C)cc1 195367319 FNZUOUVKWQCOFM-STNJDDFNSA-N 394.584 4.266 50 1 GIGF CCCNc1c(C(=O)OCC)cnc2c1cnn2C[C@@H](Cl)c1ccccc1 13491814 PTMRQPOADQFSBI-QGZVFWFLSA-N 386.883 4.410 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)cc1F)O2 587386614 VMCAXVMGPLDHTK-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@H]2Br)N1 587687220 YITULHSMSBQIHV-GFWSLJDESA-N 377.095 4.265 50 1 GIGF CN(C)CCSSCCNC(=O)c1ccccc1Nc1ccccc1 618008187 UDALNVFYZGHTTR-UHFFFAOYSA-N 375.563 4.103 50 1 GIGF N#CC1=C(N)OC(c2ccccn2)=C([S@@](=O)c2ccccc2)[C@@H]1c1ccccc1 1857641748 YLORRRPESSBODW-OLILMLBXSA-N 399.475 4.066 50 1 GIGF CO[C@H]1O[C@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@@]13OO2 100863483 JYSURLKCEQBUMV-GZSKETOLSA-N 380.456 4.348 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C\N(C)C)(c1cccs1)CC2=O 587495736 SFXHMQRFFRMWND-HJBMFWNLSA-N 382.485 4.236 50 1 GIGF CC(C)[C@@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539438 WJIYLLSREKNPAF-MAUKXSAKSA-N 377.234 4.144 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccccc1C(=O)Cl 587879901 KBHLUFANUDWVRS-UHFFFAOYSA-N 380.658 4.083 50 1 GIGF C[C@H](Oc1ccc2ccccc2c1)C(=O)NCCCSSCCN(C)C 618009037 PTUOUUJUTKOZLX-INIZCTEOSA-N 392.590 4.056 50 1 GIGF CO[C@@]1(c2cc(O)ccc2O)C=C(CC/C=C(\C)CC/C=C(\C)C=O)C(=O)O1 1772614237 MOFNDUJXTNIVEF-URUUZNIQSA-N 386.444 4.032 50 1 GIGF C[C@]1(CC(=O)NCc2ccccc2N2CCCCC2)CC2(CCCCC2)OO1 49722710 ANYUTTCGGOBCGY-QFIPXVFZSA-N 386.536 4.497 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C/N(C)C)(c1ccc(Cl)cc1)O2 587377947 LBNSVSPSIJLRLI-FFXXTYGZSA-N 381.863 4.060 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CBr)(C2CC2)[C@@H]1c1ccc(F)cc1 587324398 YPSQUTBAJQZABS-IEBWSBKVSA-N 391.236 4.434 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1F)([C@H](C)Br)O2 587384897 KNYCDLPDSKBVPP-YPMLDQLKSA-N 396.231 4.500 50 1 GIGF O=C(CCc1cccc(C(F)(F)F)c1)N[C@@H](Cc1ccccc1)C(=O)CCl 26155871 ZTODQCQSAAIXEK-KRWDZBQOSA-N 397.824 4.173 50 1 GIGF C[C@@H](Cl)C(=O)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587495854 ALKGMFXWOKISHM-IQMFZBJNSA-N 397.902 4.170 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 85911686 NFCOJBIECSQMAM-IPQYGBETSA-N 384.472 4.149 50 1 GIGF in-man CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccccc2Cl)c(C(=O)OC)c1 101459809 XOPXQXURHPEAAC-VLGSPTGOSA-N 384.819 4.478 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CBr)C1CCC1 587537568 HWNQIIUFWCIBDK-LPHOPBHVSA-N 389.245 4.288 50 1 GIGF CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@@H]1C)C(=O)[C@@H](C)Cl 40430135 ZIGNETWTEBLFNH-CVEARBPZSA-N 387.911 4.141 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2cc(F)c(F)cc2F)C(C)(C)C)c1 653878509 RUFYIJZDAYTEDC-UHFFFAOYSA-N 378.394 4.306 50 1 GIGF C#CCn1c(-c2ccc(C(=O)N/N=C/c3ccc(F)cc3)cc2)nc2ccccc21 1772651179 WLPKXGNAOMBILK-WGOQTCKBSA-N 396.425 4.240 50 1 GIGF CC(C)(C)c1ccc(Cn2nc(-c3ccc(Cl)cc3)cc2C(=O)NN)cc1 28870644 FXZNIPCWQRUALX-UHFFFAOYSA-N 382.895 4.153 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CBr)(c1oc(C)nc1C)CC2=O 587456395 OFGNRYPGNHUBEH-GOSISDBHSA-N 394.265 4.205 50 1 GIGF CO[C@]1(c2cc(O)ccc2O)C=C(CC/C=C(\C)CC/C=C(\C)C=O)C(=O)O1 1772614236 MOFNDUJXTNIVEF-GPBMSMNOSA-N 386.444 4.032 50 1 GIGF N#CC(C#N)=C[C@H](C(=O)N1c2ccccc2Sc2ccccc21)[n+]1ccccc1 95594028 HOHBQNAWFCWUFJ-HXUWFJFHSA-N 395.467 4.318 50 1 GIGF O=C(Cc1ccc(CBr)cc1)N1CCc2c([nH]c3ccccc23)C1 103269184 YRAIFSUFICWZHV-UHFFFAOYSA-N 383.289 4.190 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O 587425482 DGCTUIZFZVPAQR-SGTLLEGYSA-N 395.199 4.011 50 1 GIGF C[C@@H](C(=O)NNC(=O)NC1CCCCC1)c1cccc(Oc2ccccc2)c1 84604007 PKHFXVUUABLKDC-MRXNPFEDSA-N 381.476 4.246 50 1 GIGF CCOC(=O)[C@@H](Cl)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O 586986755 UCGXABQGBHYZIR-SFHVURJKSA-N 381.815 4.303 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@H](Oc3ccc(F)cc3)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43426922 QBWAUDCKUYPUNV-SZMJOESGSA-N 378.440 4.413 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccccc1Cl)[C@@H](C2)C3=O 587412948 FKMUCEXRHSZODA-UGSOOPFHSA-N 393.664 4.386 50 1 GIGF Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1C(=O)Cl 587880527 PQYSWEWLBRPRCS-UHFFFAOYSA-N 394.685 4.391 50 1 GIGF C=C[C@H]1O[C@H]2CC=CC[C@H](C=C=CBr)O[C@H]2C[C@@H]1Br 137579650 UEBLAIAVRZFOKE-CPMYSYMXSA-N 390.115 4.261 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C\N(C)C)(c1ccc(Cl)cc1)O2 587377949 LBNSVSPSIJLRLI-MQGIHEMASA-N 381.863 4.060 50 1 GIGF CCOC(=O)[C@H](Cl)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O 586986754 UCGXABQGBHYZIR-GOSISDBHSA-N 381.815 4.303 50 1 GIGF CCOC(=O)[C@H](Cl)Cc1ccc(C#Cc2cc(Cl)ccc2OC)cc1 587905660 DFYATEGNPPWPPY-GOSISDBHSA-N 377.267 4.461 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)[C@@]3(C)O[C@H]3C[C@@H]12 2356392783 PDQNHDCJWUTAFX-ZVOPPPCBSA-N 396.163 4.286 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2nc(Br)c[nH]c-2n1 586974281 UVDXLPGTWBLODW-QMMMGPOBSA-N 396.086 4.114 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2ccc(I)cc2[nH]1 587087824 VUAIETWOXZICST-VIFPVBQESA-N 397.029 4.352 50 1 GIGF O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@@H](Br)CCBr 587279920 UPMDZCCXSDLKJK-JTQLQIEISA-N 391.015 4.072 50 1 GIGF CC=CC[C@@H]1O[C@H]([C@@H]2C[C@H](Br)[C@@H](CC)O2)C[C@H]1Br 2356782367 DXFOROLMOVEIQX-KTEZLCCFSA-N 382.136 4.205 50 1 GIGF O=C(Oc1ccc(N(CCCl)CCCl)cc1)c1cccc([N+](=O)[O-])c1 5420657 OTCCTHBQSGSBNA-UHFFFAOYSA-N 383.231 4.098 50 1 GIGF CC(C)=CCO[C@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 253930085 WPACVSREXXEVRJ-KCLUMXDGSA-N 394.533 4.091 50 1 GIGF C=C1[C@H](C)C[C@H](OC(=O)C=Cc2ccccc2)[C@]2(C)[C@H](C=O)C(C=O)=CC[C@H]12 2356437413 RIGSJIIZCIKSKY-RMQBJGKLSA-N 378.468 4.174 50 1 GIGF CCCCCOc1ccc([C@H](CCl)NC(=O)c2cc(CC)nn2C)cc1 103173199 FSRGKPPSPDQHPX-SFHVURJKSA-N 377.916 4.261 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] 103176501 XDXFIYWDJSSSPE-HOTGVXAUSA-N 388.210 4.492 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(N=C=S)cc1 587896302 KRJNZBGYUZMTEP-UHFFFAOYSA-N 375.280 4.438 50 1 GIGF CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@]2(C)[C@H](OC(=O)C=Cc2ccccc2)C1 2356566373 FRHWTFAYHKXVPQ-ZPFZUWPUSA-N 378.468 4.318 50 1 GIGF C/C(=N\NC(=O)c1ccc(Br)cc1)c1ccc(-n2cccc2)cc1 103224074 FTCJECYLNFGIEE-KGENOOAVSA-N 382.261 4.394 50 1 GIGF COc1ccc([C@@](C)(O)c2nc(N3CCC(Cl)CC3)nc3ccccc23)cc1 1911585363 GQWVVUXQFNQZKC-JOCHJYFZSA-N 397.906 4.102 50 1 GIGF C=C(C)[C@@H](CCC(C)=CCOc1c(OC)cc(C=CCO)cc1OC)OO 2356648695 NEONTBMZDXWQFB-GOSISDBHSA-N 378.465 4.249 50 1 GIGF CC(C)(c1ccc(S(=O)(=O)/C=C/C#N)cc1)c1nnc(C2CCCCC2)o1 147601275 HWHYHMIMBBOPHO-MKMNVTDBSA-N 385.489 4.254 50 1 GIGF C=CCc1cccc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c12 587009547 KSEHUKAUNZOTTK-IBGZPJMESA-N 392.890 4.412 50 1 GIGF COc1cc2c3c(c1)O[C@@]1(c4ccccc4CC[C@H]1Br)[C@@H](C2)C3=O 587417536 NRVDRSRSCGPKDX-VPWXQRGCSA-N 385.257 4.048 50 1 GIGF Cc1ccc(C(=O)/C=C/c2ccc(/C=N/NC(=O)c3ccncc3)cc2)c(C)c1 1772575907 FMCKULMBQDNBLJ-LOBCTCGSSA-N 383.451 4.358 50 1 GIGF CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@H]1C)C(=O)[C@H](C)Cl 40430141 ZIGNETWTEBLFNH-JKSUJKDBSA-N 387.911 4.141 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1cccc(C)c1)([C@H](C)Br)[C@@H](C2)C3=O 587412331 AKVMMTPDDKKPQB-SLSDUTBNSA-N 387.273 4.430 50 1 GIGF COc1ccc2cc([C@@]3(CCl)c4nn(C)cc4CCN3C)ccc2c1Cl 963955733 SJCIDNKNGRYAQE-FQEVSTJZSA-N 390.314 4.206 50 1 GIGF CC[C@H](Br)[C@@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 587376725 XZFBJUPWHAXEMT-MAUKXSAKSA-N 375.266 4.006 50 1 GIGF CCO[C@H]1C[C@]2(C)C(=O)[C@H](Br)C[C@H]2[C@@H]2CCc3cc(O)ccc3[C@@H]12 13651521 ZYHABSOZBWTZTA-FMWJIXOUSA-N 393.321 4.206 50 1 GIGF CN1C(=O)CC[C@]2(C)[C@@H]3CC[C@@]4(C)[C@H](CC[C@@]4(O)C#CCCCl)[C@@H]3CC[C@@H]12 26004123 SUSIRKQQOODCLS-CHCWYRICSA-N 391.983 4.213 50 1 GIGF CC(=O)[C@@H](Br)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 586984657 NUAYITGUDOWZGI-GOSISDBHSA-N 382.213 4.177 50 1 GIGF NNC(=O)c1ccc2nc(-c3cncc(-c4cc(Cl)cc(Cl)c4)c3)[nH]c2c1 587069572 DGDITYIQXCCTRA-UHFFFAOYSA-N 398.253 4.202 50 1 GIGF O=C(Nc1ccccc1)[C@H](Cl)[C@@]1(c2ccccc2)NCCc2ccc(O)cc21 963328392 FOOHQYKCZJLOQH-GMAHTHKFSA-N 392.886 4.028 50 1 GIGF C[C@@]1(CCCBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539725 XWLSJRCPSPMUQP-QAPCUYQASA-N 377.234 4.288 50 1 GIGF CCc1ccc([C@]2(CBr)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 587411025 AZPUYYJAFIFQBV-UZLBHIALSA-N 387.273 4.295 50 1 GIGF CN1C(=O)CC[C@]2(C)[C@@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#CCCCl)[C@@H]3CC[C@@H]12 169359535 SUSIRKQQOODCLS-HQTNTUHFSA-N 391.983 4.213 50 1 GIGF CC(=O)OC/C(=C\C(=O)O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C=O)=CCC[C@H]12 238776947 MPESIRKGUJLXPE-GSYLYOEOSA-N 376.493 4.319 50 1 GIGF CC[C@@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@H]2CC=C[C@@H]1Br 2356803522 XERQFTJKXUDTGT-HTAVTGKESA-N 378.104 4.095 50 1 GIGF CC1(C)c2ccccc2N2C(=O)[C@]3(C)SS[C@@]21C(=O)N3c1ccccc1 169347698 NPZYKXNBQAQYRB-VQTJNVASSA-N 382.510 4.165 50 1 GIGF CCc1c(C)[nH]c2c1/C(=N/NC(=O)Nc1cccc([C@H]3CCCN3)c1)CCC2 38149912 ZMZUJYHRKQZODP-TUQDJIKESA-N 379.508 4.172 50 1 GIGF CCN[C@H](c1ccc(/C=C/C#N)cc1)c1ccnc(Nc2ccc(C#N)cc2)n1 169350580 QZFYMKGTWBSIIP-LFTXJPJQSA-N 380.455 4.328 50 1 GIGF C[C@H]1CCCc2sc(-n3cccc3)c(-c3nc4cc(C(=O)NN)ccc4[nH]3)c21 587031989 XGBDGBWNMIMRMQ-LBPRGKRZSA-N 391.500 4.125 50 1 GIGF COc1ccc([C@@]2([C@@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 587375490 SWOSJJJKNUTLAL-BLVKFPJESA-N 390.277 4.230 50 1 GIGF CN(C)CCSSCCCNC(=O)c1ccccc1Nc1ccccc1 618012742 ZKIOBWHAJMRDIB-UHFFFAOYSA-N 389.590 4.493 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 43888888 SBCGDCBRWXAAIF-WWYMACMNSA-N 386.488 4.398 50 1 GIGF O=C(N/N=C\c1ccc(Oc2ccc(Br)cc2)cc1)c1ccncc1 66101388 BOBNJNRCSWGHHC-XKZIYDEJSA-N 396.244 4.400 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@H]2Br 587543540 KTDXELDQKBBWHD-JTDSTZFVSA-N 389.245 4.430 50 1 GIGF Cc1ccc(OC(=O)N(Nc2ccccc2)S(=O)(=O)c2ccccc2)cc1 653781611 NJAHUFQRBQDANZ-UHFFFAOYSA-N 382.441 4.212 50 1 GIGF O=C(N/N=C/c1ccc(Cl)cc1Cl)c1c[nH]c2cc(Cl)ccc2c1=O 1857747160 NIAFKZVLNZNVLO-QPJQQBGISA-N 394.645 4.252 50 1 GIGF CCOc1cc(C(=CC#N)c2ccc(OC)c(OC(=O)N(C)C)c2)ccc1OC 1857623319 CJDUNKLUUVJWIS-UHFFFAOYSA-N 396.443 4.118 50 1 GIGF CC(C)[C@@H]1C[C@@H]2[C@H]3[C@H]4[C@@](C)(O)CC[C@@H](Br)[C@@]4(C)CC[C@]13C[C@H]2O 2356671204 QYWKYBMMQNPDJT-KRXXDGGMSA-N 385.386 4.370 50 1 GIGF CN(C(=O)c1ccc(NC(=O)/C(C#N)=C(\O)C2CC2)cc1)c1ccc(Cl)cc1 38989309 JJWGUUQJWMZRAD-HNENSFHCSA-N 395.846 4.301 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2cccc(F)c2)c1 38145349 LZNITGYIYIZNLQ-VUZMPXBXSA-N 391.471 4.433 50 1 GIGF COc1ccc(/C=N/N(C(=O)c2ccc(Cl)cc2)C(=O)c2cccnc2)cc1 66259156 FOJUSHDMAQSQFQ-ZMOGYAJESA-N 393.830 4.060 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3nc(O)[nH]c3c1)CC2=O 587459241 HDXNSOIQZLUDEV-FQEVSTJZSA-N 386.835 4.026 50 1 GIGF CC(C)[C@@H]1[C@H](O)[C@H]2C[C@@H]3[C@@H]4[C@](C)(O)CC[C@H](Br)[C@]4(C)CC[C@@]13C2 2356469456 OLJYONZMSNKXBK-QIWSTVMISA-N 385.386 4.370 50 1 GIGF C=C1CC[C@H]([C@]2(C)CC[C@H](C(C)(C)NC)O2)[C@@H]2[C@@H]1CC[C@@](C)(O)[C@H]2N=C=S 2356809136 ANRLMRLBKAVEHS-OGZUYTBBSA-N 392.609 4.137 50 1 GIGF N#C/C(=C1\SCCCN1c1ccccc1)c1nc2cc(C(=O)O)ccc2[nH]1 53226500 YAHOEUFRJDLKMM-XDJHFCHBSA-N 376.441 4.097 50 1 GIGF COc1ccccc1/C=N/NC(=O)c1ccccc1NC(=O)c1ccc(C)cc1 299859990 ISUDVHMSPZAGFN-BUVRLJJBSA-N 387.439 4.020 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccccc2)[C@]2(C)[C@H](C=O)C(C=O)=CC[C@H]12 2356695039 QTXOFCZHIZFJCA-IUBSTNSRSA-N 380.484 4.398 50 1 GIGF CN(C)CCSSCCC(=O)NCC(c1ccccc1)c1ccccc1 618007604 HNNYGXATIZVVDP-UHFFFAOYSA-N 388.602 4.268 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(Br)cc(C)c2[nH]1 586970689 IUFKIJOFPITGKO-LLVKDONJSA-N 376.092 4.495 50 1 GIGF CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1ccc(F)cc1)CC2=O 587465088 AGDHDFUVZXIWGE-INJZMFEXSA-N 394.446 4.314 50 1 GIGF Cc1nc(C)c([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 587541599 CKNDESCMYNYDBT-OXQOHEQNSA-N 385.803 4.093 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1NC(=O)CCCCl)O2 587373301 CPJBNSDDZQJMQB-OAQYLSRUSA-N 386.879 4.415 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 587687851 IWOAQEFGLVRYGA-ZKANADHPSA-N 387.680 4.210 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(F)cc1C(=O)CBr 587916541 LZMZVGHAFFEWQD-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@H](O)[C@@]2(C)[C@@H]1C=O 2356730843 KSXULPOQIKTIMP-ZSPTZRBXSA-N 382.928 4.052 50 1 GIGF O=C(N/N=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1C[C@@H]1c1ccccc1 15962006 UGOFNVAWWWTSKR-ICAYWSFESA-N 375.384 4.109 50 1 GIGF CN1C(=O)CC[C@]2(C)[C@@H]3CC[C@@]4(C)[C@H](CC[C@@]4(O)C#CCCCl)[C@H]3CC[C@@H]12 26004137 SUSIRKQQOODCLS-RFGFHXCZSA-N 391.983 4.213 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccccc1F)([C@@H](C)Br)[C@@H](C2)C3=O 587426749 POOJCHPPTVZWLZ-UOTLPGLASA-N 391.236 4.261 50 1 GIGF COC(=O)[C@]1([C@@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496169 BRKBEROTFHAGET-RBBKRZOGSA-N 384.859 4.423 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc2c(cc1CBr)OCO2 587898317 INSGRHZJPWWKFZ-UHFFFAOYSA-N 379.637 4.372 50 1 GIGF CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(Cl)cc2)c(C(=O)OC)c1 101459817 GLZNASWGBPMHKU-ZCXUNETKSA-N 384.819 4.478 50 1 GIGF COC(=O)[C@@]1([C@@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496171 BRKBEROTFHAGET-UNMCSNQZSA-N 384.859 4.423 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 103167895 HLXWDFOMGZVXTL-JKSUJKDBSA-N 388.210 4.492 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1cccs1)([C@@H](C)Br)[C@@H](C2)C3=O 587451960 PMPHHZULGVSZAB-ZPQPFTAQSA-N 379.275 4.183 50 1 GIGF Cc1ccc2c(=O)c(CSC(=S)N(CCCl)CCCl)coc2c1 43017241 HBXPKVPTUQWSFA-UHFFFAOYSA-N 390.357 4.399 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 85911687 NFCOJBIECSQMAM-MTJZCMQSSA-N 384.472 4.149 50 1 GIGF in-man CCCCNCCC[PH](c1ccccc1)(c1ccccc1)c1ccccc1 49803027 NPCIOWUAIBMYMC-UHFFFAOYSA-N 377.512 4.493 50 1 GIGF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@](CCCCl)(c2cccc(Cl)c2)N1 962892478 FVFVKKAMZOFBCJ-HKUYNNGSSA-N 382.262 4.341 50 1 GIGF CCCCCC(=O)O[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 1772618337 INPSLYJXSNBPRG-VBNFAEQJSA-N 382.497 4.318 50 1 GIGF CC(=O)SCC[C@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587612665 KJCZJCGFGUMCLS-QFBILLFUSA-N 392.860 4.001 50 1 GIGF Cc1sc(NC(=O)NCCSSCCN(C)C)nc1-c1ccccc1 621476453 ZGRCYWXRFSHQLF-UHFFFAOYSA-N 396.607 4.183 50 1 GIGF N#CC1=C(N)[C@]2(C(=O)Nc3ccccc32)[C@@H](c2ccccc2F)[C@@H]2CCCC=C12 169348687 UTSNHOJQYSPONU-YFMCZXFPSA-N 385.442 4.276 50 1 GIGF C[C@H](NC(=O)OC(C)(C)C)[C@@]1(CCl)CC(=O)c2ccc3c(c2O1)CCCC3 587496903 GTAGBJXNVBSZJN-ZSEKCTLFSA-N 393.911 4.421 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2cccc3c2CCCO3)C(C)(C)C)c1 103215917 DZEDTJYGXJDUNX-UHFFFAOYSA-N 380.488 4.214 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 169342094 WDTIPJZJXSSSGU-LLWOTBTRSA-N 391.895 4.288 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2ccc(Br)c(F)c2[nH]1 586971057 LGJSLKCECLDNHU-JTQLQIEISA-N 380.055 4.326 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cn(C)c3ccccc13)O2 587370289 ADBFSKSZOFSMPU-FQEVSTJZSA-N 399.288 4.325 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1cccc(C)c1)([C@@H](C)Br)[C@@H](C2)C3=O 587412325 AKVMMTPDDKKPQB-ADYAMRHXSA-N 387.273 4.430 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 587687848 IWOAQEFGLVRYGA-BCTVWOGZSA-N 387.680 4.210 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@H](CBr)[C@@]3(C)O[C@H]3C[C@@H]12 2356392782 PDQNHDCJWUTAFX-LOVAHEPDSA-N 396.163 4.286 50 1 GIGF Cc1ccc([C@@]2(CCl)N[C@H](C(=O)O)Cc3c(Cl)cc(F)c(F)c32)s1 962972398 UQNKEOUAELDHPI-MEDUHNTESA-N 392.254 4.069 50 1 GIGF O=C(O)Cc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)s1 587531821 MLOAMVMAXMXLNP-HXUWFJFHSA-N 390.888 4.354 50 1 GIGF O=C(CCl)Nc1ccc(-n2nc(O)nc2-c2ccc(Cl)c(Cl)c2)cc1 1857751371 OJWVXXDFDKSEGH-UHFFFAOYSA-N 397.649 4.124 50 1 GIGF C[C@@]1(CC(=O)NCc2ccc(OC(F)(F)F)cc2)CC2(CCCCC2)OO1 49677832 QIMHTADQASRTKL-QGZVFWFLSA-N 387.398 4.405 50 1 GIGF CCOC(=O)c1cc(-c2ccc(NC(=O)c3ccc(CCl)cc3)cc2)[nH]n1 72139891 KYGHNDMYYMZLGS-UHFFFAOYSA-N 383.835 4.245 50 1 GIGF O=C(O)CCC/C=C/C[C@@H]1[C@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 169692720 ZOQXTNLUBHPZOZ-CMVFLQJHSA-N 384.944 4.289 50 1 GIGF Cc1c(C(=O)CBr)c(C(=O)Nc2ccccc2)nn1-c1ccccc1 29123505 MUIMJLNASYOVTN-UHFFFAOYSA-N 398.260 4.011 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2cccc3c2C[C@@H](C)O3)C(C)(C)C)c1 103215908 BUNWEWRCVFOTMK-MRXNPFEDSA-N 380.488 4.213 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N=C=O)c2)N1 587742586 SHTHEQPLEWSXAB-ADLMAVQZSA-N 375.241 4.353 50 1 GIGF C#C/C=C\C/C(Br)=C1\C[C@H]2O[C@@H](CC)[C@H](Br)C[C@H]2O1 238775668 OGLSYOBOMBXPEB-PAOMTNDASA-N 390.115 4.292 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(C)c(Br)cc2[nH]1 586970892 LTHQDADVLMTPAC-LLVKDONJSA-N 376.092 4.495 50 1 GIGF CC[C@H](O[Si](C)(C)C(C)(C)C)[C@](C)(O)[C@H](O)[C@@H](C)COC(=O)C(C)(C)C 2356699298 MIABMGRTXDZCFD-MFCZKXCZSA-N 390.637 4.124 50 1 GIGF COc1ccc(C(=O)NN=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)cc1OC 5460444 JQRYETUNHBDRIW-UHFFFAOYSA-N 398.503 4.317 50 1 GIGF O=C1C[C@@](CBr)(c2nccs2)Oc2c1ccc1c2CCCC1 587536064 QREGXDYIKCMYHV-QGZVFWFLSA-N 378.291 4.278 50 1 GIGF C[C@H]1Oc2ccccc2[C@@H]2[C@@H]1C=C(C=O)[C@@H](C)[C@]21C(=O)Nc2cc(Cl)ccc21 1772625306 HWCMAGIYEQMPBF-WCXKZXLOSA-N 393.870 4.486 50 1 GIGF C=CC[C@@]12SS[C@@H](C(=O)N1Cc1ccccc1)N(Cc1ccccc1)C2=O 1857554048 YCYYMKUEKLXWFJ-FPOVZHCZSA-N 396.537 4.051 50 1 GIGF CC(C)=CCN1C(=O)/C(=N/NC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc21 1857652833 PPKDCZCQYYRBDP-NJNXFGOHSA-N 389.499 4.431 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1c[nH]c3nccc(Cl)c13)O2 587374302 VTRRRSPMGLITBD-GOSISDBHSA-N 376.243 4.206 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1cc(CCl)c(OC)cc1OC)[C@@H](C2)C3=O 587419621 FKIYMBZSEKNDEN-YCRPNKLZSA-N 388.847 4.114 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1NC(=O)CCl)CC2=O 587461917 VDMSIJIDBKBAFL-NRFANRHFSA-N 387.863 4.403 50 1 GIGF COc1ccc(/C=N/NC(=O)c2ccc(-c3cccc(Cl)c3)nc2C)cc1 1857746952 BUPHDXSGBQLIBT-YDZHTSKRSA-N 379.847 4.483 50 1 GIGF O=C(N/N=C/c1ccc(Cl)cc1Cl)c1c[nH]c2ccc(Cl)cc2c1=O 1857747015 WUWNPHFTCWVJII-QPJQQBGISA-N 394.645 4.252 50 1 GIGF C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 195297134 MUCWOBDSQXBTNM-ZLQJMPCFSA-N 394.584 4.493 50 1 GIGF C[C@@](Br)(CCl)[C@@H]1C[C@H](Cl)[C@](C)(/C=C/Br)O1 238733543 YTOJCYQLVTZXDI-AZECVOHWSA-N 380.935 4.442 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(Br)cc(F)c2[nH]1 586971589 UCVQMQJQNDDBEY-SNVBAGLBSA-N 380.055 4.326 50 1 GIGF N#CC(C#N)=Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 587882239 QLFCBNSEWHQNIQ-UHFFFAOYSA-N 394.261 4.134 50 1 GIGF COc1cc(Br)ccc1C(=O)N/N=C/c1c(O)ccc2ccccc12 1772607378 GPBCLOCWXXEQLK-SRZZPIQSSA-N 399.244 4.080 50 1 GIGF CC[C@@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@@H]2CC=C[C@H]1Br 2356803523 XERQFTJKXUDTGT-KKLJBBMUSA-N 378.104 4.095 50 1 GIGF Cc1cccc(-n2cnc3cc(C(=O)N4CCC(Br)CC4)ccc32)c1 103226027 CEOMKNCNEHKMLD-UHFFFAOYSA-N 398.304 4.333 50 1 GIGF O=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)cc1 146247419 GQJHYPHEWSEWRW-UHFFFAOYSA-N 398.418 4.394 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1ccc(F)cc1)CC2=O 587465091 AGDHDFUVZXIWGE-LKVFMFGUSA-N 394.446 4.314 50 1 GIGF Cn1ccnc1[C@@]1(CCl)c2ccccc2CCN1[C@H](C#N)c1ccccc1 963199768 DAPUUZPHSHULLO-IFMALSPDSA-N 376.891 4.025 50 1 GIGF CC(C)(C)[Si](C)(C)O[C@@H]1CCCO[C@@H]1COCC(=O)OCc1ccccc1 194999352 ICCGIVAKYLYPPM-RTBURBONSA-N 394.584 4.316 50 1 GIGF CC[C@]1(CCCCl)c2scnc2C[C@H](C(=O)O)N1C(=O)OC(C)(C)C 963143120 KWICASSLUGSBDM-PXAZEXFGSA-N 388.917 4.014 50 1 GIGF O=C(N/N=C\c1ccc(COc2ccc([N+](=O)[O-])cc2)o1)c1ccccc1Cl 13108678 AZLNGQGXOPSNFW-NHDPSOOVSA-N 399.790 4.184 50 3 GIGF [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 169703245 YCAXYDWVXDZEAN-RBUKOAKNSA-N 386.386 4.010 50 1 GIGF CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H]1Cl 587542659 ATFXVTGBTQWMKE-KPYYAMLLSA-N 388.847 4.287 50 1 GIGF CCCCc1ccc(S(=O)(=O)n2cc(C=CC=O)c3cc(OC)ccc32)cc1 2356596919 VXSSYXBBFOZZRZ-UHFFFAOYSA-N 397.496 4.442 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1cc(F)ccc1CBr)[C@@H](C2)C3=O 587426483 ORHWXDCGASUJSP-KBXCAEBGSA-N 377.209 4.218 50 1 GIGF N#C/C(=C(/O)COC(=O)CSc1ccc(Cl)cc1)c1nc2ccccc2[nH]1 101812265 CUOILKZYLXGBQH-VKAVYKQESA-N 399.859 4.344 50 1 GIGF aggregator COC(C)(C)[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587324322 QGRNBLGWTUHIJL-FXAWDEMLSA-N 378.827 4.293 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(CCl)c2occ(C=O)c(=O)c2c1 587907918 SCAJHLADHGSYIU-UHFFFAOYSA-N 387.218 4.406 50 1 GIGF Cc1ccnc2c1CCN[C@@]2(c1cc(C)n(Cc2ccco2)c1C)[C@@H](C)Cl 963084548 DYDTZAIPNYCRCR-VGOFRKELSA-N 383.923 4.466 50 1 GIGF Cc1ccc2c([C@@]3(CCl)NC[C@@H]4CC(=O)N(C)c5cccc3c54)c[nH]c2c1 963017503 BUBPCRWIPQKIQT-FPTDNZKUSA-N 379.891 4.012 50 1 GIGF CCCc1c(O)ccc2c1O[C@](C)([C@H](Cl)C(=O)Nc1ccccc1)CC2=O 587458067 FUXNBZHEYMIAQV-CTNGQTDRSA-N 387.863 4.315 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3nc(O)oc3c1)CC2=O 587458878 FYTXMHMBDJGVKP-FQEVSTJZSA-N 387.819 4.291 50 1 GIGF CCn1cc(C(=O)N/N=C\C=C(/C)CCC=C(C)C)c(=O)c2ccc(C)nc21 98081955 NPVCCSUPAJCFNM-RYMQJFMGSA-N 380.492 4.133 50 1 GIGF CC(=O)OCC(=CCCC(C)=CCO)CCC[C@@H](C)C(=O)C=CC(C)(C)OO 2356386747 VFWLLWIEDAKQNA-GOSISDBHSA-N 396.524 4.395 50 1 GIGF CCOC(=O)c1[nH]c2cc(Cl)ccc2c1/C=N/NC(=O)CCc1ccccc1 1857610972 ZWGYQYQFHZRGQK-YDZHTSKRSA-N 397.862 4.081 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(C#N)cc2)N1 587689740 VILSVEQLIIPKGS-VOJFVSQTSA-N 393.687 4.476 50 1 GIGF O=C(Oc1ccc([N+](=O)[O-])cc1)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F 68574314 VPKISVWPQWYZAO-UHFFFAOYSA-N 385.138 4.174 50 1 GIGF biogenic C=C1CCC=C(C)C[C@@H]2OC(=O)C(=C)[C@@H]2CC=C(COC(C)=O)CC[C@@H]1OO 2356406913 LCYYYCIAJNWGOB-ACRUOGEOSA-N 390.476 4.289 50 1 GIGF COc1cc2c3c(c1)O[C@]1([C@@H](C2)C3=O)[C@H](Br)[C@H]2CC[C@@]1(C)C2(C)C 587416890 GADGSAZQNCDXGZ-BIXUVVFBSA-N 391.305 4.401 50 1 GIGF CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H]1Cl 587542662 ATFXVTGBTQWMKE-NVEXJGOOSA-N 388.847 4.287 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)[C@@H]2CCC[C@@H]3O[C@H](C)C[C@H]32)C(C)(C)C)c1 299846653 WDYHWAPYSQDGTB-LMCOJAPRSA-N 386.536 4.169 50 1 GIGF Cc1ccc(SCc2n[nH]c3c2[C@@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1 4168395 QHPLVOGJTWERNY-QGZVFWFLSA-N 378.457 4.130 50 3 GIGF N#C/C(C(=O)Nc1ccc([N+](=O)[O-])cc1)=C(/O)c1ccc(C(F)(F)F)cc1 59034410 QUCPKZOIUBVODC-PFONDFGASA-N 377.278 4.045 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc3c(c1)CCC3)O2 587374524 OYOQVUSETNLQSD-HXUWFJFHSA-N 386.289 4.322 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3nc(O)oc3c1)CC2=O 587458882 FYTXMHMBDJGVKP-HXUWFJFHSA-N 387.819 4.291 50 1 GIGF N#CC(C#N)=C1N(CCCN2CCCCC2)CCN1Cc1cccc2ccccc12 36289091 SHRSGQGHSIIIOH-UHFFFAOYSA-N 399.542 4.092 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)C(=O)[C@@H](Br)CC3 586986743 TUEVUDCYRWHZAR-LBPRGKRZSA-N 394.224 4.044 50 1 GIGF COC(=O)C1=C(C(F)(F)F)N(C)C(C)=C(C#N)[C@@H]1c1ccc(F)cc1Cl 62224688 BAVATTCEWXIPMY-ZDUSSCGKSA-N 388.748 4.295 50 1 GIGF O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 103167314 DKLRKSZQSVUEJP-HZPDHXFCSA-N 388.210 4.492 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)c(C)c1)O2 587381358 HYDCFOGYBWHLQB-SFHVURJKSA-N 378.241 4.280 50 1 GIGF N#Cc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587541265 AIZAROIFIAUIHJ-SIKLNZKXSA-N 391.810 4.360 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12c1ccccc1C[C@H]2Cl 587550976 WQWSKRWPSGWGBF-XQBPLPMBSA-N 378.811 4.413 50 1 GIGF O=C([C@@H]1Cc2ccccc2[C@](CCl)(c2ccc(Cl)cc2)N1)C(F)(F)F 962763395 KFPRZKJICCSVMN-RDJZCZTQSA-N 388.216 4.468 50 1 GIGF C/C(=N\NC(=O)c1ccncc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 15894670 XPXVWVJSARKJSH-AFUMVMLFSA-N 392.846 4.141 50 3 GIGF O=C(Nc1ccccc1)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 43543983 VPSXKEMYZVMPDM-UHFFFAOYSA-N 384.476 4.141 50 1 GIGF Cc1ccc(/C=C(\C#N)c2nc3cc(Br)cc(C(=O)O)c3[nH]2)cc1 587187787 KTIZBELHZBMHGW-WUXMJOGZSA-N 382.217 4.396 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)c(F)c1)[C@@H](C2)C3=O 587426104 KZSQVSOZIPMXLU-LIRRHRJNSA-N 391.236 4.181 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OCCCCl)c1)[C@@H](C2)C3=O 587420044 GBWIBZCIEKACFW-BTYIYWSLSA-N 388.847 4.200 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1cccc(C(=O)OC)c1)CC2=O 587458590 CGWFRSDGPWKCKH-OAQYLSRUSA-N 388.847 4.231 50 1 GIGF COc1ccc2ccccc2c1C=NNC(=O)c1cc(-c2ccc(C)cc2)n[nH]1 263590451 HQJOCTQPDCYXLI-UHFFFAOYSA-N 384.439 4.311 50 3 GIGF CCCCNc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc(OC)cc(OC)c1 38153945 GDHWOXGCFPEPAF-NRFANRHFSA-N 379.460 4.134 50 1 GIGF Clc1ccc([C@@H](Cl)Cn2ncc3c(NCc4ccncc4)ncnc32)cc1 71319426 LHXWTIIFWARQLP-KRWDZBQOSA-N 399.285 4.467 50 1 GIGF O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc([N+](=O)[O-])ccc1F 84671540 VAQZCDBSURAXFZ-UHFFFAOYSA-N 379.391 4.081 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 103167896 HLXWDFOMGZVXTL-HOTGVXAUSA-N 388.210 4.492 50 1 GIGF CC[C@@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@@H]2CC=C[C@@H]1Br 2356803521 XERQFTJKXUDTGT-HKXRBXPKSA-N 378.104 4.095 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@@H](NC(=O)OC(C)(C)C)C(C)C)O2 587374345 XBVGHCDHRGNZNG-PXNSSMCTSA-N 396.915 4.069 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 586971792 YYHRRWBUPAVCPJ-INIZCTEOSA-N 389.297 4.255 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2c(Cl)c(Br)cnc2[nH]1 586971824 YIHLMMRJYQBLCF-MRVPVSSYSA-N 397.498 4.235 50 1 GIGF N#CSC[C@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 587532553 OBJJIIOVIQCHQZ-NRFANRHFSA-N 381.453 4.052 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N=C=O)cc2)N1 587742046 PTQFFJYJIKZGFC-ADLMAVQZSA-N 375.241 4.353 50 1 GIGF Cc1cc(N(CCCl)CCCl)ccc1[C@@H]1NCCc2ccc(O)cc21 963354660 XTPOGJZARKFUFU-FQEVSTJZSA-N 379.331 4.220 50 1 GIGF CCOC(=O)C[C@@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 587498403 GXTKFMDNFNUFKT-CWTRNNRKSA-N 395.293 4.006 50 1 GIGF Cc1ccc(/C=N/NC(=O)c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)cc1 473166241 FLICCCLIVQCYIC-ZVHZXABRSA-N 398.422 4.182 50 1 GIGF CCN(CC)c1ccc2c(c1)OC(/N=C/N)=C(C#N)[C@H]2c1ccc(Cl)cc1 66074607 LPKDFLSOYXOXNA-FQEVSTJZSA-N 380.879 4.433 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C#N)=COc1ccccc12 587743095 VEYDRGCHNQLRRS-JEOXALJRSA-N 385.236 4.166 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@@]2(C)[C@@H]1C(C=O)=C[C@@H]1CC(C)(C)C[C@H]12 100782778 NFCOJBIECSQMAM-NMTUAQRSSA-N 384.472 4.149 50 1 GIGF endogenous,in-man COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C\c3ccc(C)cc3)nc2c1 587188211 PPGCGABJGVPCSA-AUWJEWJLSA-N 396.244 4.485 50 1 GIGF CC(=O)Nc1cc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)ccc1O 587498790 ONCFPMQYANOXHU-JOCHJYFZSA-N 399.874 4.329 50 1 GIGF O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@@H]1Br 40420246 YZSQCBLLDFMPON-NYNLCMDTSA-N 381.122 4.493 50 1 GIGF CC(C)=NNC(=O)c1cc2c([nH]c3ccccc32)c(-c2cccc([N+](=O)[O-])c2)n1 73141869 NZMXCSROKCXFOV-UHFFFAOYSA-N 387.399 4.417 50 1 GIGF CC[C@@H](Br)[C@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 587376727 XZFBJUPWHAXEMT-QAPCUYQASA-N 375.266 4.006 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCl)COc1ccccc1 587543162 JQLXBFNKRIIIHY-UGKGYDQZSA-N 396.826 4.410 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@@H](Cl)N=O)[C@@H](C2)C3=O 587417048 IRVBKNPRCUTLRB-DOPJRALCSA-N 378.211 4.323 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(C(Cl)Cl)N1 587689425 SHLKSUAKGUFMOI-SREIQFSDSA-N 375.496 4.360 50 1 GIGF Cc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2C(=O)NC2CCCCC2)o1 103204036 TYTNUNFSLXNMEU-WSDLNYQXSA-N 387.867 4.068 50 1 GIGF BrC/C=C\c1nc2c(Br)ccc(Br)c2[nH]1 586972659 YOSPYASITWJESE-UPHRSURJSA-N 394.892 4.496 50 1 GIGF O=C(Cl)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587542219 GDBZKCCZYAMKKQ-XLIONFOSSA-N 380.783 4.474 50 1 GIGF Br[C@@H]1C=C[C@@]2(C1)c1ccccc1C[C@@H]1CN(c3ccccc3)CCN12 962626715 CFRUFDDERVFBIU-SYYKKAFVSA-N 395.344 4.352 50 1 GIGF Cc1cc2nc(-c3ccc(C(=O)N/N=C/c4ccccc4O)cc3)[nH]c2cc1C 1857551044 PPSDGFLULCCFTM-ZMOGYAJESA-N 384.439 4.316 50 1 GIGF O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@H](Br)CCBr 587279921 UPMDZCCXSDLKJK-SNVBAGLBSA-N 391.015 4.072 50 1 GIGF O=C1c2ccc(O)cc2OC2(CC(Br)C2)[C@@H]1c1ccc(F)cc1 587325544 YPFMSTCNUXFFOX-GOVJDZJHSA-N 377.209 4.186 50 1 GIGF CC1(C)[C@]2(C(=O)NCc3ccccc3Cl)CC[C@@]1(C)C(=O)[C@@H]2Br 13139440 DGRQQFSPTYGWLX-DOPJRALCSA-N 398.728 4.115 50 1 GIGF Cc1ccc2c(c1)[C@@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C(C#N)=CO2 587572538 PSQFVWDDAAFZJG-URXFXBBRSA-N 397.386 4.358 50 1 GIGF CCCCCCOC(=O)[C@H](F)[C@@H](Br)C(=O)OCCCCCC 33815063 HXMKOCXMUASSJO-ZIAGYGMSSA-N 383.298 4.335 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)[C@@H]2CCC[C@@H]3O[C@@H](C)C[C@H]32)C(C)(C)C)c1 299846655 WDYHWAPYSQDGTB-RNQOJCNYSA-N 386.536 4.169 50 1 GIGF O=C(c1cccc(CCl)c1)c1c(CO)oc2cc(Br)cnc12 587275913 GZQDRGPCVNSVRS-UHFFFAOYSA-N 380.625 4.052 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(C=C(C#N)C#N)c2nsnc12 587920102 ABWKGIGKRSGDPX-UHFFFAOYSA-N 376.828 4.184 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C)([C@@H](Cl)C(=O)Nc1ccccc1)CC2=O 587458070 FUXNBZHEYMIAQV-PZJWPPBQSA-N 387.863 4.315 50 1 GIGF C=C1C(=O)O[C@@H]2C=C(C)CC=C[C@](C)(OO)CCC=C(C)[C@H](OC(C)=O)C[C@@H]12 2356799330 UIRWAUSAMAORJV-HIUFNZKISA-N 390.476 4.287 50 1 GIGF COc1cc2occ(O)c2cc1[C@]1(CCl)CC(=O)c2cc(C)cc(N)c2O1 587374432 XZSINGZXMDAGRJ-HXUWFJFHSA-N 387.819 4.137 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cnc(N3CCCCC3)s1)O2 587415161 XYQDHKRHXSMZAF-IBGZPJMESA-N 391.924 4.124 50 1 GIGF COC(=O)c1cc(CBr)ccc1C#Cc1cc(Cl)ccc1OC 587898770 PWDPWRUTCCHVRF-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@@](CCCCCl)(c2ccnc(Cl)c2)N1 962906891 RKKIIAOLAGOQCG-QFBILLFUSA-N 397.277 4.126 50 1 GIGF CO[C@@H]1C(=O)N(C/C(C#N)=C/c2ccccc2)[C@@H]1c1ccc(Cl)cc1Cl 1772606898 APKWSPOGIGDHOZ-DUKJBESISA-N 387.266 4.499 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3 253855531 UZRHATKYSCLMQF-YWZHVOKPSA-N 380.403 4.163 50 1 GIGF COc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587545609 RTRGHEUTOUSZJO-SIKLNZKXSA-N 396.826 4.497 50 1 GIGF CN(C)CCSSCCCC(=O)Nc1nc(-c2ccccc2)cs1 618012637 UOWXJWWIWOVCQZ-UHFFFAOYSA-N 381.592 4.472 50 1 GIGF Cc1c(O)ccc2c1[C@@](C)(CCCO[Si](C)(C)C(C)(C)C)N[C@H](C(=O)O)C2 963509531 OBNOOPUYTBYDKB-HRAATJIYSA-N 393.600 4.317 50 1 GIGF C=CC(C)(C)c1cc2cc3c(cc2oc1=O)O[C@@H](C(C)(C)OC(=O)CCl)C3 1772625603 ZAQAHCPUHFGQHG-QGZVFWFLSA-N 390.863 4.121 50 1 GIGF CC(C)[C@@H]1[C@H](O)[C@H]2C[C@@H]3[C@H]4[C@](C)(CC[C@@]13C2)[C@@H](Br)CC[C@@]4(C)O 2356469457 OLJYONZMSNKXBK-SCYLNOJRSA-N 385.386 4.370 50 1 GIGF C=C1C[C@H](OC(C)=O)[C@H](Br)C(C)(C)[C@@]12CC=C(C)C[C@@H]2OC(C)=O 13379292 UFKFDTHMWZFEOE-DWRORGKVSA-N 399.325 4.326 50 1 GIGF biogenic C[C@@]1(CC(=O)NCc2cccc(Br)c2)CC2(CCCCC2)OO1 49694684 GCBIADPPDPBDLJ-QGZVFWFLSA-N 382.298 4.269 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccccc1Cl)O2 587373582 MERJEBBIFSSVBQ-QGZVFWFLSA-N 380.669 4.486 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 587087780 UDWXKWGBGGDZSK-SCSAIBSYSA-N 375.551 4.161 50 1 GIGF O=C1/C(=N/c2ccc(F)cc2)[C@@H](Cl)C(=O)N1c1ccc(Cl)c(Cl)c1 169687472 ZSBZOQPTCBJQKU-SBGWBMIRSA-N 385.609 4.386 50 1 GIGF COc1ccc(CO[C@H]2C[C@H]3[C@@H]([C@H]2C)[C@H]2OC[C@H](C)[C@@]24CC[C@]3(C)OO4)cc1 64447306 IYCGFLNHJAQUSX-DMVSYFFZSA-N 388.504 4.141 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CBr)(C2CC2)N1 587674307 VYKJBTOEQBXTNJ-CLAHSXSESA-N 377.095 4.123 50 1 GIGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@@](CBr)(c2cncc(F)c2)N1 962938943 ATJSFIINZXLUQW-IFXJQAMLSA-N 388.284 4.265 50 1 GIGF CC1(C)CC[C@H](OC(=O)C=Cc2ccc(O)cc2)[C@]2(C)[C@@H](C=O)C(C=O)=CC[C@H]12 2356491751 OOBNDBQPMFZTTD-SEDAZVQISA-N 396.483 4.104 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2c(Br)cnc(Cl)c2[nH]1 586970881 LKBSQHQRGSGFIW-QMMMGPOBSA-N 397.498 4.235 50 1 GIGF COC(=O)[C@@]1([C@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496166 BRKBEROTFHAGET-IRLDBZIGSA-N 384.859 4.423 50 1 GIGF CCCCCCCCNC(=O)[C@@]1(C)CC(c2ccc(C)cc2)=C(C#N)C(=O)N1 1772643857 BJAMUZGHZXLJGL-HSZRJFAPSA-N 381.520 4.028 50 1 GIGF O=C(N/N=C1\C(=O)N(CCC2CCCCC2)c2ccccc21)c1ccccc1 40380321 BUNAXLWTUFPOJI-FLFQWRMESA-N 375.472 4.138 50 1 GIGF O=[N+]([O-])c1ccc([S@@](=O)c2ccc(N(CCCl)CCCl)cc2)cc1 27409449 AJMOZVPMFOZZNF-XMMPIXPASA-N 387.288 4.046 50 1 GIGF Cc1cc(NC(=O)CCl)sc1-c1nnc2sc(-c3ccccc3)nn12 28826954 UEFVCKVWJQJSDH-UHFFFAOYSA-N 389.893 4.067 50 1 GIGF Cc1cc(Cl)cc(C(=O)NNCc2ccccc2)c1NC(=O)CC(C)(C)C 103208601 LTBLLDVFSDKORW-UHFFFAOYSA-N 387.911 4.458 50 1 GIGF CCN(CC)c1nc(SC)nc2c1cnn2C[C@@H](Cl)c1ccccc1 13589893 IROGZYPJAAVIAT-OAHLLOKOSA-N 375.929 4.375 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 586970949 MRITWXUPBIJVOR-LLVKDONJSA-N 376.176 4.314 50 1 GIGF CC[C@]1([C@@H](C)Br)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587537804 KKESZACDTSLUQT-PZDGAKPMSA-N 377.234 4.286 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1nnc(-c3ccccc3)o1)CC2=O 587458407 AZYJLPSBSHSTNB-OAQYLSRUSA-N 398.846 4.494 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]2Br)N1 587687223 YITULHSMSBQIHV-ULOPGQLASA-N 377.095 4.265 50 1 GIGF CCN(Cc1ccc(C#Cc2cc(Cl)ccc2OC)s1)C(=O)CCl 587920255 BOODDEYCDVYPEA-UHFFFAOYSA-N 382.312 4.397 50 1 GIGF CCCCCN1C(=O)/C(=N\NC(=O)CC2CCCCC2)c2ccc(OC)cc21 40974531 VAXDVWBLANFEDF-FLFQWRMESA-N 385.508 4.023 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 169320639 SBCGDCBRWXAAIF-FBQXSHQRSA-N 386.488 4.398 50 1 GIGF COc1ccc(C)cc1[C@@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587371815 GGRBWBXJVZVQBZ-IBGZPJMESA-N 390.277 4.150 50 1 GIGF CCO/C(O)=C1\C(CSc2ccncc2)=NC(C)=C(C#N)[C@H]1c1ccccn1 40442351 XUNYSXMOSPLUAI-GEXZYOHASA-N 392.484 4.411 50 1 GIGF O=C(Cl)c1cc(C(=O)Cl)cc(C(=O)c2coc3cc([N+](=O)[O-])ccc23)c1 587279737 QBZSPRKDQDOATL-UHFFFAOYSA-N 392.150 4.330 50 1 GIGF CC(C)=CCO[C@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 101265181 WPACVSREXXEVRJ-PMXSJFBMSA-N 394.533 4.091 50 1 GIGF O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1coc2c(Cl)cc(Cl)cc12 73298196 HGFUMYBLSDBPJL-FBCYGCLPSA-N 378.171 4.412 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(NC(=O)CCBr)cc1 587898496 LJMFUXAOXTVKCI-UHFFFAOYSA-N 392.680 4.472 50 1 GIGF COC(=O)/C=C/c1cccc([C@@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)c1 73196329 YUPAXNZLZIMBTR-RUCTVCJSSA-N 382.419 4.244 50 1 GIGF CO[C@H]1C=C(O[Si](C)(C)C(C)(C)C)C[C@@H]2Oc3ccccc3C(=O)[C@]12C#N 170004564 IZAXZIOCCZDGLA-BBTUJRGHSA-N 385.536 4.465 50 1 GIGF CC(=O)O[C@H]1C[C@](C)(Cl)[C@@H](Br)C[C@]12C(C)(C)[C@H]1CC[C@]2(C)O1 238736953 DVONIFXCMJQOGF-ASANIRNASA-N 393.749 4.437 50 1 GIGF O=Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c[nH]1 587325434 FNAICAQGJWLSTJ-PZJWPPBQSA-N 399.805 4.165 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(N=C=S)c1 587895065 AJOWLJXXFJOFIY-UHFFFAOYSA-N 375.280 4.438 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] 103176506 XDXFIYWDJSSSPE-CVEARBPZSA-N 388.210 4.492 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)C(=O)[C@H](Br)CC3 586986742 TUEVUDCYRWHZAR-GFCCVEGCSA-N 394.224 4.044 50 1 GIGF COc1ccc(O[C@H]2O[C@@H]3O[C@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 103105752 FEPLYIUDBNDUQK-OQHLHPLBSA-N 390.476 4.282 50 1 GIGF C[C@@H]1CC[C@H]2[C@@](C)(C(=O)Sc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103188969 RLMAGUNMIOCDGD-SWVQUTDYSA-N 390.501 4.310 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N=C=O)cc2)N1 587741706 OQMNJPYUFJCVDE-VOJFVSQTSA-N 375.241 4.353 50 1 GIGF COc1ccc([C@H]2[C@@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772642951 QKYATZBPHAXODG-MSOLQXFVSA-N 388.254 4.415 50 1 GIGF O=C(N/N=C/c1ccccc1)c1ccc(C(F)(F)F)nc1NCc1ccco1 1772584054 HBXWQXDDJLESMX-BHGWPJFGSA-N 388.349 4.069 50 1 GIGF O=C(OC1CSSC1)c1cc(Br)ccc1Br 96283323 MASNRBPOSRNPNK-UHFFFAOYSA-N 384.114 4.132 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 103196263 DWAVMDSJIRPCPO-CVEARBPZSA-N 385.832 4.127 50 1 GIGF CC(C)=CCN1C(=O)/C(=N/NC(=O)c2ccc(C(C)C)cc2)c2ccccc21 1857648515 MTYUFSJLTHENBI-DARPEHSRSA-N 375.472 4.257 50 1 GIGF Cc1ccc(C(=O)C[C@@H]2C(C#N)=C(N)Oc3ccc(Br)cc32)cc1 1857649533 YYBOSIXYWXWTFB-AWEZNQCLSA-N 383.245 4.200 50 1 GIGF C[C@]12CC[C@@H]3[C@H](CCC4=CC(=O)CC[C@@]43C(=O)CBr)[C@H]1CCC2=O 253697008 AGHFYYSPGSRXOM-DSVUEQLOSA-N 393.321 4.032 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(C#N)=COc2ccc(Br)cc21 587372572 PSJLABFURHLIOU-LJQANCHMSA-N 397.228 4.000 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(C(=O)Cl)cc1 587884887 RQUYMGLMVIWRKI-UHFFFAOYSA-N 380.658 4.083 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1ccc(NC(=O)CCCCl)cc1)[C@@H](C2)C3=O 587419585 FGNFGDUZYZOBRE-HTAPYJJXSA-N 399.874 4.316 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(C(Cl)Cl)N1 587689422 SHLKSUAKGUFMOI-INWYIAFRSA-N 375.496 4.360 50 1 GIGF O=C(NNc1ccccc1)c1nc(Nc2ccccc2)nc(Nc2ccccc2)n1 653720269 NKPCGEOGNIHJPO-UHFFFAOYSA-N 397.442 4.116 50 1 GIGF CO[C@@]1(c2cc(O)ccc2O)C=C(CCC=C(C)CCC=C(C)C=O)C(=O)O1 2356356597 MOFNDUJXTNIVEF-QFIPXVFZSA-N 386.444 4.032 50 1 GIGF Cc1ccc2c([C@@]3(CCl)N[C@H](C(=O)O)Cc4cc(F)ccc43)c(C)[nH]c2c1 962898884 PDRIYBFOHVVZCB-RXVVDRJESA-N 386.854 4.005 50 1 GIGF Cc1ccc(C2=C(C#N)C(=O)N[C@@](c3ccc(N(C)C)cc3)(C(F)(F)F)C2)cc1 1772593898 QPVBOLUSJHWRPQ-NRFANRHFSA-N 399.416 4.316 50 1 GIGF COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]3C[C@H]4OO[C@@]3(C=C4C(C)(C)OO)CC[C@H]21 2356765308 JTMNVWQNMNACAS-XNLMUQHUSA-N 380.481 4.050 50 1 GIGF CC(=O)OC/C=C(/CCl)CC[C@H](Br)C(C)(C)Br 1638721 CGRDTJCHEFNOHQ-RUYJGKKWSA-N 390.543 4.432 50 1 GIGF CC(C)=CCO[C@@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 38148268 WPACVSREXXEVRJ-VMXMFDLUSA-N 394.533 4.091 50 1 GIGF CC(=O)C1=NN(c2ccccc2)/C(=C(\C#N)C(=O)c2c[nH]c3ccccc23)S1 40602301 CDYBDPUFLZWGRL-PGMHBOJBSA-N 386.436 4.242 50 1 GIGF C[C@H](c1ccc(CBr)cc1)c1nc2ccc(S(C)(=O)=O)cc2[nH]1 586972968 DNHFRUAKUHIIRW-LLVKDONJSA-N 393.306 4.013 50 1 GIGF O=C(CCl)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2ccc(Cl)cc2[nH]1 587009742 PZRHMGXHPXOCRT-KRWDZBQOSA-N 387.270 4.336 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2ccc(Br)c(F)c2[nH]1 586971058 LGJSLKCECLDNHU-SNVBAGLBSA-N 380.055 4.326 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCl)c1ccc(O)cc1 587543459 KNQSZMXNLZVWEH-WIYYLYMNSA-N 382.799 4.194 50 1 GIGF CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1Cl 587327886 HZTZXISCFQCGMB-IZBJGVDFSA-N 376.811 4.045 50 1 GIGF COc1cc2c3c(c1)O[C@@]1(C[C@H]4CC[C@@]1(CBr)C4(C)C)[C@@H](C2)C3=O 587414398 VAZOCJSMJLMQHP-MLGOKKRCSA-N 391.305 4.403 50 1 GIGF Cn1cccc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587326543 LVVAEQWABRPGJT-CTNGQTDRSA-N 385.822 4.363 50 1 GIGF COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)([C@@H](C)Br)[C@@H](C2)C3=O 587415523 UJNNDPPWXHHJDF-ADYAMRHXSA-N 387.273 4.430 50 1 GIGF O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@@H]1Br 40420247 YZSQCBLLDFMPON-LCWDIZFYSA-N 381.122 4.493 50 1 GIGF O=C1c2ccc(O)cc2OC2(CC(Br)C2)[C@H]1c1ccc(F)cc1 587325543 YPFMSTCNUXFFOX-DTBJDSCCSA-N 377.209 4.186 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)([C@H](C#N)c1nc(C)cs1)CC2=O 587493447 HOLJPPTTZDSIFD-AUUYWEPGSA-N 390.892 4.360 50 1 GIGF COc1ccc([C@@H]2[C@@H](C)C(=O)C[C@@H](c3ccc(F)cc3)N2C(=O)CCl)cc1 169352126 RXXAPBCIJIFNMW-FPSMJMQUSA-N 389.854 4.293 50 1 GIGF COc1ccc(/C=N/NC(=O)c2ccc(-c3nc4cccc(C)c4[nH]3)cc2)cc1 299827525 KQAGLGIEYWCRFU-ZVHZXABRSA-N 384.439 4.311 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)cc1F)O2 587386613 VMCAXVMGPLDHTK-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF COc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 587545605 RTRGHEUTOUSZJO-DENIHFKCSA-N 396.826 4.497 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(-c2ccc(C(=O)NN)s2)cc1 587920650 KTWLCBZCEGSYJG-UHFFFAOYSA-N 382.872 4.080 50 1 GIGF CC1(C)C[C@@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 100234801 CWCXONZIEDNVKI-FBABHZFISA-N 399.325 4.010 50 1 GIGF in-vitro COc1ccnc2ccc(/C=N/NC(=O)CCn3cc(C)c4ccccc43)cc12 115599008 WYZGVSOECUWAIG-AFUMVMLFSA-N 386.455 4.047 50 1 GIGF COc1ccc([C@]2([C@@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 587375494 SWOSJJJKNUTLAL-CWTRNNRKSA-N 390.277 4.230 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccsc2CC[C@@H]1Br 587414561 NAMYMKISRXBPJZ-RDJZCZTQSA-N 378.291 4.209 50 1 GIGF N#CC(C#N)=C1C(=O)c2ccccc2[C@]12NCCc1cccc(-c3ccccc3)c12 962659361 CCIOVCWHCIDEAH-AREMUKBSSA-N 387.442 4.283 50 1 GIGF COc1cccc2c3c(cnc12)CCN[C@@]3(CCl)c1c[nH]c2ccc(F)cc12 963060811 XCOSQFLILOTGQB-QFIPXVFZSA-N 395.865 4.492 50 1 GIGF CCOC(=O)C1=C(O)C[C@@H](c2ccccc2)N(C(=O)CCl)[C@@H]1c1ccccc1 100078271 OLZUOULUTZTBDG-LAUBAEHRSA-N 399.874 4.315 50 1 GIGF CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H]1Cl 587542660 ATFXVTGBTQWMKE-NNNWTRQLSA-N 388.847 4.287 50 1 GIGF COc1ccc(N(C)c2ccnc(Cl)n2)cc1OCCCBr 1857646153 URHHNPKGDWWCEI-UHFFFAOYSA-N 386.677 4.070 50 1 GIGF O=CC1=C(Cl)[C@H]([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCC1 587555234 ZKQCODYJQZDHKX-FNXXIHLHSA-N 384.815 4.214 50 1 GIGF CCOC(=O)/C(C#N)=C\Nc1ccc(C#Cc2cc(Cl)ccc2OC)cc1 587906887 XYDFBNKGSDXGOE-VKAVYKQESA-N 380.831 4.131 50 1 GIGF CCc1ccc(CC)c([C@@]2(CCl)N[C@H](C(=O)O)Cc3cccc(F)c32)c1 962903218 WLYJCAYZJJKUJO-GHTZIAJQSA-N 375.871 4.032 50 1 GIGF Cc1sc2c(c1C)CCN[C@@]2(CCl)[C@@H](NC(=O)OC(C)(C)C)C(C)C 963014740 UXMQWWSYAMWATN-KXBFYZLASA-N 386.989 4.494 50 1 GIGF COC(=O)C=C(CC[C@@H]1C(C=O)=CC[C@H]2C(C)(C)CCC[C@@]12C)COC(C)=O 2356427552 DWQLMTINEJBFII-QTEQDKRBSA-N 390.520 4.407 50 1 GIGF C#C/C=C/C/C(Br)=C1\C[C@H]2O[C@@H](CC)[C@H](Br)C[C@H]2O1 238760064 OGLSYOBOMBXPEB-HQIVVVIQSA-N 390.115 4.292 50 1 GIGF C=C1[C@H](C)C[C@H](OC(=O)C=Cc2ccccc2)[C@]2(C)[C@@H](C=O)C(C=O)=CC[C@H]12 2356437411 RIGSJIIZCIKSKY-QPWVLVGYSA-N 378.468 4.174 50 1 GIGF COc1cc(C(=O)N/N=C/c2ccc(-c3ccc(C)c(Cl)c3)o2)ccc1O 13864056 JEZLJEFWKHUIFU-SSDVNMTOSA-N 384.819 4.387 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1cccs1)CC2=O 587495734 SFXHMQRFFRMWND-ARKBFRDHSA-N 382.485 4.236 50 1 GIGF COc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587545610 RTRGHEUTOUSZJO-UGKGYDQZSA-N 396.826 4.497 50 1 GIGF COc1ccc(/C=C/C(=O)Nc2cc(N)c3ccccc3c2CCCl)nc1 28521421 KWXIPUIWHSDRBU-VQHVLOKHSA-N 381.863 4.259 50 1 GIGF C[C@]1([C@H](Br)Cc2ccc(F)cc2F)NCCc2ccc(O)cc21 963341970 PGFVAAARXMVJTQ-MSOLQXFVSA-N 382.248 4.038 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cccc(Cl)c1)O2 587372619 JYBLCYHUGQLJJK-KRWDZBQOSA-N 380.669 4.486 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CSC#N)(c1ccc(OC)cc1)CC2=O 587493074 QHJWDBWKEACRBV-NRFANRHFSA-N 383.469 4.428 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CBr)CC1CC1 587539773 YCAVLHWLXFJORH-VQIMIIECSA-N 389.245 4.288 50 1 GIGF CC[C@H]1O[C@@H]2C[C@@H](C=C=CBr)O[C@@H]2C/C=C\C[C@@H]1Br 14560137 MFIOGNKPHIMUQN-YJNXAUKYSA-N 392.131 4.485 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)c(C)c1)[C@@H](C2)C3=O 587415761 WVULMXFDOXIKQD-OXJNMPFZSA-N 387.273 4.350 50 1 GIGF CC(C)[C@@]1(CBr)N[C@@H](C)Cc2cc(Br)c(F)cc21 587674279 VTCATSSIECJJRH-LKFCYVNXSA-N 379.111 4.369 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCl)COc1ccccc1 587543159 JQLXBFNKRIIIHY-KNQAVFIVSA-N 396.826 4.410 50 1 GIGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@]2(N1)C(C=O)=COc1ccc(Cl)cc12 962950569 NRYSCDAGRYHCQH-IVZQSRNASA-N 378.859 4.464 50 1 GIGF O=C(Cn1c(-c2ccco2)nc2ccccc21)N/N=C/c1ccccc1Cl 1857749823 HANHPGKXCXGDBE-WSDLNYQXSA-N 378.819 4.100 50 1 GIGF CCOc1ccccc1[C@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587374152 OHUWWPFUHWOCCG-LJQANCHMSA-N 390.277 4.232 50 1 GIGF Cc1[nH]nc2c1[C@@](c1cc(Cl)cc(Cl)c1)(C1CCC1)C(C#N)=C(N)O2 1777699090 SPNNZCKKJSFKKB-GOSISDBHSA-N 375.259 4.197 50 1 GIGF CC(=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@@H]4C(C=O)=CC[C@@H]23)O1)CO 2356324321 IXOCIELJWNTVCH-GSTJTDTKSA-N 398.543 4.186 50 1 GIGF O=C(CCCl)Nc1ccc(SCC(=O)Nc2cc(Cl)ccn2)cc1 96908526 VSSRMATWRWBTEZ-UHFFFAOYSA-N 384.288 4.033 50 1 GIGF COc1ccc(C(=O)CSc2nc(C)c(C)n2Nc2ccc(OO)cc2)cc1 103243306 JPHCLECZLRYMJK-UHFFFAOYSA-N 399.472 4.211 50 1 GIGF CC(C)[C@H]1[C@H]2C[C@@H]3[C@H]4[C@@](C)(O)CC[C@@H](Br)[C@]4(C)CC[C@@]13C[C@H]2O 238743144 DUDYIHSAQAOWKR-RVBLSUJCSA-N 385.386 4.370 50 1 GIGF CCCN1[C@H](C)Cc2ccccc2[C@]1(CBr)c1cccc(OC)n1 963237691 YXXGGXIORTYJHY-FOIQADDNSA-N 389.337 4.385 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@H]1c1ccc(F)cc1 1857590338 ALWFMQDMXPLYSU-SFHVURJKSA-N 383.382 4.451 50 1 GIGF CN(C(=O)Cc1cccc(N=C=S)c1)[C@H](CN1CCCC1)c1ccccc1 13738410 AQNKJLVANZELEX-OAQYLSRUSA-N 379.529 4.259 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cc(F)ccc1F)[C@@H](C2)C3=O 587424993 ZRPCWQNQUPFLIL-SCLBCKFNSA-N 395.199 4.011 50 1 GIGF CC[C@]1([C@H](C)Br)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587537801 KKESZACDTSLUQT-BKGUAONASA-N 377.234 4.286 50 1 GIGF CCOc1ccc([C@]2([C@H](C)Cl)NC[C@@H]3CC(=O)N(C)c4cccc2c43)cc1 963033859 VLMXLRWJZAOZAB-DFFLPILJSA-N 384.907 4.010 50 1 GIGF CO[C@]1(c2cc(O)ccc2O)C=C(CCC=C(C)CCC=C(C)C=O)C(=O)O1 2356356596 MOFNDUJXTNIVEF-JOCHJYFZSA-N 386.444 4.032 50 1 GIGF COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CC[C@]13C=C(C(C)(C)OO)[C@H](C[C@H]21)OO3 238751972 JTMNVWQNMNACAS-DETUAXERSA-N 380.481 4.050 50 1 GIGF COc1cc(Cl)cc(OC(=O)c2cc3cc(CCl)ccc3oc2=O)c1 13676432 WCJKRWAUTJKTJU-UHFFFAOYSA-N 379.195 4.413 50 1 GIGF COc1cccc(-c2ccc(-c3nc4ccc(C(=O)NN)cc4[nH]3)c(Cl)c2)c1 587052233 LFSWOGBPTRDTMP-UHFFFAOYSA-N 392.846 4.162 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1c(CCl)c(C#N)c4ccccn14)[C@@H](C2)C3=O 587421444 MDXGVBCHEAZFRC-YEJXKQKISA-N 378.815 4.047 50 1 GIGF Nc1ccc([C@@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587497603 DATOCLPUDGOQPO-FQEVSTJZSA-N 386.289 4.403 50 1 GIGF CC(=O)NN=C1CC[C@@H]2[C@@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@@]12C 2356581755 JTSYJYALWDMECW-SZKCUPFNSA-N 388.552 4.453 50 1 GIGF CC(C)(C)[Si](C)(C)O[C@H]1CCCO[C@@H]1COCC(=O)OCc1ccccc1 195285369 ICCGIVAKYLYPPM-RBUKOAKNSA-N 394.584 4.316 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CC(C)C)([C@H](Cl)C(=O)OCC)CC2=O 587459735 PGGUDTQBNWPPHU-QUCCMNQESA-N 382.884 4.265 50 1 GIGF CCCCNc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc(OC)cc(OC)c1 38153944 GDHWOXGCFPEPAF-OAQYLSRUSA-N 379.460 4.134 50 1 GIGF O=C(O)[C@@H]1Cc2c(Cl)cc(F)c(F)c2[C@@](CCCl)(c2cccs2)N1 962998179 SKTSMGCZTYITKE-MEDUHNTESA-N 392.254 4.151 50 1 GIGF O=C(CCCC[C@@H]1CCSS1)N1CCN(CCCc2ccccc2)CC1 95582731 SISJAACCMAHCII-HXUWFJFHSA-N 392.634 4.478 50 1 GIGF C[C@@]12C=CC(=O)[C@H]1C1=C(CC2)[C@]2(CCl)C(=CC1=O)C=C[C@H](Cl)[C@H]2Cl 96085376 OFMUBMLCGMAWGO-GJQMJKEGSA-N 383.702 4.357 50 1 GIGF in-vitro C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(O)cc2)N1 587685340 PTFDJKWYDMQRQN-BMLIUANNSA-N 384.676 4.310 50 1 GIGF COc1cc(/C=N/NC(=O)Nc2cccc3ccccc23)cc(OC)c1OC 53313942 PQAHVZAHQQQERA-LPYMAVHISA-N 379.416 4.021 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(NC(C)=O)cc1)CC2=O 587460700 OVPYJBAQXXPPAO-OAQYLSRUSA-N 387.863 4.403 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CBr)C1CCC1 587537570 HWNQIIUFWCIBDK-VQIMIIECSA-N 389.245 4.288 50 1 GIGF CN(C)NC(=O)c1ccccc1Nc1ccc2c(/C=C/c3ccccn3)[nH]nc2c1 1772615336 QAVBQOUOCLRCLO-ACCUITESSA-N 398.470 4.078 50 1 GIGF COc1ccc([C@H]2O[C@]34C[C@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 96933994 JKVGVXPPLHTQLQ-LUGPXAIHSA-N 378.424 4.256 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] 103189207 OZFLQFKFMRZOMP-CVEARBPZSA-N 385.832 4.127 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cc(F)ccc1F)O2 587382361 QBGLJMHDQCWPEM-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF O=C(Nc1cc2c3c(cccc3c1)C(=O)OC2=O)c1cccc(C(F)(F)F)c1 95584926 VCOUDHUSWPBJGO-UHFFFAOYSA-N 385.297 4.422 50 1 GIGF CC1=CC[C@@H]([C@@](C)(Cl)CCl)O[C@@H]1C(Br)Br 138783309 FVPHWLFPVMYUFV-NRPADANISA-N 380.935 4.442 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(CC(=O)O)s1)CC2=O 587495199 PSTRZOMQVHLIIM-IBGZPJMESA-N 394.876 4.133 50 1 GIGF O=C(O)CCC/C=C\C[C@@H]1[C@H](Cl)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)C1CCCCC1 3775819 ZOQXTNLUBHPZOZ-SZPSZWKHSA-N 384.944 4.289 50 1 GIGF in-vitro CC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@]4(O)C(C=O)=CC[C@@H]23)O1 96927592 MNTJKNWRCITJMY-CAASVOSTSA-N 398.543 4.328 50 1 GIGF CCN[C@@H](c1ccc(/C=C/C#N)cc1)c1ccnc(Nc2ccc(C#N)cc2)n1 169350579 QZFYMKGTWBSIIP-SIAOZKNOSA-N 380.455 4.328 50 1 GIGF Fc1c([C@@]2(CBr)NCCc3cccc(Cl)c32)ccnc1Cl 963377641 CQEXDHWKCQLGAQ-OAHLLOKOSA-N 390.083 4.312 50 1 GIGF N#Cc1ccc([C@@H]2[C@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772609148 OLHLJZLZSVHXKP-ZWKOTPCHSA-N 383.238 4.278 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cscn2)N1 587853045 KNKXQKJMTOCZHA-CLAHSXSESA-N 375.694 4.061 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(Br)c(F)cc2[nH]1 586971046 KXKGVLFJIPESJL-SNVBAGLBSA-N 380.055 4.326 50 1 GIGF Cn1cccc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587326547 LVVAEQWABRPGJT-FPOVZHCZSA-N 385.822 4.363 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CBr)(c1nccs1)CC2=O 587495095 NGRMAEVEJWRFKG-MRXNPFEDSA-N 382.279 4.057 50 1 GIGF Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1cccc(OC(F)(F)F)c1 1857571330 KFZLUWKRJQQXEI-LSFURLLWSA-N 386.757 4.076 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(C)c(Br)cc2[nH]1 586970893 LTHQDADVLMTPAC-NSHDSACASA-N 376.092 4.495 50 1 GIGF COC(=O)C1=C(Cc2ccccc2)NC(C)=C(C#N)[C@H]1c1ccccc1Cl 62224678 MGFCKVJJCBNEQH-HXUWFJFHSA-N 378.859 4.494 50 1 GIGF COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl 587376317 RUYMFJUUDHWBHN-OAQYLSRUSA-N 389.879 4.474 50 1 GIGF O=C1C[C@@](CBr)(C2CCOCC2)Oc2c1ccc1c2CCCC1 587497405 CHNLJKVXWLHTMV-LJQANCHMSA-N 379.294 4.091 50 1 GIGF CC(C)N(C(=O)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3)C(C)C 43552620 DBLPKTHESYVJFB-UHFFFAOYSA-N 392.540 4.148 50 1 GIGF CN(C)C[C@H](Br)c1ccc(Br)c(Br)c1 169345660 OCKZIWPUWODXOH-JTQLQIEISA-N 385.925 4.209 50 1 GIGF CC(=O)[C@H](Br)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 586984658 NUAYITGUDOWZGI-SFHVURJKSA-N 382.213 4.177 50 1 GIGF C[C@H](Br)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587322432 MJCDRGGGNMIKAG-MENVHETRSA-N 379.225 4.432 50 1 GIGF COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl 587376315 RUYMFJUUDHWBHN-NRFANRHFSA-N 389.879 4.474 50 1 GIGF CC(C)[C@@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539437 WJIYLLSREKNPAF-CRAIPNDOSA-N 377.234 4.144 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1NC(=O)CCCCl)O2 587373298 CPJBNSDDZQJMQB-NRFANRHFSA-N 386.879 4.415 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)([C@H](C)Br)[C@@H](C2)C3=O 587415524 UJNNDPPWXHHJDF-APXLUKDGSA-N 387.273 4.430 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(CN(C)C(=O)[C@H](C)Cl)cc1 587905875 LJSMNLPMYAKNLI-AWEZNQCLSA-N 376.283 4.334 50 1 GIGF CO[C@H]1O[C@@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@@]13OO2 14293495 JYSURLKCEQBUMV-KZEVZHLLSA-N 380.456 4.348 50 1 GIGF [C-]#[N+]C(=C\c1ccc(OC)cc1)/C(=C/c1ccc(OS(=O)(=O)O)cc1)[N+]#[C-] 72110830 AFDVXUYMZKBPPT-BKHHGCLFSA-N 382.397 4.097 50 1 GIGF in-vitro COc1ccc(-c2nn(C[C@H](Cl)c3ccccc3)c3ncnc(N)c23)cc1 473135969 LZFMMPRNKIQRAF-INIZCTEOSA-N 379.851 4.064 50 1 GIGF COc1c(Cc2cccc3ccccc23)cc(O)n1-c1ccnc(CCl)n1 587941513 VQBXIKCVJMYVSZ-UHFFFAOYSA-N 379.847 4.464 50 1 GIGF CC(C)=CCO[C@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 38148267 WPACVSREXXEVRJ-WJMWBRGCSA-N 394.533 4.091 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1cc(F)cc(CBr)c1)[C@@H](C2)C3=O 587428673 NXYYYDAOSMNTTR-KSSFIOAISA-N 377.209 4.218 50 1 GIGF COc1ccc(OC)c2c1C[C@@H](C)N[C@]2(CBr)c1ccc(F)cc1 963576890 AWYSKBOBGBBMNV-CWTRNNRKSA-N 394.284 4.016 50 1 GIGF CCN(C)C(=O)Oc1cccc(CNC(=O)CCCC[C@@H]2CCSS2)c1 1857631714 JUAVIZNHBLORJY-QGZVFWFLSA-N 396.578 4.467 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2Br 587543537 KTDXELDQKBBWHD-GJYPPUQNSA-N 389.245 4.430 50 1 GIGF Oc1noc(C2CCNCC2)c1[C@@H](Br)c1ccc2ccccc2c1 28636778 ONIHNTIPKYMTGW-KRWDZBQOSA-N 387.277 4.485 50 1 GIGF C=CCOCC1=C(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 103186125 QKHCAXSCTSSTJA-ZCQAHWFZSA-N 390.398 4.251 50 1 GIGF C[C@H](Cl)C(=O)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587495857 ALKGMFXWOKISHM-NPMXOYFQSA-N 397.902 4.170 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(C(Cl)Cl)N1 587689447 SMVLAUJDDRMUPI-PWCHPLFNSA-N 375.496 4.360 50 1 GIGF O=C(N/N=C/c1cccs1)c1cc(Cl)ccc1C(=O)NC1CCCCC1 103204029 BBJSSSCFQISVKA-CIAFOILYSA-N 389.908 4.228 50 1 GIGF Cc1oncc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587330066 ZZRIINUQRDDZHO-UYAOXDASSA-N 387.794 4.321 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1F)([C@@H](C)Br)O2 587384802 IZJJHQOVKMNEAX-ZMZPIMSZSA-N 378.241 4.360 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O 587421902 BAKWGEZTYWZHBF-LIRRHRJNSA-N 391.236 4.181 50 1 GIGF COc1cccc2cc3c(nc12)[C@@](C1CCC1)([C@H](C)Br)NCC3 963059304 QNLATALVBKMKPL-BUXKBTBVSA-N 375.310 4.168 50 1 GIGF N#CC(=C\c1ccccc1)/C=C1\SC(=S)N(c2ccc(C(=O)O)cc2)C1=O 103228432 ZBVAHOHTTWJWCD-HRBPJWPPSA-N 392.461 4.241 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)C(CO)=CC[C@H]12 86033609 MXJNOJNIEWXXFS-XFMPKHEZSA-N 396.163 4.047 50 1 GIGF CC1(C)CC[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O 95592040 OOBNDBQPMFZTTD-TWEQYNAUSA-N 396.483 4.104 50 1 GIGF Cc1ccc(/C=N\NC(=O)[C@H](C)Oc2cc(Cl)c(Cl)cc2Cl)o1 103188063 XETQVIWYDFNDKX-UPPWUEATSA-N 375.639 4.466 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@@H]2Br)N1 587687221 YITULHSMSBQIHV-NFMODRRSSA-N 377.095 4.265 50 1 GIGF CC(C)c1ccccc1OS(=O)(=O)c1cccc(NC(=O)CCCl)c1 1857649790 AALCKTYCVCKTGE-UHFFFAOYSA-N 381.881 4.145 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccccc1F)([C@H](C)Br)[C@@H](C2)C3=O 587426746 POOJCHPPTVZWLZ-KDDHCUDTSA-N 391.236 4.261 50 1 GIGF C[C@]1(CCCBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539723 XWLSJRCPSPMUQP-CRAIPNDOSA-N 377.234 4.288 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C#N)=COc1ccccc12 587738985 FHNSJGJFNFUVSP-NSPYISDASA-N 385.236 4.166 50 1 GIGF Cn1cccc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587326549 LVVAEQWABRPGJT-PZJWPPBQSA-N 385.822 4.363 50 1 GIGF CC(=O)[C@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C[C@](O)(CCl)[C@]12C 2356384222 LSUMZADQUYYJTQ-ASISCSHQSA-N 378.940 4.303 50 1 GIGF Cc1ccc(-c2cc(C(=O)N/N=C\c3cnn(C)c3C)c3ccccc3n2)cc1C 15989769 XMYMSJOTLQWCPD-MXAYSNPKSA-N 397.482 4.324 50 3 GIGF C=CCC[C@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539304 VGLKGXCSVHWPKG-VQIMIIECSA-N 389.245 4.454 50 1 GIGF CC=C(C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@]2(O)[C@H](Cl)CC[C@H](C)[C@]12C 2356565016 LIIUXOSINVLFRM-AFHQPIGPSA-N 380.868 4.110 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4nccc(Cl)c14)[C@@H](C2)C3=O 587419367 CKWIHIRDTBAAMX-WLRWDXFRSA-N 389.238 4.107 50 1 GIGF CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c1coc2ccc(Cl)cc2c1=O 28645857 PYAUFXBOLVZMOV-UHFFFAOYSA-N 398.846 4.032 50 1 GIGF CC[C@H]1O[C@H]2CC=CC[C@H](C=C=CBr)O[C@H]2C[C@@H]1Br 38841895 IYISXRFGBKUBQG-CPMYSYMXSA-N 392.131 4.485 50 1 GIGF Cc1ccccc1N/C=C1\C=C2C(=CC1=O)OC(N)=C(C#N)[C@@H]2c1ccccc1 100557519 XZRTXHDBPKMTFN-AKXFXYSNSA-N 381.435 4.192 50 3 GIGF CC[Si](O)(C#C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@@]21C)CC 195479226 OCDNSBRYQPEECT-URYYLNOGSA-N 398.619 4.500 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3ccon3)c1C)O2 587374342 XAVPLDLGPPHGAA-FQEVSTJZSA-N 385.851 4.072 50 1 GIGF CS(=O)(=O)/C(C#N)=C/c1cc(Cc2ccc(OC(F)(F)F)cc2)ccc1F 1857588069 MPYGEJWEVAGQKB-MHWRWJLKSA-N 399.365 4.224 50 1 GIGF CC(=O)SCC[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 587844577 LOUWEQBIHMILFZ-BJOHPYRUSA-N 394.737 4.226 50 1 GIGF Cc1ccnc2c1CCN[C@]2(c1cc(C)n(Cc2ccco2)c1C)[C@H](C)Cl 963084547 DYDTZAIPNYCRCR-JTSKRJEESA-N 383.923 4.466 50 1 GIGF CC1(C)CCC[C@]2(C)[C@@H](C=O)C(C=O)=C(OC(=O)C=Cc3ccc(O)cc3)C[C@H]12 2356705163 YVIMZBRWYFADCK-XZDHIHRUSA-N 396.483 4.453 50 1 GIGF CC1(C)CC(=O)c2cc(C(=O)NN(C(=O)c3ccccc3)C(C)(C)C)ccc2O1 28645831 OIHZWAWZWVWCTB-UHFFFAOYSA-N 394.471 4.016 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(C(=O)O)cs1)CC2=O 587494717 NLHRDLUFTKHTTD-GOSISDBHSA-N 380.849 4.204 50 1 GIGF O=C(CCCl)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 587496755 FLGHAIKCVYMJPD-HSZRJFAPSA-N 397.902 4.171 50 1 GIGF Clc1ccc([C@H](Cl)Cn2ncc3c(NCc4ccncc4)ncnc32)cc1 71319425 LHXWTIIFWARQLP-QGZVFWFLSA-N 399.285 4.467 50 1 GIGF CCCNc1nc(SC)nc2c1cnn2C[C@@H](Cl)c1ccc(F)cc1 40980253 PLGTYHJNZDEORQ-CQSZACIVSA-N 379.892 4.489 50 1 GIGF CCOC(=O)C1=C(c2ccc3c(c2)OCO3)Nc2cc(OC)ccc2[C@@H]1Cl 49112379 RQSZGXHMBDBMBB-SFHVURJKSA-N 387.819 4.104 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2c(Br)cnc(Cl)c2[nH]1 586970877 LKBSQHQRGSGFIW-MRVPVSSYSA-N 397.498 4.235 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CBr)C1CCC1 587537569 HWNQIIUFWCIBDK-QFBILLFUSA-N 389.245 4.288 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCC(Br)CC2 587545363 RBQXHBFHCNQCTR-CHLGFOLGSA-N 389.245 4.430 50 1 GIGF COCCCN1CCc2ccc(OC)cc2[C@]1(C(C)C)[C@@H](C)Br 961321637 KCXGARHINWPQFR-BEFAXECRSA-N 384.358 4.225 50 1 GIGF CCOC(=O)/C(C#N)=C\Nc1ccc2ncnc(Nc3ccc(Cl)cc3)c2c1 95601766 UVMNWAMWKQHBBI-QBFSEMIESA-N 393.834 4.409 50 1 GIGF COc1ccc([C@H]2O[C@]34C[C@@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 96933993 JKVGVXPPLHTQLQ-VAFVZNMKSA-N 378.424 4.256 50 1 GIGF CCOC(=O)C1=C(O)C[C@H](c2ccccc2)N(C(=O)CCl)[C@@H]1c1ccccc1 100078269 OLZUOULUTZTBDG-DYESRHJHSA-N 399.874 4.315 50 1 GIGF CC(C)[C@@H]1C[C@H](O)[C@H]2C[C@@]13CC[C@]1(C)[C@H](Br)CC[C@](C)(O)[C@@H]1[C@@H]23 2356573702 XIMOIAZZHIMGIZ-WQAOWFNKSA-N 385.386 4.370 50 1 GIGF CC(C)[C@H]1C[C@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O 140402378 BDIHJSNVMBYIDA-XKZGAYRXSA-N 385.386 4.370 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@H](C#N)c1nc3ccccc3s1)O2 587415759 WVRXFPYDACGLFD-ZUOKHONESA-N 397.887 4.437 50 1 GIGF COc1ccc([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)[C@]23C(=O)Nc2ccccc23)cc1 169348684 RKOHEHFJHHLACC-WSUBETFTSA-N 397.478 4.145 50 1 GIGF CC(C)[C@@H]1C[C@H](O)[C@H]2C[C@@]13CC[C@@]1(C)[C@H]([C@@H]23)[C@@](C)(O)CC[C@H]1Br 2356573703 XIMOIAZZHIMGIZ-ZEYKNQPMSA-N 385.386 4.370 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(C(=O)Cl)c1ccc(F)cc1 587573736 XCIWTDWDPCOOEU-UWJYYQICSA-N 398.773 4.154 50 1 GIGF COc1ccc([C@]2(C(F)(F)F)CC(c3ccc(C)cc3)=C(C#N)C(=O)N2)cc1 1772634054 JWJSLVALDGJEQA-FQEVSTJZSA-N 386.373 4.259 50 1 GIGF CCO[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2N(CCCl)C1=O 26162317 MSHMORPBEMXHDK-GOSISDBHSA-N 377.271 4.125 50 1 GIGF Cl[C@@H](Cn1ncc2c(NCCc3ccccc3)ncnc21)c1ccccc1 40405566 FSEASSKBJKLGGN-IBGZPJMESA-N 377.879 4.461 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(C2CCOCC2)[C@H]1c1ccc(F)cc1 587325038 BQUSEKLCEXCKES-PZJWPPBQSA-N 390.838 4.294 50 1 GIGF COc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1CCl 587882950 PBWSVZYIDIIXSZ-UHFFFAOYSA-N 396.701 4.451 50 1 GIGF COc1cc2c3c(c1)O[C@@]1([C@@H](C2)C3=O)[C@H](Br)[C@H]2CC[C@@]1(C)C2(C)C 587416893 GADGSAZQNCDXGZ-BKDLZKTMSA-N 391.305 4.401 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(NC(C)=O)cc1)CC2=O 587460699 OVPYJBAQXXPPAO-NRFANRHFSA-N 387.863 4.403 50 1 GIGF Cc1nc(C)c([C@@]2(CCl)N[C@@H](C)Cc3cc(Br)c(F)cc32)o1 587683419 HAMVRJHAQFEWGE-PWJLMRLQSA-N 387.680 4.210 50 1 GIGF C=C1C(=O)O[C@@H]2C=C(C)CC=C[C@](C)(OO)CCC=C(C)[C@@H](OC(C)=O)C[C@@H]12 2356799331 UIRWAUSAMAORJV-KEZQHZCBSA-N 390.476 4.287 50 1 GIGF COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C/c3ccc(C)cc3)nc2c1 587188214 PPGCGABJGVPCSA-VGOFMYFVSA-N 396.244 4.485 50 1 GIGF COc1cc2c3c(c1)O[C@](c1cccs1)([C@@H](C)Br)[C@@H](C2)C3=O 587451949 PMPHHZULGVSZAB-CIBPLQMKSA-N 379.275 4.183 50 1 GIGF O=C(CNc1cccc(Oc2ccccc2)c1)N/N=C1\CCCc2cnccc21 1772633085 BGAIRMZDXXRYGH-XTCLZLMSSA-N 386.455 4.143 50 1 GIGF CCC/C(=N\NC(=O)c1ccc(CSc2nncn2C)cc1)c1ccccc1 4984986 NHDHHMGCKLJKGH-FCDQGJHFSA-N 393.516 4.042 50 3 GIGF CC(C)(C)c1ccc(O)c(/C=N/NC(=O)c2ccc(Br)cc2)c1 49072675 AWCSIZOJVBXNAJ-RGVLZGJSSA-N 375.266 4.216 50 1 GIGF CC(C)[C@@H]1C[C@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O 140402202 BDIHJSNVMBYIDA-VHXYLUBJSA-N 385.386 4.370 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12c1ccccc1C[C@@H]2Cl 587550968 WQWSKRWPSGWGBF-CNNODRBYSA-N 378.811 4.413 50 1 GIGF COC(=O)c1sc(CBr)cc1NC(=O)Nc1ccc(C)cc1 26672261 PEADCOWIDLRFLC-UHFFFAOYSA-N 383.267 4.382 50 1 GIGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 95808919 XZUGUAXDLGBMQA-HAVVHWLPSA-N 382.460 4.443 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1oc3ccccc3c1NC(=O)CCl)O2 587373828 TVTYGVRPJMMTED-OAQYLSRUSA-N 398.846 4.381 50 1 GIGF CCc1c(C)[nH]c2c1/C(=N/NC(=O)Nc1cccc([C@@H]3CCCN3)c1)CCC2 38149910 ZMZUJYHRKQZODP-IBGRPIGGSA-N 379.508 4.172 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(C)c(F)c1)O2 587381660 KWKZIZJDTZQLGD-SFHVURJKSA-N 378.241 4.280 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C#N)=COc1ccccc12 587738984 FHNSJGJFNFUVSP-JEOXALJRSA-N 385.236 4.166 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 43380056 WDTIPJZJXSSSGU-MEOKCCQFSA-N 391.895 4.288 50 1 GIGF C[C@@H]1CC[C@@H]2CC(=O)N(CCCc3ccccc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 195310707 IGHHGSMGNAAZGN-RDYYDRBJSA-N 385.504 4.067 50 1 GIGF C=C(C)[C@@H](CC/C(C)=C/COc1c(OC)cc(/C=C/CO)cc1OC)OO 137701826 NEONTBMZDXWQFB-IFKPDFOSSA-N 378.465 4.249 50 1 GIGF CCOC(=O)[C@H](Cl)[C@@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 587494775 ABWPWTFMCCAAMB-PZJWPPBQSA-N 378.896 4.486 50 1 GIGF CCOC(=O)c1cc(N=CC(C#N)=C(O)OCC)c2ccc(OC)c(OC)c2c1 1857743054 WJEGIHQZGQUQQX-UHFFFAOYSA-N 398.415 4.066 50 1 GIGF Cn1ccnc1[C@@]1(CCl)c2ccccc2CCN1[C@@H](C#N)c1ccccc1 963199771 DAPUUZPHSHULLO-RBBKRZOGSA-N 376.891 4.025 50 1 GIGF COC(=O)[C@@H](Br)c1cccc(C#Cc2cc(Cl)ccc2OC)c1 587898865 SURLMMRMOZFHTI-KRWDZBQOSA-N 393.664 4.357 50 1 GIGF COC(=O)c1ccc(C#Cc2cc(Cl)ccc2OC)cc1CBr 587898952 UXFADLINCHMGSI-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF CCOC(=O)/C(C#N)=C/Nc1ccc(C#Cc2cc(Cl)ccc2OC)cc1 587906886 XYDFBNKGSDXGOE-SAPNQHFASA-N 380.831 4.131 50 1 GIGF O=C1c2ccccc2[C@]2(NCCc3c(Cl)cc(Cl)cc32)[C@@H]1Br 963127245 ZYJCWPUCXJYVCQ-IAGOWNOFSA-N 397.099 4.343 50 1 GIGF N#CSc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl 587896468 NGQXKGIFAXPAKD-UHFFFAOYSA-N 375.280 4.277 50 1 GIGF Oc1noc(C2CCNCC2)c1[C@H](Br)c1ccc2ccccc2c1 28636781 ONIHNTIPKYMTGW-QGZVFWFLSA-N 387.277 4.485 50 1 GIGF C=C1CCC=C(C)C[C@@H]2OC(=O)C(=C)[C@H]2CC=C(COC(C)=O)CC[C@H]1OO 2356406916 LCYYYCIAJNWGOB-NJYVYQBISA-N 390.476 4.289 50 1 GIGF C=C1[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@@H](OC(=O)C=Cc2ccccc2)C[C@H]1C 2356437412 RIGSJIIZCIKSKY-RHYJRHRISA-N 378.468 4.174 50 1 GIGF CCO[P@@](=O)(O)CC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 49783880 BRUAMNZSGXQDCC-UHFFFAOYSA-N 386.425 4.226 50 1 GIGF CC1(C)[C@]2(C(=O)Nc3ccccc3Cl)CC[C@@]1(C)C(=O)[C@@H]2Br 13144873 QFNRBQIMRXBWHH-AFAVFJNCSA-N 384.701 4.437 50 1 GIGF C/C(=N\NC(=O)Nc1nc2ccc(Cl)cc2s1)c1ccc([N+](=O)[O-])cc1 28823186 MJRJNBUJUNMGSB-AWQFTUOYSA-N 389.824 4.404 50 1 GIGF COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)cc2C)c1=O 169330570 DGJGQOYXXUGICS-FOKLQQMPSA-N 392.484 4.423 50 1 GIGF BrC/C=C\c1nc2cc(Br)c(Br)cc2[nH]1 586972153 IQIHYLPWFRSDPF-UPHRSURJSA-N 394.892 4.496 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(CCl)OC=C1OCc1ccccc1)O2 587374621 IKMYNXSYJHFDCR-QFIPXVFZSA-N 397.858 4.492 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@@H](C)Br)O2 587385584 UERFHZGKPSJKDX-ADLMAVQZSA-N 378.241 4.360 50 1 GIGF Cc1nn(CCCl)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587541911 DTIWKVCMRZUCJM-WIYYLYMNSA-N 398.846 4.147 50 1 GIGF CS(=O)(=O)c1ccc2[nH]c(-c3ccc(F)cc3)c(CCBr)c2c1 587649325 HRLLYKPRCUYVFB-UHFFFAOYSA-N 396.281 4.315 50 1 GIGF C=C(C)[C@@H](CC/C(C)=C/COc1c(OC)cc(/C=C\CO)cc1OC)OO 85799238 NEONTBMZDXWQFB-HAOAIKQQSA-N 378.465 4.249 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 85911684 NFCOJBIECSQMAM-HTSANVFLSA-N 384.472 4.149 50 1 GIGF in-man O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cscc1C(=O)Cl 587898873 OBJRLMSCGISEOK-UHFFFAOYSA-N 386.687 4.144 50 1 GIGF C/C(=N\NC(=O)COc1ccc(C)cc1)c1ccc(-n2c(C)ccc2C)cc1 103238064 RMVNGSPDLWWVNP-LYBHJNIJSA-N 375.472 4.322 50 1 GIGF COc1cc2c3c(c1)O[C@]1(c4ccccc4CC[C@@H]1Br)[C@@H](C2)C3=O 587417535 NRVDRSRSCGPKDX-RIFZZMRRSA-N 385.257 4.048 50 1 GIGF COc1ccc2c(=O)c(-c3ccc(OCCBr)cc3)coc2c1 66260253 VUMZUBQNZGDXKB-UHFFFAOYSA-N 375.218 4.242 50 1 GIGF COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl 587374005 FQVROTUYQFWNGS-GOSISDBHSA-N 375.852 4.300 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@H](C#N)c1nc3ccccc3s1)O2 587415758 WVRXFPYDACGLFD-XCLFUZPHSA-N 397.887 4.437 50 1 GIGF CCNC(=O)c1ccc(C(C#N)=C2C[C@@H]3CC[C@H](C2)N3Cc2ccoc2)cc1 36286790 BKCDCSOAOQZEDS-OYRHEFFESA-N 375.472 4.133 50 1 GIGF Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cnc1CCl 587885335 FJRZFDIIYQUSNK-UHFFFAOYSA-N 381.690 4.146 50 1 GIGF ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@@H](Cl)[C@@H]4O[C@H]34)[C@]1(Cl)C2(Cl)Cl 113904626 ZXFXBSWRVIQKOD-BKRRVYRRSA-N 389.320 4.453 50 1 GIGF CCCc1c(O)ccc2c1O[C@@H](c1cc([N+](=O)[O-])cc(CCl)c1O)CC2=O 587459981 JTEAYOHPWXXFJV-QGZVFWFLSA-N 391.807 4.404 50 1 GIGF O=C(NN/C=C1\C=Nc2ccccc21)c1cc(-c2ccc3ccccc3c2)n[nH]1 13125005 YVHOQNNHUZORNG-NBVRZTHBSA-N 379.423 4.221 50 3 GIGF N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@H]1c1ccc(Cl)cc1 1772625980 IPPKJVIVSBVTQP-SFHVURJKSA-N 399.841 4.237 50 1 GIGF C[C@](Cl)(C=CBr)[C@H](Br)C=C[C@@](C)(Cl)C=O 2356306750 JDUDNUKHKRTULQ-BBBLOLIVSA-N 378.919 4.409 50 1 GIGF C=C1CCC=C(C)C[C@@H]2OC(=O)C(=C)[C@H]2CC=C(COC(C)=O)CC[C@@H]1OO 2356406915 LCYYYCIAJNWGOB-HKBOAZHASA-N 390.476 4.289 50 1 GIGF COC(=O)C1=CN(c2c(C)cc(C)cc2C)C(N)=C(C#N)[C@H]1c1cccc(F)c1 95569344 JMOZXIFTTPHGEH-HXUWFJFHSA-N 391.446 4.106 50 3 GIGF CC1=NN(c2ccccc2)[C@@]2(C1)[C@@H](Cl)C(=O)N2c1nc2ccccc2s1 5964598 BARPPGCSDZGDGV-LPHOPBHVSA-N 382.876 4.233 50 1 GIGF CC(=O)SCC[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 587843195 HNRHVNXHXXNXNO-BJOHPYRUSA-N 394.737 4.226 50 1 GIGF Cc1ccc(C(=O)N/N=C/c2ccc(-c3cccc(Br)c3)o2)cn1 1247061 UXQOLEXCSIDTIM-SRZZPIQSSA-N 384.233 4.176 50 1 GIGF O=C([C@@H]1Cc2ccccc2[C@@](CCl)(c2ccc(Cl)cc2)N1)C(F)(F)F 962763381 KFPRZKJICCSVMN-DOTOQJQBSA-N 388.216 4.468 50 1 GIGF CC(C)[C@H]1[C@H](O)[C@H]2C[C@@H]3[C@H]4[C@@](C)(O)CC[C@@H](Br)[C@]4(C)CC[C@]31C2 238742433 OLJYONZMSNKXBK-POQKFZGESA-N 385.386 4.370 50 1 GIGF O=C(Cl)Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 587884900 RUSVJMJFUMUVCI-UHFFFAOYSA-N 394.685 4.012 50 1 GIGF CC(C)c1ccccc1OS(=O)(=O)c1ccc(NC(=O)CCCl)cc1 1857772875 VXEIGIBKQWKBCA-UHFFFAOYSA-N 381.881 4.145 50 1 GIGF CC(=O)NC1=C(C#N)[C@@H](c2ccccc2)C2=C(C[C@H](c3ccccc3)CC2=O)O1 64549310 LPTXCIPKWKYQCQ-XMSQKQJNSA-N 384.435 4.072 50 1 GIGF COc1ccc2cc(O)c(C(=O)N/N=C/c3c(O)ccc4ccccc34)cc2c1 84709498 DWEDWTTYILNMGD-ZMOGYAJESA-N 386.407 4.177 50 1 GIGF N#C/C=C/c1ccc([C@@H](NC2CC2)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 169350606 KRGHLQAVTNUKAV-AGXACZNRSA-N 392.466 4.470 50 1 GIGF COc1cc(/C=C\c2ccc(NC(=O)NCCCl)cc2)cc(OC)c1OC 473104940 QIUGSQOYQJHXAQ-PLNGDYQASA-N 390.867 4.243 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(NC(=O)CCCCl)cc1)O2 587377587 XCPIVKDVUOTSNW-OAQYLSRUSA-N 386.879 4.415 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CBr)CC1CC1 587539766 YCAVLHWLXFJORH-APWZRJJASA-N 389.245 4.288 50 1 GIGF NNC(=O)c1ccc2nc(CCCCCCCCCCCCC(=O)O)[nH]c2c1 587957444 LFNPCTRMKURMRY-UHFFFAOYSA-N 388.512 4.085 50 1 GIGF CCCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2cc(Cl)ccc21 40391495 CXNFZZVAUOMLJN-NMWGTECJSA-N 383.879 4.401 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 169371574 IGHHGSMGNAAZGN-YFVCOXNXSA-N 385.504 4.067 50 1 GIGF CCOC(=O)c1cc(N=C/C(C#N)=C(/O)OCC)c2ccc(OC)c(OC)c2c1 299846766 WJEGIHQZGQUQQX-NVEGYQBFSA-N 398.415 4.066 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587546239 VFQTWOWTSFJZEX-FXAWDEMLSA-N 385.803 4.093 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C#N)=COc1ccccc12 587738987 FHNSJGJFNFUVSP-WYRIXSBYSA-N 385.236 4.166 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CC(C)C)([C@H](Cl)C(=O)OCC)CC2=O 587459737 PGGUDTQBNWPPHU-UYAOXDASSA-N 382.884 4.265 50 1 GIGF O=C([C@H](Cl)[C@@]1(C2CC2)c2c(F)cccc2C[C@H]2CCCN21)C(F)(F)F 963094696 CRAQFGJCIMXNFR-ISTRZQFTSA-N 375.793 4.190 50 1 GIGF O=C(Nc1ccnc(NC(=O)[C@H]2C[C@H]2Cl)c1)c1c(Cl)cccc1Cl 96928700 UHLHQPYWAQABMR-JOYOIKCWSA-N 384.650 4.207 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587546243 VFQTWOWTSFJZEX-XLIONFOSSA-N 385.803 4.093 50 1 GIGF COc1ccc([C@@H]2O[C@]34C[C@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 96933996 JKVGVXPPLHTQLQ-WIQPIVSASA-N 378.424 4.256 50 1 GIGF NNC(=O)c1ccc2[nH]c(-c3ccc(-c4cc(Cl)ccc4Cl)o3)nc2c1 587051688 SOHMRIGZOCKWFD-UHFFFAOYSA-N 387.226 4.400 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(Cl)cc1)[C@@H](C2)C3=O 587410964 APDLEYSAKOHKPJ-KBXCAEBGSA-N 393.664 4.386 50 1 GIGF CC1(C)C[C@H]2[C@H](C=C(C=O)[C@]3([C@@H]4N[C@H](C(=O)O)Cc5cc(F)ccc54)C[C@]23C)C1 962909415 MEVPYUDTHVGQTC-LKZUOZKLSA-N 397.490 4.053 50 1 GIGF CC(C)=NNC(=O)c1cc2c([nH]c3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 73162653 TWWSDRCYMKBYRO-UHFFFAOYSA-N 387.399 4.417 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1ccc(NC(=O)C(C)C)cc1)[C@@H](C2)C3=O 587417352 LUASJFLOLUXTEC-HTAPYJJXSA-N 399.874 4.171 50 1 GIGF O=C(O[C@@H]1CCC[C@]2(C1)OOC1(O2)C2CC3CC(C2)CC1C3)N1CCCCC1 621477745 YPVMLSGZTLSYAO-GDTNWSJKSA-N 391.508 4.379 50 1 GIGF COC(=O)C=C(C)CC[C@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@]2(C)C(C)=C(C=O)C[C@H]21 2356680714 RYBWQXGDQMJOIS-IHWDNLPISA-N 390.520 4.405 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(C#N)cc2)N1 587689739 VILSVEQLIIPKGS-BBATYDOGSA-N 393.687 4.476 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N=C=O)c2)N1 587743865 YGAVWHGESVDARM-ZMZPIMSZSA-N 375.241 4.353 50 1 GIGF FC1(F)CCN(C2CCC3(CC2)OOC2(OO3)C3CC4CC(C3)CC2C4)CC1 169321465 CUWDTMPGCQFJKT-UHFFFAOYSA-N 399.478 4.419 50 1 GIGF Cc1ccc(-c2cc(NC(=S)NNC(=O)c3ccc(O)cc3)cs2)cc1 169350778 LCWVBMHCJYJPIJ-UHFFFAOYSA-N 383.498 4.061 50 1 GIGF Cc1nc(C)c([C@]2(CCl)N[C@H](C)Cc3cc(Br)c(F)cc32)o1 587683420 HAMVRJHAQFEWGE-VPTHRUTESA-N 387.680 4.210 50 1 GIGF O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@H]1Br 58566828 YZSQCBLLDFMPON-LIEFSGRHSA-N 381.122 4.493 50 1 GIGF CCOc1cc(/C(=C\C#N)c2ccc(OC)c(OC(=O)N(C)C)c2)ccc1OC 73156282 CJDUNKLUUVJWIS-GZTJUZNOSA-N 396.443 4.118 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@@H](Cl)N=O)[C@@H](C2)C3=O 587417050 IRVBKNPRCUTLRB-KKXDTOCCSA-N 378.211 4.323 50 1 GIGF COC(=O)C1=C(Cc2ccccc2)NC(C)=C(C#N)[C@@H]1c1ccccc1Cl 58582512 MGFCKVJJCBNEQH-FQEVSTJZSA-N 378.859 4.494 50 1 GIGF Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 100782781 NFCOJBIECSQMAM-VRSMFXQYSA-N 384.472 4.149 50 1 GIGF endogenous,in-man C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 195297159 MUCWOBDSQXBTNM-CPNUEBSUSA-N 394.584 4.493 50 1 GIGF CN(C)c1ccc(N=Nc2ccc(-c3nc4cc(C(=O)NN)ccc4[nH]3)cc2)cc1 587196653 XAXAPSGJRXBZPK-UHFFFAOYSA-N 399.458 4.315 50 1 GIGF CC(C)[C@H](Br)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587537261 CEKNCSKZUKVDLQ-MPGHIAIKSA-N 377.234 4.142 50 1 GIGF O=C([C@@H]1Cc2ccccc2[C@](CCl)(c2ccc(F)c(F)c2)N1)C(F)(F)F 962762516 JHWMGBABYYQWAT-RDJZCZTQSA-N 389.751 4.093 50 1 GIGF COc1cc(/C=N/NC(=O)Nc2nc3c(ccc4ccccc43)s2)ccc1O 40899349 KHNXMHGKKIRFSR-SRZZPIQSSA-N 392.440 4.319 50 1 GIGF COc1cc(/C=N\NC(=O)c2cccc(C)c2O)ccc1OCc1ccccc1 38201015 DAOYUCWLDWZFFY-OYKKKHCWSA-N 390.439 4.052 50 1 GIGF ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H]4O[C@H]4[C@H](Cl)[C@@H]3[C@@]1(Cl)C2(Cl)Cl 169355126 ZXFXBSWRVIQKOD-WKCIHSDDSA-N 389.320 4.453 50 1 GIGF O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@H](Br)C(=O)CC3 587102180 RWLJLPLIUVSXOV-GOSISDBHSA-N 378.225 4.398 50 1 GIGF CC(C)[C@@H](NC(=O)CCl)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 586986724 RZIXPAMFQJABCJ-OAQYLSRUSA-N 394.858 4.204 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1ccc(CCBr)cc1)[C@@H](C2)C3=O 587413738 PRMQNZWNHWKTOR-JXFKEZNVSA-N 387.273 4.295 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(C2=C(C=O)SC3=NCCN32)cc1 587921371 XAWXYUJAPZSTKW-UHFFFAOYSA-N 394.883 4.034 50 1 GIGF C[C@H](COC[C@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C 2356519377 YTNMLZVAADXGMA-HUUCEWRRSA-N 394.733 4.089 50 1 GIGF N[C@H](CCl)c1nc2cccc(C(=O)Nc3ccc(C(F)(F)F)cc3)c2[nH]1 587010080 FVJAPEDFUYTYKM-GFCCVEGCSA-N 382.773 4.073 50 1 GIGF N#C/C=C\c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1F 587894142 BFKDGXUNJOVURL-RJRFIUFISA-N 387.241 4.380 50 1 GIGF COc1cccc(/C=N/NC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)c1O 1857630458 CPXGRGAQHDSFKC-FSJBWODESA-N 395.846 4.189 50 1 GIGF O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 103196253 XMVQHNUPHYJXOS-CVEARBPZSA-N 385.832 4.127 50 1 GIGF CCN(CC)c1ccc(/C=N/NC(=O)c2cc(Cl)cc(Cl)c2)c(O)c1 49055577 DCGSIAAIILRKQH-SRZZPIQSSA-N 380.275 4.309 50 1 GIGF O=C(N/N=C/c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1cccnc1 1857770329 RPJDKUVRYGKEJQ-FSJBWODESA-N 387.468 4.014 50 1 GIGF CC[C@@H]1C[C@@H]1[C@@H]1OC(=O)CCCC=CCC=C[C@H]2[C@@H]1C[C@@H](Br)[C@H]2O 2356793912 KULVVWPMIUGXPG-VUJKKSPKSA-N 397.353 4.391 50 1 GIGF O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(N(CCCl)CCCl)cc1 49746562 PWZYWYPWXWMXFF-UHFFFAOYSA-N 382.247 4.131 50 1 GIGF O=C(N/N=C/c1c(F)cccc1F)c1cc(-c2ccc(F)cc2F)ccc1O 221321552 XZJXTJNYAKVXMT-KIBLKLHPSA-N 388.320 4.380 50 1 GIGF O=C(Cl)Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 587882591 HBNUCLIIUNNSLX-UHFFFAOYSA-N 394.685 4.012 50 1 GIGF COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)cc(CBr)c1 587898941 UOCCECBQEJLPLM-UHFFFAOYSA-N 393.664 4.430 50 1 GIGF Cc1cc2c(cc1O)[C@@](C)(CCCO[Si](C)(C)C(C)(C)C)N[C@H](C(=O)O)C2 963509506 NUUBRFBMBHNTQH-LAUBAEHRSA-N 393.600 4.317 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccsc2CC[C@H]1Br 587414563 NAMYMKISRXBPJZ-WBVHZDCISA-N 378.291 4.209 50 1 GIGF CCOc1ccc([C@]2([C@@H](C)Cl)NC[C@H]3CC(=O)N(C)c4cccc2c43)cc1 963033865 VLMXLRWJZAOZAB-HLFMIMNKSA-N 384.907 4.010 50 1 GIGF C[C@@H]1CC[C@@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]32OO4 195304530 SBCGDCBRWXAAIF-XZBQRBHSSA-N 386.488 4.398 50 1 GIGF C=CCC[C@@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539296 VGLKGXCSVHWPKG-APWZRJJASA-N 389.245 4.454 50 1 GIGF COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(O)nc2c3ccc3ccccc32)cc1 1857541101 UCVFAXXLTHEWPJ-LJQANCHMSA-N 395.418 4.320 50 1 GIGF Cc1ccc(C(=O)C[C@H]2C(C#N)=C(N)Oc3ccc(Br)cc32)cc1 1857649534 YYBOSIXYWXWTFB-CQSZACIVSA-N 383.245 4.200 50 1 GIGF CCO/C(O)=C1\C(C[S@@](=O)c2ccccc2)=NC(C)=C(C#N)[C@H]1c1ccco1 40810744 RFSFTDZEDALWJG-XLFCUPMZSA-N 396.468 4.229 50 1 GIGF COCCCn1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C 587373469 QYAQWCGUVISMIG-NRFANRHFSA-N 390.911 4.132 50 1 GIGF CO[C@@H]1C=C(O[Si](C)(C)C(C)(C)C)C[C@@H]2Oc3ccccc3C(=O)[C@@]21C#N 170004560 IZAXZIOCCZDGLA-LVCYWYKZSA-N 385.536 4.465 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@H](O)[C@]2(C)[C@H]1C=O 2356730842 KSXULPOQIKTIMP-XUJOMZSTSA-N 382.928 4.052 50 1 GIGF CC(C)=CCOc1ccc([C@@H]2C[C@H]2C(=O)NNc2nncc3ccccc23)cc1 49067073 VCYCXVVUFLVCEQ-LEWJYISDSA-N 388.471 4.222 50 1 GIGF N#Cc1ccc([C@H]2[C@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772609147 OLHLJZLZSVHXKP-ROUUACIJSA-N 383.238 4.278 50 1 GIGF CCCNc1c(C(=O)OCC)cnc2c1cnn2C[C@H](Cl)c1ccccc1 13491815 PTMRQPOADQFSBI-KRWDZBQOSA-N 386.883 4.410 50 1 GIGF [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 169703248 YCAXYDWVXDZEAN-RTBURBONSA-N 386.386 4.010 50 1 GIGF COc1cc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2cc1C 587009789 SQOSXZSXQKKWFG-SFHVURJKSA-N 396.878 4.000 50 1 GIGF COc1cc2c3c(c1)O[C@@](C)(c1cc(CCl)c(OC)cc1OC)[C@@H](C2)C3=O 587419617 FKIYMBZSEKNDEN-BTYIYWSLSA-N 388.847 4.114 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1cc(F)ccc1F)([C@@H](C)Br)O2 587380985 DQGJCBZSGHTMBT-MLCYQJTMSA-N 396.231 4.500 50 1 GIGF O=C1NC(=O)[C@]2(C3CCC3)Cc3ccccc3[C@@]3(CCCCCC[C@@H]3Cl)N12 962661679 IANVPEFUYPMOGB-VLCRHTCISA-N 386.923 4.490 50 1 GIGF CCOC(=O)[C@@H](c1nc(C)cs1)[C@@]1(CCl)NCCc2c1sc(C)c2C 963019409 HBVGEBVOAJMOCO-RDTXWAMCSA-N 398.981 4.057 50 1 GIGF N#Cc1ccc(-c2cc(-c3ccc(C(=O)NN)cc3)cc(-c3ccco3)n2)cc1 1857767119 ZPHJQXQBQRKFCO-UHFFFAOYSA-N 380.407 4.151 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CBr)(c1ccc(N)cc1)CC2=O 587456085 KIRQYVIJLAYBND-LJQANCHMSA-N 390.277 4.183 50 1 GIGF O=C(NCCCCCCCl)NCCOC(=O)Nc1cccc2ccccc12 68586423 RJJSIWPOWZWCEE-UHFFFAOYSA-N 391.899 4.487 50 1 GIGF biogenic CCCC(=O)Nc1ccc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 587372952 OIDZSCOJGRZGRS-NRFANRHFSA-N 386.879 4.415 50 1 GIGF CCOC(=O)C1=C(c2ccc3c(c2)OCO3)Nc2cc(OC)ccc2[C@H]1Cl 49112380 RQSZGXHMBDBMBB-GOSISDBHSA-N 387.819 4.104 50 1 GIGF COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)([C@H](C)Br)[C@@H](C2)C3=O 587427507 IIJVMJFMIGUIAM-PYFOHURJSA-N 391.236 4.261 50 1 GIGF COc1ccc(/C=N/NC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1857632916 HTZDZULHQCMXOW-YDZHTSKRSA-N 379.847 4.483 50 1 GIGF Cc1ccc2c([C@@]3(CCl)NC[C@H]4CC(=O)N(C)c5cccc3c54)c[nH]c2c1 963017517 BUBPCRWIPQKIQT-PEBXRYMYSA-N 379.891 4.012 50 1 GIGF O=C1c2ccccc2[C@]2(NCCc3c(Cl)cc(Cl)cc32)[C@H]1Br 963127240 ZYJCWPUCXJYVCQ-DLBZAZTESA-N 397.099 4.343 50 1 GIGF N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2cccc(C#N)c2)c1 13917537 PNGKHTXBXPGJKZ-PPCHASGVSA-N 398.491 4.165 50 1 GIGF O=C(N/N=C\c1ccco1)c1ccccc1OCc1ccc(Br)cc1 15974109 PJIWVCXHHYRWTN-MTJSOVHGSA-N 399.244 4.385 50 1 GIGF N#CC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 587570512 JEEJKQNHVJZZGR-NFBKMPQASA-N 383.359 4.049 50 1 GIGF Cn1c(SC#N)cc(-c2ccc(F)cc2)c1-c1ccc(S(C)(=O)=O)cc1 28093820 DYPMYHMJYLFQFS-UHFFFAOYSA-N 386.473 4.475 50 1 GIGF COC(C)(C)[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587324326 QGRNBLGWTUHIJL-YLJYHZDGSA-N 378.827 4.293 50 1 GIGF CC(C)=CCO[C@@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 253930087 WPACVSREXXEVRJ-NRDMVMEKSA-N 394.533 4.091 50 1 GIGF COC(=O)c1cc2nc(CBr)[nH]c2c(F)c1Nc1ccccc1 586972348 NDHYCRXKKHKUHB-UHFFFAOYSA-N 378.201 4.127 50 1 GIGF COc1cc2c3c(c1)O[C@@]1([C@@H](Br)[C@H]4CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O 587416895 GADGSAZQNCDXGZ-PRHBQEMCSA-N 391.305 4.401 50 1 GIGF Cc1ccnc2c1CCN[C@@]2(c1cc(C)n(Cc2ccco2)c1C)[C@H](C)Cl 963084546 DYDTZAIPNYCRCR-HTAPYJJXSA-N 383.923 4.466 50 1 GIGF CCn1c2ccccc2c2cc(/C=N/NC(=O)c3ccc(O)c(OC)c3)ccc21 13864057 BCXBZRRBUCACID-ZVHZXABRSA-N 387.439 4.293 50 1 GIGF ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H](Cl)[C@H]4O[C@@H]4[C@H]3[C@@]1(Cl)C2(Cl)Cl 100899331 ZXFXBSWRVIQKOD-WPMIUEAUSA-N 389.320 4.453 50 1 GIGF in-vitro Cc1oncc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587330064 ZZRIINUQRDDZHO-QUCCMNQESA-N 387.794 4.321 50 1 GIGF CCOc1ccc([C@]2(CBr)CC(=O)c3cc(C)cc(N)c3O2)cc1 587371517 FHIAKEQZXWEHTA-LJQANCHMSA-N 390.277 4.232 50 1 GIGF CC(C)[C@@]1(CBr)N[C@H](C)Cc2ccc(F)c(Br)c21 587671763 ANMYOZRURBUUBM-YMTOWFKASA-N 379.111 4.369 50 1 GIGF CC1(C)CC(NC(=O)[C@@]23CC[C@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 169304442 VEOCQHPHVDVKDX-UPRAQXHNSA-N 385.390 4.002 50 1 GIGF CN(C)CCSSCCCNC(=O)c1occc1-c1ccc(F)cc1 618017604 UBAMGYOEPYKLPI-UHFFFAOYSA-N 382.526 4.149 50 1 GIGF CCCCCCCN/C=C1/C=C(C=O)c2c(ccc3c(C)cc(=O)oc23)C1=O 101608888 UNDZRYNIWPDFQM-SSZFMOIBSA-N 379.456 4.324 50 1 GIGF C=C[C@@]1(C)CC[C@@H]2[C@](C)(C[C@H](O)[C@@H]3C(C)(C)[C@H](Br)CC(=O)[C@]32C)O1 38796934 RCIPFLDRBRMOJS-XLUASRDZSA-N 399.369 4.266 50 1 GIGF CC(C)(Cl)[C@H](Br)C[C@H](Br)[C@](C)(Cl)[C@H]1CO1 238750828 WEHGQQRMZAEXFT-JIOCBJNQSA-N 382.951 4.317 50 1 GIGF O=C(O)CCC/C=C/C[C@H]1[C@@H](Cl)C[C@@H](O)[C@H]1/C=C/[C@H](O)C1CCCCC1 33985171 ZOQXTNLUBHPZOZ-MGZWZLCASA-N 384.944 4.289 50 1 GIGF N#CC1=C(N)Oc2c(c(O)nc3c2ccc2ccccc23)[C@@H]1c1ccc(O)cc1 1857558877 XNKHXCZRDIAVBS-GOSISDBHSA-N 381.391 4.017 50 1 GIGF O=C(N/N=C\c1ccc(COc2ccc([N+](=O)[O-])cc2)o1)c1ccc(Cl)cc1 13108568 CWIZBYMOZURGFA-NHDPSOOVSA-N 399.790 4.184 50 3 GIGF CC[C@H]1O[C@H]2C[C@H](C=C=CBr)O[C@H]2C/C=C\C[C@@H]1Br 38346152 MFIOGNKPHIMUQN-MYZNQJQGSA-N 392.131 4.485 50 1 GIGF O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@H]1Br 299806851 YZSQCBLLDFMPON-XBURVNOZSA-N 381.122 4.493 50 1 GIGF N[C@H](CCl)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 587012391 XQKYWJHOIOFQMU-GFCCVEGCSA-N 380.673 4.143 50 1 GIGF CCOC(=O)[C@H](Cl)[C@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 587494771 ABWPWTFMCCAAMB-FPOVZHCZSA-N 378.896 4.486 50 1 GIGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc2c(c1)Cc1ccccc1-2 95808697 WJSLWTRFASCSOE-LFVJCYFKSA-N 378.472 4.222 50 1 GIGF COc1ccc(N[C@H]2O[C@@H]3O[C@@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 44323897 QNDVWLZXYZIKMP-MAWUFDTGSA-N 389.492 4.315 50 1 GIGF COc1cc2c3c(c1)O[C@H]([C@@]14C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C4C=O)[C@@H](C2)C3=O 587444596 FDZXGJGWLLKEIR-FLMHXZPOSA-N 392.495 4.399 50 1 GIGF Cc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cccc1C(=O)Cl 587877484 MPVYACFWOCJYCR-UHFFFAOYSA-N 394.685 4.391 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 587086935 JMMOQJUADBTXBN-VIFPVBQESA-N 394.038 4.208 50 1 GIGF O=C(c1ccc(CCl)cc1)c1c(CO)oc2cc(Br)cnc12 587275529 CPNVKTOMYRABNI-UHFFFAOYSA-N 380.625 4.052 50 1 GIGF COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)[C@@H](C)Cl)c1C)[C@@H](C2)C3=O 587417694 ONBQUIWCUSTKTO-LHZHGFSSSA-N 387.863 4.113 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CBr)(c1cccc(O)c1)CC2=O 587455669 FAYGHCNCFRLVDD-IBGZPJMESA-N 391.261 4.306 50 1 GIGF O=C([C@H]1Cc2ccccc2[C@](CCl)(c2ccc(Cl)cc2)N1)C(F)(F)F 962763401 KFPRZKJICCSVMN-WBVHZDCISA-N 388.216 4.468 50 1 GIGF CC=C(C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@]2(O)[C@H](Cl)CC[C@@H](C)[C@@]12C 2356565017 LIIUXOSINVLFRM-MSVUAZDBSA-N 380.868 4.110 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2cccc(I)c2[nH]1 587087914 YSAOTVSTLPZBFR-VIFPVBQESA-N 397.029 4.352 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(C1(c3ccccc3)CC1)O2 587375429 SFDQQELWUVCZRS-FQEVSTJZSA-N 386.289 4.408 50 1 GIGF CC(C)[C@@H]1C[C@H](O)[C@H]2C[C@@]13CC[C@@]1(C)[C@H]([C@H]23)[C@@](C)(O)CC[C@H]1Br 2356573700 XIMOIAZZHIMGIZ-IZIVOVIWSA-N 385.386 4.370 50 1 GIGF O=C(N/N=C(\C=C\c1ccc(O)cc1)c1ccccc1O)Nc1ccc(F)cc1 103200912 DFQISZQMKJAEAL-SIACRCKJSA-N 391.402 4.476 50 1 GIGF CC=CC[C@@H]1O[C@H]([C@@H]2C[C@H](Br)[C@H](CC)O2)C[C@@H]1Br 2356782368 DXFOROLMOVEIQX-LHEWDLALSA-N 382.136 4.205 50 1 GIGF C/C(=N/NC(=O)c1ccncc1)c1ccc(NC(=S)Nc2ccccc2)cc1 28568896 ZMMIHRONVIWHII-MYYYXRDXSA-N 389.484 4.045 50 1 GIGF O=C1c2ccccc2C(=O)N1Cc1c(CCl)[nH]c2ccc(F)c(Cl)c12 587628645 PRHHTZRHJJFRJV-UHFFFAOYSA-N 377.202 4.495 50 1 GIGF Cc1ccccc1N/C=C1\C=C2C(=CC1=O)OC(N)=C(C#N)[C@H]2c1ccccc1 100557517 XZRTXHDBPKMTFN-IOUNIBQOSA-N 381.435 4.192 50 3 GIGF Cc1cccc(C)c1NC(=O)N/N=C/c1ccc(I)cc1 149719799 WDNROICVDYUSQS-VCHYOVAHSA-N 393.228 4.064 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@@H](Cl)c1ccccc1)CC2=O 587460048 RBSXMBWHQRBSJQ-PZJWPPBQSA-N 388.847 4.202 50 1 GIGF Cn1c(=O)oc2cc([C@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 587496545 DVIQDKGDAMNQKN-JOCHJYFZSA-N 397.858 4.110 50 1 GIGF CN(C)N(c1cc(C#CC(C)(C)C)sc1C(=O)O)C(=O)[C@H]1CC[C@H](C)CC1 299815469 LATMUSXHHVOIII-SHTZXODSSA-N 390.549 4.480 50 1 GIGF O=C(CCl)Nc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12 299820693 GTASAMASJLVHTD-UHFFFAOYSA-N 378.211 4.203 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccccc1N=C=S 587897141 VSPSXOBPZQKLON-UHFFFAOYSA-N 375.280 4.438 50 1 GIGF Cc1cccc(C(=O)N(NC(=O)c2ccc3c(c2C)C[C@H](C)O3)C(C)(C)C)c1 103203919 VLCTZHVJXYWGLV-HNNXBMFYSA-N 380.488 4.213 50 1 GIGF COC(=O)C=C(CC[C@@H]1C(C=O)=CC[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O 2356427554 DWQLMTINEJBFII-VIZSFHNOSA-N 390.520 4.407 50 1 GIGF ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl 100899329 ZXFXBSWRVIQKOD-LOFFKTJVSA-N 389.320 4.453 50 1 GIGF in-vitro CC(C)[C@@H]1[C@H](O)[C@H]2C[C@@H]3[C@@H]4[C@](C)(O)CC[C@@H](Br)[C@]4(C)CC[C@@]13C2 2356469458 OLJYONZMSNKXBK-UIELHBJYSA-N 385.386 4.370 50 1 GIGF COc1ccc(OC)c2c1C[C@@H](C)N[C@]2(C)c1cc(F)cc(CCl)c1O 963641780 XTKVEOBKZZVZGM-BIBXISHDSA-N 379.859 4.085 50 1 GIGF CC(C)[C@H](NC(=O)CCl)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 586986721 RZIXPAMFQJABCJ-NRFANRHFSA-N 394.858 4.204 50 1 GIGF Cc1cc([C@@]2(CBr)NCCc3c(C(=O)O)cccc32)ccc1Cl 963131692 NPYGRUZEJMACIE-GOSISDBHSA-N 394.696 4.131 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2ccc(S(C)(=O)=O)cc2[nH]1 586972969 DNHFRUAKUHIIRW-NSHDSACASA-N 393.306 4.013 50 1 GIGF Cn1ccnc1[C@]1(CCl)c2ccccc2CCN1[C@@H](C#N)c1ccccc1 963199772 DAPUUZPHSHULLO-UNMCSNQZSA-N 376.891 4.025 50 1 GIGF O=C(c1ccncc1)N(/N=N/c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 1772640735 VXYUNLUJHLDXEZ-QZQOTICOSA-N 392.331 4.244 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(OCCCl)cc1 587886026 IWTNBHJBDRYPNR-UHFFFAOYSA-N 396.701 4.321 50 1 GIGF CC1(C)C[C@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 100234808 CWCXONZIEDNVKI-RQOBQMRWSA-N 399.325 4.010 50 1 GIGF in-vitro CC[C@H](Br)[C@H]1CC=CC[C@@H]2O[C@H](C=C=CBr)C[C@@H]2O1 105395527 ZFUYDSOHVJVQNB-CPMYSYMXSA-N 392.131 4.485 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cccc(F)c1F)O2 587384420 CXAKAFZQHAHADA-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF O=C([C@H]1Cc2ccccc2[C@@](CCl)(c2ccc(Cl)cc2)N1)C(F)(F)F 962763391 KFPRZKJICCSVMN-NVXWUHKLSA-N 388.216 4.468 50 1 GIGF Cc1ccc(/C=N/NC(=O)c2cc(C)nc3c2c(C)nn3-c2ccccc2)cc1 1772616078 RFFXCNVAHXPVJU-ZVHZXABRSA-N 383.455 4.110 50 1 GIGF COc1cc2c3c(c1)O[C@](c1[nH]c(C)c(C(C)=O)c1C)([C@H](C)Cl)[C@@H](C2)C3=O 587417682 OJEPAGDGLXMDEA-HCQWSFJTSA-N 387.863 4.113 50 1 GIGF Cc1cc(NNC(=O)c2ccccc2Cl)nc2c1c(-c1cccs1)nn2C 1857616074 PRZYTPBYZCODHS-UHFFFAOYSA-N 397.891 4.416 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CSc3ccccc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 100961508 OCZSYYGYYJECSV-NADKITPMSA-N 390.501 4.167 50 1 GIGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@](CBr)(c2cncc(F)c2)N1 962938944 ATJSFIINZXLUQW-KUHUBIRLSA-N 388.284 4.265 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCC(F)(F)F)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 43379894 PLQRQNZEPLAUHQ-JNFWJAKCSA-N 378.387 4.108 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2ccc(F)c(Br)c2[nH]1 586971513 TXUILHCUZSCLEO-JTQLQIEISA-N 380.055 4.326 50 1 GIGF COc1ccc2oc(C(=O)N3C[C@@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 5923375 QXOZQTZJASWELT-GFCCVEGCSA-N 386.791 4.332 50 1 GIGF COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(Cl)cc2)c1=O 169330572 IMVRHBDPYILKLS-LSHDLFTRSA-N 398.875 4.460 50 1 GIGF Cc1nc(C)c([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 587541598 CKNDESCMYNYDBT-OXJNMPFZSA-N 385.803 4.093 50 1 GIGF CCOC(=O)[C@@H](Cl)Cc1ccc(C#Cc2cc(Cl)ccc2OC)cc1 587905661 DFYATEGNPPWPPY-SFHVURJKSA-N 377.267 4.461 50 1 GIGF Cn1cccc1CN1CCc2sccc2[C@]1(CCl)c1ccc(C#N)cc1 962371667 HHTKVJILDBKLRP-NRFANRHFSA-N 381.932 4.499 50 1 GIGF Cc1cccc([C@@]2([C@H](C)Br)NCCc3c2c(C(C)C)nn3C)c1 962916089 IUCOPCHQLMXDRX-IFXJQAMLSA-N 376.342 4.025 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1cc4ccccc4o1)[C@@H](C2)C3=O 587411255 CPFLRXBMOWAVRX-VBKZILBWSA-N 399.240 4.479 50 1 GIGF CC(C)[C@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 587539439 WJIYLLSREKNPAF-QAPCUYQASA-N 377.234 4.144 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(C#N)cc2)N1 587690004 YPIDIOZBVUEGNZ-BBATYDOGSA-N 393.687 4.476 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCCBr)cc1)O2 587371644 FLUXACQOOWCTOE-KRWDZBQOSA-N 376.250 4.057 50 1 GIGF CC(C)(C)N(NC(=O)c1ccc(Cl)cc1)C(=O)c1coc2ccccc2c1=O 28645877 NRKZLVFCCBLOAO-UHFFFAOYSA-N 398.846 4.032 50 1 GIGF CCCCN(CCCC)Cc1cccc(/C(C)=N/NC(=O)c2ccncc2)c1O 103242066 GXCBBALIXDYHDN-XIEYBQDHSA-N 396.535 4.343 50 1 GIGF COc1cc2c3c(c1)O[C@]1([C@@H](Br)[C@H]4CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O 587416898 GADGSAZQNCDXGZ-RFBFKHLVSA-N 391.305 4.401 50 1 GIGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@](CBr)(c2cncc(F)c2)N1 962938941 ATJSFIINZXLUQW-AUUYWEPGSA-N 388.284 4.265 50 1 GIGF CS(=O)(=O)/C(C#N)=C/c1cc(Cc2ccc(C(F)(F)F)cc2)ccc1F 1857598980 UJWNXRRKZPSWST-MHWRWJLKSA-N 383.366 4.344 50 1 GIGF C=C(C)[C@H](Cl)CC=C(C)[C@@H]1CC[C@]2(C)OC3=C(C[C@H]12)C(=O)[C@@]1(O)CO[C@H]3C1 2356691682 SPHHHXFBOCONBA-ZETURPHTSA-N 392.923 4.068 50 1 GIGF CC1(C)CC(=O)C=C(NNC(=O)CCCOc2ccc(Cl)cc2Cl)C1 13140448 ADOFCGKXUSCZOS-UHFFFAOYSA-N 385.291 4.046 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1c(C)[nH]c4ccc(OC)cc14)[C@@H](C2)C3=O 587423253 UJHXDNLFDHKJPS-KSFYIVLOSA-N 397.858 4.375 50 1 GIGF O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@@H]1Br 40420244 YZSQCBLLDFMPON-JVQVWZCXSA-N 381.122 4.493 50 1 GIGF C[C@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Oc2ccccc2)c1 84604009 HDHKONAQITXRKY-KRWDZBQOSA-N 395.503 4.493 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](Br)Cc1ccccc1F)O2 587385123 MAJNDUSSUZXSPQ-IEBWSBKVSA-N 392.268 4.446 50 1 GIGF COC(=O)c1cccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 587499445 TUYGLZWXAUNIKN-QFIPXVFZSA-N 384.859 4.452 50 1 GIGF CN(C)/C=C(/C#N)[C@@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 587529618 AGVZBDKYNOMXPU-NKZVREJYSA-N 378.497 4.457 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C#N)=COc1ccccc12 587743098 VEYDRGCHNQLRRS-WYRIXSBYSA-N 385.236 4.166 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCC(Br)CC2 587545365 RBQXHBFHCNQCTR-WHROBYLRSA-N 389.245 4.430 50 1 GIGF Cc1cccc([C@]2([C@H](C)Br)NCCc3c2c(C(C)C)nn3C)c1 962916097 IUCOPCHQLMXDRX-LIRRHRJNSA-N 376.342 4.025 50 1 GIGF COC(C)(C)[C@H](Br)c1nc2cc(C)cc(Br)c2[nH]1 586970222 BYJUCLXJCSFEIC-LLVKDONJSA-N 376.092 4.495 50 1 GIGF COc1ccc([C@@H]2[C@@H](C)C(=O)C[C@H](c3ccc(F)cc3)N2C(=O)CCl)cc1 299858459 RXXAPBCIJIFNMW-NVMYHKGLSA-N 389.854 4.293 50 1 GIGF CN(C)/C=C(\C#N)[C@@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 587529616 AGVZBDKYNOMXPU-KJLVKZSNSA-N 378.497 4.457 50 1 GIGF CCCCCCN1C(=O)/C(=N\NC(=O)c2ccc(Cl)cc2)c2ccccc21 40859795 JZWQLUMKLFATDJ-NMWGTECJSA-N 383.879 4.401 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1ccc(O)cc1 587543456 KNQSZMXNLZVWEH-NQIIRXRSSA-N 382.799 4.194 50 1 GIGF O=CC1=C(Cl)[C@H]([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCC1 587555238 ZKQCODYJQZDHKX-ZVGUJKQYSA-N 384.815 4.214 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3cc(C)on3)c1C)O2 587371051 CQGGLDCQXDDDDF-NRFANRHFSA-N 399.878 4.381 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)c(F)c1)O2 587380492 AEGZNGXCWDQURP-KRWDZBQOSA-N 382.204 4.111 50 1 GIGF CC(C)(C)[Si](O[C@H]1C[C@H]2CC(=O)C[C@H]2C1)(c1ccccc1)c1ccccc1 299859097 VXWHJZKIBZBRHJ-KXTWHKPSSA-N 378.588 4.321 50 1 GIGF CC1(C)C(Br)=C[C@H]2O[C@@]2(C)[C@@]12C[C@H](Br)[C@]1(C)C[C@H]2O1 2356851375 QGZVAFYBURCCNT-YQHHGQFNSA-N 392.131 4.164 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1cccc(F)c1CBr)[C@@H](C2)C3=O 587423948 LWOZTRDEXCDNMN-SGTLLEGYSA-N 377.209 4.218 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CBr)(c1oc(C)nc1C)CC2=O 587456398 OFGNRYPGNHUBEH-SFHVURJKSA-N 394.265 4.205 50 1 GIGF O=C([C@@H]1Cc2ccccc2[C@@](CCl)(c2ccc(F)c(F)c2)N1)C(F)(F)F 962762513 JHWMGBABYYQWAT-DOTOQJQBSA-N 389.751 4.093 50 1 GIGF Cc1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)[nH]1 587541578 CIMUFAPOJSPJKK-NQIIRXRSSA-N 383.831 4.433 50 1 GIGF Cc1nc(C)c([C@]2(CCl)N[C@H](C)Cc3ccc(F)c(Br)c32)o1 587685721 RJQRYONLMFYIMU-VPTHRUTESA-N 387.680 4.210 50 1 GIGF C=C1CC[C@H]([C@]2(C)CC[C@H](C(C)(C)NC)O2)[C@@H]2[C@@H]1CC[C@](C)(O)[C@H]2N=C=S 2356809138 ANRLMRLBKAVEHS-WRKHRYLDSA-N 392.609 4.137 50 1 GIGF O=C(NNc1ccccc1)c1cc2ccc(OCc3ccccc3)cc2oc1=O 40425431 OSWDDFNVOXEAGK-UHFFFAOYSA-N 386.407 4.129 50 1 GIGF CCNC(=O)c1ccc(C(C#N)=C2C[C@@H]3CC[C@@H](C2)N3Cc2ccoc2)cc1 101017456 BKCDCSOAOQZEDS-SFTDATJTSA-N 375.472 4.133 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12c1ccccc1C[C@@H]2Cl 587550974 WQWSKRWPSGWGBF-IPJJNNNSSA-N 378.811 4.413 50 1 GIGF Cc1ccc([C@@]2(CCl)N[C@@H](C(=O)O)Cc3c(Cl)cc(F)c(F)c32)s1 962972390 UQNKEOUAELDHPI-BDJLRTHQSA-N 392.254 4.069 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1c(CCl)c(C#N)c4ccccn14)[C@@H](C2)C3=O 587421448 MDXGVBCHEAZFRC-ZSEKCTLFSA-N 378.815 4.047 50 1 GIGF C[C@@H](C(=O)NNC(=O)NC1CCCCC1)c1cccc(Cc2ccccc2)c1 84597029 HMSZAPFLFNLPEK-QGZVFWFLSA-N 379.504 4.044 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CC(C)C)([C@@H](Cl)C(=O)OCC)CC2=O 587459728 PGGUDTQBNWPPHU-AZUAARDMSA-N 382.884 4.265 50 1 GIGF CC(C)[C@@H]1C[C@@H]2[C@H]3[C@@H]4[C@@](C)(O)CC[C@@H](Br)[C@@]4(C)CC[C@]13C[C@H]2O 2356671202 QYWKYBMMQNPDJT-FPGPFZBPSA-N 385.386 4.370 50 1 GIGF COc1ccc(N[C@@H]2O[C@@H]3O[C@@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@]53OO4)cc1 44323892 QNDVWLZXYZIKMP-ZMJFZODZSA-N 389.492 4.315 50 1 GIGF CC(=O)O[C@@H]1C[C@]2(O)C[C@@]3(C)CC[C@@]2(C[C@H]3Cl)C(C)(C)[C@H]1Br 2356588701 DIJRDZRTBRINGF-DCPIPXHOSA-N 393.749 4.030 50 1 GIGF O=C(NNc1ccc(C(F)(F)F)cc1Cl)C12C3[C@H]4C=C[C@H]1[C@@H]4[C@H]1[C@H]3C=C[C@H]12 1772604739 BOUVQCQJXAMZKR-AVOAJDHISA-N 392.808 4.282 50 1 GIGF COc1cc(C=CCO)cc(OC)c1OCC=C(C)CC=CC(C)(C)OO 2356637410 RVCISGRHDQEYDW-UHFFFAOYSA-N 378.465 4.249 50 1 GIGF CCOC(=O)c1c(O[C@@H]2CCCC[C@H]2Cl)cc(Cc2ccccc2)[nH]c1=O 95591841 BJKWBSFFJGSPLK-IAGOWNOFSA-N 389.879 4.071 50 1 GIGF COc1ccc(Cl)cc1C#Cc1cc(CBr)cc2c1OCO2 587898957 VEXFNJPKGJIQJE-UHFFFAOYSA-N 379.637 4.372 50 1 GIGF CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@H]1C)C(=O)[C@@H](C)Cl 40430137 ZIGNETWTEBLFNH-HZPDHXFCSA-N 387.911 4.141 50 1 GIGF ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@@H](Cl)[C@H]4O[C@@H]43)[C@]1(Cl)C2(Cl)Cl 113904629 ZXFXBSWRVIQKOD-IWOHTMRNSA-N 389.320 4.453 50 1 GIGF CCN(c1ccc(-c2csc(C(C#N)=C3CCCC3)n2)cc1)S(C)(=O)=O 8209916 MVSHKURLOABONI-UHFFFAOYSA-N 387.530 4.447 50 1 GIGF CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\NC(=O)c1cccc(Cl)c1 103292360 OBDAQUULQGLJTF-BGWGFDHBSA-N 398.846 4.434 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(c1c(C)[nH]c4ccc(OC)cc14)[C@@H](C2)C3=O 587423248 UJHXDNLFDHKJPS-AOMKIAJQSA-N 397.858 4.375 50 1 GIGF COc1cccc2cc3c(nc12)[C@](C1CCC1)([C@H](C)Br)NCC3 963059309 QNLATALVBKMKPL-HXPMCKFVSA-N 375.310 4.168 50 1 GIGF CCOC(=O)C(=O)[C@H](Cl)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 586993756 NMIOEUICEAQGBC-GOSISDBHSA-N 393.826 4.167 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N=C=O)c2)N1 587742591 SHTHEQPLEWSXAB-ZMZPIMSZSA-N 375.241 4.353 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)[C@]3(C)O[C@H]3C[C@@H]12 2356392781 PDQNHDCJWUTAFX-KPRRGPHJSA-N 396.163 4.286 50 1 GIGF C[C@H](C(=O)c1ccc(NC(=O)CCl)cc1)N1CCC(Cc2ccccc2)CC1 29043778 RCYWAXIDQNVCBO-QGZVFWFLSA-N 398.934 4.390 50 1 GIGF CC(C)(F)[C@H](Br)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587087775 UCYMZFFMLFKEEW-SECBINFHSA-N 395.026 4.418 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1F)([C@@H](C)Br)O2 587384798 IZJJHQOVKMNEAX-ADLMAVQZSA-N 378.241 4.360 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cc(F)cc(F)c1)O2 587385351 NKBKXZYSJJCGHL-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF COc1ccc(/C=N/NC(=O)c2ccc(-c3cc(=O)c4ccccc4o3)cc2)cc1 653754335 RSHKKVXIQGGQSF-MFKUBSTISA-N 398.418 4.233 50 1 GIGF Cc1cc2nc([C@H](Cc3c[nH]c4ccccc34)NC(=O)CCl)[nH]c2cc1F 587010030 ZVZPKAIMRTXOFO-SFHVURJKSA-N 384.842 4.131 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(C#N)=COc2ccc(Br)cc21 587372365 PSJLABFURHLIOU-IBGZPJMESA-N 397.228 4.000 50 1 GIGF CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)[C@H](Cl)C1=CCBr 2356729697 BURJCSPPDZTXBA-OUAUKWLOSA-N 388.527 4.040 50 1 GIGF COc1ccc(OC)c2c1C[C@@H](C)N[C@@]2(C)c1cc(F)cc(CCl)c1O 963641788 XTKVEOBKZZVZGM-GIPWTMENSA-N 379.859 4.085 50 1 GIGF N#CC(=C\c1cccs1)/C=C1\SC(=S)N(c2ccc(C(=O)O)cc2)C1=O 103228469 HLXPKHFEWMJXKO-BTTAZIECSA-N 398.490 4.302 50 1 GIGF C=CCO/C(O)=C1\C(C)=NC(SCC)=C(C#N)[C@H]1c1ccc(O)c(OC)c1 104087861 SBKDARPCKZFYFS-GMQRBVGNSA-N 386.473 4.419 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCBr)(c1ccc(F)cc1)O2 587383849 GXPLTTUCFCPSIL-SFHVURJKSA-N 378.241 4.362 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CBr)(c1cccc(O)c1)CC2=O 587455670 FAYGHCNCFRLVDD-LJQANCHMSA-N 391.261 4.306 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3c(c1)OCCO3)CC2=O 587460702 OVXPFVBYKOFTEE-OAQYLSRUSA-N 388.847 4.215 50 1 GIGF Cc1sc2c(c1C)CCN[C@]2(CCl)[C@@H](NC(=O)OC(C)(C)C)C(C)C 963014708 UXMQWWSYAMWATN-HNAYVOBHSA-N 386.989 4.494 50 1 GIGF N#CC1=C2SCN(c3ccc(F)cc3)CN2C(=O)C[C@H]1c1cccc(F)c1 4923479 ONUHLYCFPJAGTC-KRWDZBQOSA-N 383.423 4.184 50 3 GIGF aggregator C/C(CCC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1ccc(-n2cccc2)cc1 1772631438 ZTTYZVHUDVYQSN-PCLIKHOPSA-N 392.434 4.141 50 1 GIGF CC/C=N\NC(=O)c1cc(Cl)cc(C)c1NC(=O)c1cccnc1Cl 103216268 XLIJZPRHSHNERJ-MPUCSWFWSA-N 379.247 4.075 50 1 GIGF COc1ccc(/C=C/C(=O)N2C[C@H](CCl)c3c2cc(O)c2ncccc32)cc1 38394657 VOSGPGDJAFYOIZ-PPYMECGQSA-N 394.858 4.331 50 1 GIGF COC(C)(C)[C@@H](Br)c1nc2cc(Br)cc(C)c2[nH]1 586970790 IUFKIJOFPITGKO-NSHDSACASA-N 376.092 4.495 50 1 GIGF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCl)COc1ccccc1 587543160 JQLXBFNKRIIIHY-SIKLNZKXSA-N 396.826 4.410 50 1 GIGF CCN(C)C(=O)Oc1cccc(CNC(=O)CCCC[C@H]2CCSS2)c1 1857631713 JUAVIZNHBLORJY-KRWDZBQOSA-N 396.578 4.467 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1coc4ccccc14)[C@@H](C2)C3=O 587414412 VDWMVXBFFFPXCS-XOBRGWDASA-N 399.240 4.479 50 1 GIGF Cc1ccc2c([C@]3(CCl)NC[C@H]4CC(=O)N(C)c5cccc3c54)c[nH]c2c1 963017511 BUBPCRWIPQKIQT-JLCFBVMHSA-N 379.891 4.012 50 1 GIGF CC(C)(C)OC(=O)n1c2c(c3ccccc31)[C@@H](C(F)(F)F)C(C#N)=C(N)O2 1857648143 GVJGWUMSDSMNSK-ZDUSSCGKSA-N 379.338 4.157 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cscn2)N1 587852733 ICQQGSAQFSFEQY-XLKFXECMSA-N 375.694 4.061 50 1 GIGF O=C(N/N=C/c1ccc(OCc2cccc(F)c2)cc1)c1nc2ccccc2[nH]1 1911575693 CJQSIZHZMVUJAB-ZMOGYAJESA-N 388.402 4.045 50 1 GIGF ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H]4O[C@@H]4[C@@H](Cl)[C@@H]3[C@@]1(Cl)C2(Cl)Cl 100899333 ZXFXBSWRVIQKOD-OXOMBSTBSA-N 389.320 4.453 50 1 GIGF in-vitro Nc1ccc([C@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 587497604 DATOCLPUDGOQPO-HXUWFJFHSA-N 386.289 4.403 50 1 GIGF CC(=O)OCC(=CCCC(C)=CCO)CCC[C@H](C)C(=O)C=CC(C)(C)OO 2356386748 VFWLLWIEDAKQNA-SFHVURJKSA-N 396.524 4.395 50 1 GIGF COC(=O)C1=CC[C@@H]2[C@](C)(CCC=C(C)C)[C@H](Cl)C[C@@H]3O[C@H](O)[C@@H]1[C@]32C 2356572931 SRJIDFQIECGKBW-DYYHUOPESA-N 382.928 4.209 50 1 GIGF COc1ccc2onc(/C(C#N)=C/c3ccccc3OCCN3CCCC3)c2c1 40554456 WHUVHTJXBMTOKY-NBVRZTHBSA-N 389.455 4.375 50 1 GIGF Cc1ccc2c3c(c4c(nc13)[C@@H](Br)C(=O)C4)-c1ccccc1C2=O 586992611 FDCNXMKYFVXERE-KRWDZBQOSA-N 378.225 4.316 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1cccc(CBr)c1F)[C@@H](C2)C3=O 587426459 OAJGUIDYFHLHDV-SCLBCKFNSA-N 377.209 4.218 50 1 GIGF C[C@@H]1CC[C@H]2[C@H](CCCc3ccccc3)C(=O)O[C@@H]3O[C@@]4(C)CC[C@H]1[C@]32OO4 43888682 SBCGDCBRWXAAIF-CLDLGEPJSA-N 386.488 4.398 50 1 GIGF COc1ccc(-c2nnc(-c3ccc4nc(CBr)[nH]c4c3)o2)cc1 586972130 HJFSUFFUGBJXGA-UHFFFAOYSA-N 385.221 4.183 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(F)c1C(=O)Cl 587893023 KBXOXGRGLCNPKR-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF Cn1ccc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 587328094 SWYOPZDCLHNTJH-CTNGQTDRSA-N 385.822 4.363 50 1 GIGF O=C([C@H](Cl)[C@]1(C2CC2)c2c(F)cccc2C[C@H]2CCCN21)C(F)(F)F 963094698 CRAQFGJCIMXNFR-PVUWLOKVSA-N 375.793 4.190 50 1 GIGF O=C(N/N=C/c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1ccncc1 1857772191 NNRYVGFKZSNOAN-YDZHTSKRSA-N 387.468 4.014 50 1 GIGF CC(=O)OCC(=CCCC(C=O)=CC=O)CCC=C(C)[C@H](O)CC=C(C)C 2356648032 MDPQKRFXKXCPOC-JOCHJYFZSA-N 376.493 4.024 50 1 GIGF C[C@](O)(c1ccccc1)c1cccc(/C(C#N)=C(\N)Sc2ccccc2N)c1 38145374 XCACMUUUJDXIGW-NYPLXPLJSA-N 387.508 4.468 50 1 GIGF CC(=O)NC[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3/C(=N/NC(C)=O)C[C@H]21 473115498 TUJLAXVEYKZNIV-UPHVMHIDSA-N 397.563 4.254 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cc(F)ccc1F)O2 587382363 QBGLJMHDQCWPEM-QGZVFWFLSA-N 382.204 4.111 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCBr)(c1ccc(F)cc1)O2 587383845 GXPLTTUCFCPSIL-GOSISDBHSA-N 378.241 4.362 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](CSC#N)(c1cccc([N+](=O)[O-])c1)CC2=O 587489158 BEZLJCCDCRIHOC-FQEVSTJZSA-N 398.440 4.328 50 1 GIGF CC(=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@H]4C(C=O)=CC[C@H]23)O1)CO 2356324319 IXOCIELJWNTVCH-CXRLYFCOSA-N 398.543 4.186 50 1 GIGF O=C(N/N=C\c1ccc(OC(=O)c2ccccc2Cl)cc1)c1ccc(O)cc1 61878126 WHROHZUVTXKXLT-QRVIBDJDSA-N 394.814 4.029 50 1 GIGF Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)on1 587326649 MGUAQMPYMLJDTC-ICSRJNTNSA-N 387.794 4.321 50 1 GIGF CCCN1[C@H](C)Cc2ccccc2[C@@]1(CBr)c1cccc(OC)n1 963237693 YXXGGXIORTYJHY-QRWLVFNGSA-N 389.337 4.385 50 1 GIGF Cc1oncc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587330063 ZZRIINUQRDDZHO-ICSRJNTNSA-N 387.794 4.321 50 1 GIGF C[C@@]1(CCCBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 587539726 XWLSJRCPSPMUQP-YJBOKZPZSA-N 377.234 4.288 50 1 GIGF Cc1cc(C(=O)Cl)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl 587878920 YTIMXJNHNPHAOL-UHFFFAOYSA-N 394.685 4.391 50 1 GIGF COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(O)nc2c3ccc3ccccc32)cc1 1857541100 UCVFAXXLTHEWPJ-IBGZPJMESA-N 395.418 4.320 50 1 GIGF O=C(O)CCc1ccc(-c2ccc(Cl)cc2)n1-c1ccnc(CCl)n1 587941400 USFWAOZVRLDMTN-UHFFFAOYSA-N 376.243 4.344 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(Cl)cc1)[C@@H](C2)C3=O 587410965 APDLEYSAKOHKPJ-KSSFIOAISA-N 393.664 4.386 50 1 GIGF Cc1ccc(/C=C(/C#N)c2nc3cc(Br)cc(C(=O)O)c3[nH]2)cc1 587187785 KTIZBELHZBMHGW-SDQBBNPISA-N 382.217 4.396 50 1 GIGF COc1cc2c3c(c1)O[C@]1(C[C@H]4CC[C@@]1(CBr)C4(C)C)[C@@H](C2)C3=O 587414397 VAZOCJSMJLMQHP-GREUMRBKSA-N 391.305 4.403 50 1 GIGF CCOC(=O)c1cnc2c(cnn2C[C@H](Cl)c2ccccc2)c1NC1CC1 13491817 DQSKSPGAGGAIOZ-KRWDZBQOSA-N 384.867 4.162 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(C2CCOCC2)[C@H]1c1ccc(F)cc1 587325036 BQUSEKLCEXCKES-FPOVZHCZSA-N 390.838 4.294 50 1 GIGF COc1cc2c3c(c1)O[C@@]1(c4ccsc4CC[C@H]1Br)[C@@H](C2)C3=O 587453629 RNLWFFQZXCQRPQ-PNPHSEOMSA-N 391.286 4.109 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(O)cc2)N1 587685347 PTFDJKWYDMQRQN-QGHHPUGFSA-N 384.676 4.310 50 1 GIGF COc1ccc(Br)cc1P(=O)(c1ccccc1)c1ccccc1 68600201 NXXJUHSHQVUOJN-UHFFFAOYSA-N 387.213 4.097 50 1 GIGF biogenic O=C(O)CCC/C=C\C[C@@H]1[C@H](Cl)C[C@H](O)[C@@H]1/C=C/[C@H](O)C1CCCCC1 261192078 ZOQXTNLUBHPZOZ-VRQXTABBSA-N 384.944 4.289 50 1 GIGF in-vitro C[C@]1([C@@H](Br)Cc2ccc(F)cc2F)NCCc2ccc(O)cc21 963341972 PGFVAAARXMVJTQ-ROUUACIJSA-N 382.248 4.038 50 1 GIGF Cc1cc(N(CCCl)CCCl)ccc1[C@H]1NCCc2ccc(O)cc21 963354661 XTPOGJZARKFUFU-HXUWFJFHSA-N 379.331 4.220 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 169359025 UZRHATKYSCLMQF-HDYBAZQVSA-N 380.403 4.163 50 1 GIGF COC(=O)/C=C(\CC[C@@H]1C(C=O)=CC[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O 238747705 DWQLMTINEJBFII-GURSNZFUSA-N 390.520 4.407 50 1 GIGF Cc1noc(C)c1[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 587687849 IWOAQEFGLVRYGA-PWJLMRLQSA-N 387.680 4.210 50 1 GIGF [C-]#[N+][C@]12C(=O)[C@H](C=C(Cl)[C@@]1(C)C=C)C(C)(C)[C@H]1C(=O)N(C)c3cccc2c31 195927150 XIXVXXYJRITWPP-YLBNWIERSA-N 380.875 4.415 50 3 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CBr)C1CCC1 587537567 HWNQIIUFWCIBDK-APWZRJJASA-N 389.245 4.288 50 1 GIGF CCCc1c(O)ccc2c1O[C@H](c1cc([N+](=O)[O-])cc(CCl)c1O)CC2=O 587459980 JTEAYOHPWXXFJV-KRWDZBQOSA-N 391.807 4.404 50 1 GIGF COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C\c3ccccc3)nc2c1 587188816 XEUDPPQMNTXGGW-QPEQYQDCSA-N 382.217 4.176 50 1 GIGF O=C(N/N=C/c1ccncc1)c1cccnc1Nc1cccc(C(F)(F)F)c1 98082081 GQFYNALHLSPEMR-BRJLIKDPSA-N 385.349 4.003 50 1 GIGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)C(CO)=CC[C@@H]12 138981980 MXJNOJNIEWXXFS-ABHRYQDASA-N 396.163 4.047 50 1 GIGF C[C@@H]1CC[C@@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 195310696 IGHHGSMGNAAZGN-ZJCSWCTASA-N 385.504 4.067 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 587086895 IHCDIDQCABGBLV-JTQLQIEISA-N 375.039 4.381 50 1 GIGF Cc1ccc([C@]2(CCl)N[C@H](C(=O)O)Cc3c(Cl)cc(F)c(F)c32)s1 962972399 UQNKEOUAELDHPI-ZBEGNZNMSA-N 392.254 4.069 50 1 GIGF CC1(C)C[C@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]23C1 100234797 CWCXONZIEDNVKI-UGGNJGMFSA-N 399.325 4.010 50 1 GIGF in-vitro N#CC1=C(N)Oc2c(N)cc3nc4ccccc4nc3c2[C@@H]1c1ccccc1Cl 1772634858 ANQGTAVFBAXZSG-GOSISDBHSA-N 399.841 4.237 50 1 GIGF CC(=CCl)[C@H]1CC(Cl)=C(C)[C@@](O)(C(Br)Br)O1 2356457836 CVIPXLIMSIYMFK-SCZZXKLOSA-N 394.918 4.235 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1cc(C)ccc1C)[C@@H](C2)C3=O 587414629 NUZBHIPIJRASGE-OXJNMPFZSA-N 387.273 4.350 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O 587425480 DGCTUIZFZVPAQR-KPZWWZAWSA-N 395.199 4.011 50 1 GIGF CCCCCCCCNC(=O)[C@]1(C)CC(c2ccc(C)cc2)=C(C#N)C(=O)N1 1772643858 BJAMUZGHZXLJGL-QHCPKHFHSA-N 381.520 4.028 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N=C=O)cc2)N1 587742048 PTQFFJYJIKZGFC-BBATYDOGSA-N 375.241 4.353 50 1 GIGF CCOC(=O)c1ccc(/N=N/N(C)C(=O)CCCCc2ccc(O)cc2)cc1 1772639727 LBSUHMQMBCZKKM-GHVJWSGMSA-N 383.448 4.439 50 1 GIGF Cc1ccc(/C=N/N2C(=O)[C@H](C)[C@@H]3CC[C@@H](C)[C@@H]4CC[C@@]5(C)OO[C@]43[C@H]2O5)cc1 169308370 DMWWEDWGWROZFD-RQVXWQPTSA-N 398.503 4.023 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(c2ccccn2)[C@@H]1c1ccc(F)cc1 587329451 XVPVZUOUAGWUBT-CTNGQTDRSA-N 383.806 4.420 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc3c(c1)CCC3)O2 587374517 OYOQVUSETNLQSD-FQEVSTJZSA-N 386.289 4.322 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1F)([C@@H](C)Br)O2 587384895 KNYCDLPDSKBVPP-MLCYQJTMSA-N 396.231 4.500 50 1 GIGF COc1cc2c3c(c1)O[C@](CCl)(Cc1c(F)cccc1Cl)[C@@H](C2)C3=O 587424361 NQOBZGITLPRKDB-DJJJIMSYSA-N 381.230 4.455 50 1 GIGF Cc1noc(C)c1[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 587687832 IPPPISCJUHSUCY-BCTVWOGZSA-N 387.680 4.210 50 1 GIGF C[C@@]1([C@@H](Br)Cc2ccc(F)cc2F)NCCc2ccc(O)cc21 963341973 PGFVAAARXMVJTQ-ZWKOTPCHSA-N 382.248 4.038 50 1 GIGF Cc1ccc(N/C=C2\C=C3C(=CC2=O)OC(N)=C(C#N)[C@@H]3c2ccccc2)cc1 100538077 FSXSVJRMDSBAAP-AKXFXYSNSA-N 381.435 4.192 50 3 GIGF COc1ccc(-c2cc(-c3ccccc3)c(-c3ccccc3)n2CC(=O)NN)cc1 66078660 XMPNEBFDEFDFFR-UHFFFAOYSA-N 397.478 4.488 50 1 GIGF COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1/C(=C(\C)C=O)CC[C@@]1(C)O3 84710411 ZSKLSJMYNRFZJZ-VDZCTEQFSA-N 380.396 4.096 50 1 GIGF COc1ccc(-c2cc(=O)c3c(OC)c4ccoc4c(/C=C/C=O)c3o2)cc1 169354117 NWWCCNDERPDVLQ-ONEGZZNKSA-N 376.364 4.436 50 1 GIGF CCOc1ccc(-c2csc(/C(C#N)=C/[c-]3ccc(=O)c([N+](=O)[O-])c3)n2)cc1 169689162 MOXISCZUDYOVNA-OQLLNIDSSA-N 392.416 4.260 50 1 GIGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@@]2(N1)C(C=O)=COc1ccc(Cl)cc12 962950577 NRYSCDAGRYHCQH-OYHNWAKOSA-N 378.859 4.464 50 1 GIGF N#C/C(=C/c1ccccc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O 587189132 YKSLDQJKCVGZOO-QINSGFPZSA-N 375.387 4.402 50 1 GIGF Cc1cccc(Nc2ncnc3ccc(NC(=O)N(CCCl)N=O)cc23)c1 34339745 ONOZVTJDHKAIOL-UHFFFAOYSA-N 384.827 4.436 50 1 GIGF CC1(C)C[C@H]2[C@H](C=C(C=O)[C@]3([C@@H]4NCCc5c(C(=O)O)cccc54)C[C@]23C)C1 963132773 CHZIQWGNKNBAMU-NKSFJDBCSA-N 379.500 4.159 50 1 GIGF O=C(O)c1csc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 587533125 UMQKWLWQGLPHTD-IBGZPJMESA-N 376.861 4.425 50 1 GIGF NCCOCc1nc2cc(S(F)(F)(F)(F)F)cc(Br)c2[nH]1 587245770 XJBGZZBACLFOQU-UHFFFAOYSA-N 396.179 4.458 50 1 GIGF O=C1C[C@](CBr)(C2CCOCC2)Oc2c1ccc1c2CCCC1 587497402 CHNLJKVXWLHTMV-IBGZPJMESA-N 379.294 4.091 50 1 GIGF Fc1c([C@]2(CBr)NCCc3cccc(Cl)c32)ccnc1Cl 963377640 CQEXDHWKCQLGAQ-HNNXBMFYSA-N 390.083 4.312 50 1 GIGF CCO/C(O)=C1\C(C[S@](=O)c2ccccc2)=NC(C)=C(C#N)[C@@H]1c1ccco1 40810747 RFSFTDZEDALWJG-VYRVLUFASA-N 396.468 4.229 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O[C@H](C#N)c3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103036657 AKXUGEWGUZMDGE-JNHKUWJLSA-N 399.487 4.476 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(CBr)c(F)c1)[C@@H](C2)C3=O 587425917 HZHJZWQAXSPSJM-SCLBCKFNSA-N 377.209 4.218 50 1 GIGF CN(C)CCSSCCCC(=O)Nc1nc(Cc2ccccc2)cs1 618012510 KPXOQPGAGYXMNF-UHFFFAOYSA-N 395.619 4.396 50 1 GIGF CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 169324574 UZRHATKYSCLMQF-XQLAAWPRSA-N 380.403 4.163 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 169371495 SBCGDCBRWXAAIF-NZQABMISSA-N 386.488 4.398 50 1 GIGF C[C@H](NC(=O)/C(C#N)=C/c1cccc(Br)n1)c1ccc(Cl)cc1 73166104 PQNCDPXXAMRMCA-GJSJWPQCSA-N 390.668 4.282 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1NC(=O)CCl)CC2=O 587461918 VDMSIJIDBKBAFL-OAQYLSRUSA-N 387.863 4.403 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3ccccn3)c1C)O2 587374231 VGVVOFSLRGEVKS-QFIPXVFZSA-N 395.890 4.479 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(F)c(C(=O)Cl)c1 587894581 PXBNBNNBKFSARX-UHFFFAOYSA-N 398.648 4.222 50 1 GIGF CS(=O)(=O)/C(C#N)=C/c1cc(Cc2cccc(OC(F)(F)F)c2)ccc1F 1857617510 RFBVZVVVOFSCIY-MHWRWJLKSA-N 399.365 4.224 50 1 GIGF C[C@]12C=C3C(=O)C[C@H](c4ccccc4)C[C@@]3(OO1)O[C@@H]2c1ccc([N+](=O)[O-])cc1 96933989 QJJZTHNUOHCECI-ZJQURUERSA-N 393.395 4.156 50 1 GIGF O=C1c2ccc(O)cc2O[C@@](CCl)(c2cscn2)[C@H]1c1ccc(F)cc1 587374559 PDZQOWQDWTWUOR-HKUYNNGSSA-N 389.835 4.481 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCCCBr)cc1)O2 587375988 WJHOGSGUDYFANP-SFHVURJKSA-N 390.277 4.448 50 1 GIGF C[C@@]1(C=CBr)O[C@H]([C@@](C)(Br)CCl)C[C@H]1Cl 2356477517 YTOJCYQLVTZXDI-KATARQTJSA-N 380.935 4.442 50 1 GIGF CCCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2cccc(Cl)c21 40379972 SIELLYJORFCFRS-NKFKGCMQSA-N 383.879 4.401 50 1 GIGF Cc1cc(C)cc(C(=O)N(NC(=O)c2ccc3c(c2)O[C@@H](C)C3)C(C)(C)C)c1 103215827 CALDISSJISJPMY-INIZCTEOSA-N 380.488 4.213 50 1 GIGF CN(C)CCSSCCN(C)C(=O)c1cccc(Oc2ccccc2)c1 618010538 ZDZNHYFXQBVFBN-UHFFFAOYSA-N 390.574 4.494 50 1 GIGF CCOC(=O)[C@@H](Cl)[C@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 587494764 ABWPWTFMCCAAMB-CTNGQTDRSA-N 378.896 4.486 50 1 GIGF ClC[C@]1(c2cscn2)c2ccccc2C[C@H]2CN(c3ccccc3)CCN21 962627934 IIBMQCCPCRSMCQ-SIKLNZKXSA-N 395.959 4.372 50 1 GIGF CC1(C)[C@H]2CC=C(/C=N\NC(=O)CCCCCC(=O)Nc3ccccc3O)[C@@H]1C2 95809771 ONABVWUONYUNRU-QRHYHNLTSA-N 397.519 4.376 50 1 GIGF CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H]1Cl 587542654 ATFXVTGBTQWMKE-DCTVWTRXSA-N 388.847 4.287 50 1 GIGF N#CC(C(=O)c1ccc(Cl)cc1Cl)=C1NC(=O)c2ccc(Cl)cc2N1 1857743003 JKKSCGHDRHRWOQ-UHFFFAOYSA-N 392.629 4.420 50 1 GIGF COc1ccc(Cl)c2c1CCN[C@]2(CBr)CC[C@H]1CCCO1 963269527 KLFPNSPZRFCNTE-PXAZEXFGSA-N 388.733 4.044 50 1 GIGF COc1cc2c3c(c1)O[C@](CCBr)(c1ccc(F)cc1)[C@@H](C2)C3=O 587427604 JBQMQIWXBMTZHU-HNAYVOBHSA-N 391.236 4.262 50 1 GIGF CCCN1[C@@H](C)Cc2ccccc2[C@]1(CBr)c1cccc(OC)n1 963237692 YXXGGXIORTYJHY-MGPUTAFESA-N 389.337 4.385 50 1 GIGF CCN(CC)c1nc(SC)nc2c1cnn2C[C@H](Cl)c1ccccc1 13589894 IROGZYPJAAVIAT-HNNXBMFYSA-N 375.929 4.375 50 1 GIGF CCc1ccc(CC)c([C@@]2(CCl)N[C@H](C(=O)O)Cc3cc(F)ccc32)c1 962892543 GGBMMQWNIMXTPA-FPOVZHCZSA-N 375.871 4.032 50 1 GIGF C=C1C(=O)C=CC(C)(C)[C@]12C[C@@H](Br)[C@](C)(Cl)C[C@@H]2OC(C)=O 13379348 WJPXJFRAAMMVGZ-YALNPMBYSA-N 389.717 4.181 50 1 GIGF biogenic,in-vitro C[C@]12C=C3C(=O)C[C@@H](c4ccccc4)C[C@@]3(OO1)O[C@@H]2c1ccc([N+](=O)[O-])cc1 96933990 QJJZTHNUOHCECI-DHWLSRIRSA-N 393.395 4.156 50 1 GIGF CN(C)N(c1cc(C#CC(C)(C)C)sc1C(=O)O)C(=O)[C@H]1CC[C@H](C)CC1 103005825 LATMUSXHHVOIII-GASCZTMLSA-N 390.549 4.480 50 1 GIGF COc1ccc2[nH]c(C)c([C@@]3(CCl)CC(=O)c4cc(C)cc(N)c4O3)c2c1 587372445 LJSTWQMELRCMQD-NRFANRHFSA-N 384.863 4.475 50 1 GIGF COc1ccc2c(c1OC)[C@](C)(C(C#N)=C1Nc3ccccc3N1)N(C)[C@@H](C)C2 962571958 PKROLCKRNMHEEB-PSLXWICFSA-N 390.487 4.068 50 1 GIGF C[C@@H]1CC[C@H]2[C@@H](CCCc3ccccc3)C(=O)O[C@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 101273409 SBCGDCBRWXAAIF-HDBUIXBASA-N 386.488 4.398 50 1 GIGF O=C(N/N=C/c1ccc(O)cc1O)c1ccc(-c2nc3ccccc3s2)cc1 299870983 XJJOGZKFYNITIG-WSDLNYQXSA-N 389.436 4.138 50 1 GIGF C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 169342092 WDTIPJZJXSSSGU-LQXCBXNSSA-N 391.895 4.288 50 1 GIGF CC(=C[C@@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@@H]4C(C=O)=CC[C@H]23)O1)CO 2356324326 IXOCIELJWNTVCH-LMLFMBSESA-N 398.543 4.186 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCCCCCl)(C(=O)OCC)CC2=O 587460676 OOOUSMPQZCUTGE-FQEVSTJZSA-N 382.884 4.411 50 1 GIGF C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(O)cc2)N1 587685344 PTFDJKWYDMQRQN-DYZYQPBXSA-N 384.676 4.310 50 1 GIGF O=C(Nc1ccccc1)[C@@H](Cl)[C@]1(c2ccccc2)NCCc2ccc(O)cc21 963328388 FOOHQYKCZJLOQH-FYYLOGMGSA-N 392.886 4.028 50 1 GIGF N#CCC(=O)N/N=C\c1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12 15979488 AHVFEHJDCPIOGU-RMORIDSASA-N 385.254 4.360 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N=C=O)c2)N1 587743860 YGAVWHGESVDARM-ADLMAVQZSA-N 375.241 4.353 50 1 GIGF N#CC(C#N)=Cc1ccc(OCCSc2nnc(-c3ccc(F)cc3)o2)cc1 103186338 SXRIVDRWVHHQAN-UHFFFAOYSA-N 392.415 4.477 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 586973388 JLMRMFVJFMVDTD-LBPRGKRZSA-N 386.293 4.311 50 1 GIGF COc1cc2c3c(c1)O[C@](CBr)(C1(c4ccccc4)CC1)[C@@H](C2)C3=O 587412826 CNDBFWYWOZGWKC-KKSFZXQISA-N 399.284 4.308 50 1 GIGF O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1sccc1C(=O)Cl 587896881 RAHCFCPEMQNAJW-UHFFFAOYSA-N 386.687 4.144 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 586973217 GVRQUZQVWMVGBB-VIFPVBQESA-N 377.213 4.447 50 1 GIGF COc1cc2c3c(c1)O[C@@H](c1cc(CBr)ccc1F)[C@@H](C2)C3=O 587424563 PEZPMPGRUGRDCH-UGSOOPFHSA-N 377.209 4.218 50 1 GIGF COc1ccc([C@@H]2[C@@H](Cl)C(=O)N2Nc2ccnc3cc(Cl)ccc23)cc1 1772642952 QKYATZBPHAXODG-QZTJIDSGSA-N 388.254 4.415 50 1 GIGF C=C1[C@@H](CBr)O[C@@]2(C)CC[C@H](Br)C(C)(C)[C@@H]2C[C@H]1O 2356489832 LWYFAEHJQSCFQJ-BIGJJFBESA-N 396.163 4.046 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OCCCCl)c1)[C@@H](C2)C3=O 587420047 GBWIBZCIEKACFW-YCRPNKLZSA-N 388.847 4.200 50 1 GIGF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@@H]2Br)N1 587683781 PANADNMCIQWHOZ-YKHWKNEFSA-N 377.095 4.265 50 1 GIGF COc1cccc2cc3c(nc12)[C@@](C1CCC1)([C@@H](C)Br)NCC3 963059301 QNLATALVBKMKPL-BLVKFPJESA-N 375.310 4.168 50 1 GIGF O=C(N/N=C/c1ccc(O)cc1)Nc1ccc(Oc2cc[nH]c3nccc2-3)cc1 1857771400 FATYWASGRFAAKI-ZMOGYAJESA-N 387.399 4.168 50 1 GIGF CCO/C(O)=C1\C(CSc2ccncc2)=NC(C)=C(C#N)[C@@H]1c1ccccn1 40442353 XUNYSXMOSPLUAI-UOFXHNCJSA-N 392.484 4.411 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2C2(CC(CBr)C2)N1 587672804 IBTYTVDATAXGEN-NQTXRORDSA-N 377.095 4.123 50 1 GIGF C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cscn2)N1 587852732 ICQQGSAQFSFEQY-RTHLEPHNSA-N 375.694 4.061 50 1 GIGF CC(C)[C@@H]1C[C@H]2[C@H](O)C[C@@]13CC[C@@]1(C)[C@H]([C@@H]23)[C@@](C)(O)CC[C@H]1Br 2356671205 QYWKYBMMQNPDJT-RKQBELTPSA-N 385.386 4.370 50 1 GIGF Cc1ccc2c(c1CC[C@@H](Br)C(C)(C)O)C(=O)C(=O)C(C(C)C)=C2 26652470 REGVXHGIAQRHEZ-MRXNPFEDSA-N 393.321 4.267 50 1 GIGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(NC(=O)C(C)C)cc1)O2 587372399 KZDMVNQYRJTHSX-NRFANRHFSA-N 386.879 4.271 50 1 GIGF COc1cc2c3c(c1)O[C@@](CBr)(C1(c4ccccc4)CC1)[C@@H](C2)C3=O 587412825 CNDBFWYWOZGWKC-HRAATJIYSA-N 399.284 4.308 50 1 GIGF CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(N(C)C=O)cc1)CC2=O 587459960 JIWDTBUSWBQACW-OAQYLSRUSA-N 387.863 4.037 50 1 GIGF O=C(Cl)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 587542217 GDBZKCCZYAMKKQ-FXAWDEMLSA-N 380.783 4.474 50 1 GIGF CC(=O)O[C@@H]1CC/C(=C\C=O)CO[C@@]1(C)CCC[C@H](C)C(=O)CC=C(C)C 27890129 HVKGLFXDAZKVNN-WBVLRSDDSA-N 378.509 4.344 50 1 GIGF O=Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c[nH]1 587325435 FNAICAQGJWLSTJ-TZIWHRDSSA-N 399.805 4.165 50 1 GIGF CCCc1c(O)ccc2c1O[C@@](C(=O)Cl)(c1c[nH]c3ccccc13)CC2=O 587458028 FHHDCGMQTTVADN-OAQYLSRUSA-N 383.831 4.452 50 1 GIGF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(C(Cl)Cl)N1 587689446 SMVLAUJDDRMUPI-INWYIAFRSA-N 375.496 4.360 50 1 GIGF Cc1ccc2c(c1)[C@]1(N[C@@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 587740875 LELJGNXYJOYUAR-YUNKPMOVSA-N 399.263 4.474 50 1 GIGF CCCCNS(=O)(=O)c1ccc2nc(/C(C#N)=C/c3ccc(C)cc3)[nH]c2c1 587188877 XWIDXEIXMYFCSL-SFQUDFHCSA-N 394.500 4.014 50 1 GIGF COc1cc2c3c(c1)O[C@H](c1cc(F)cc(CBr)c1)[C@@H](C2)C3=O 587428671 NXYYYDAOSMNTTR-KBXCAEBGSA-N 377.209 4.218 50 1 GIGF COCCCN1CCc2ccc(OC)cc2[C@@]1(C(C)C)[C@@H](C)Br 961321638 KCXGARHINWPQFR-DNVCBOLYSA-N 384.358 4.225 50 1 GIGF C[C@H](C(=O)NNC(=O)NC1CCCCC1)c1cccc(Oc2ccccc2)c1 84604005 PKHFXVUUABLKDC-INIZCTEOSA-N 381.476 4.246 50 1 GIGF O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 103196258 DWAVMDSJIRPCPO-HOTGVXAUSA-N 385.832 4.127 50 1 GIGF COc1cc2c3c(c1)O[C@](c1cccc(C)c1)([C@H](C)Br)[C@@H](C2)C3=O 587412328 AKVMMTPDDKKPQB-APXLUKDGSA-N 387.273 4.430 50 1 GIGF CCOCC1=C(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 103184983 JMEFAWJXGLEOCT-DGUCZMLGSA-N 378.387 4.085 50 1 GIGF O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 103196245 XMVQHNUPHYJXOS-JKSUJKDBSA-N 385.832 4.127 50 1 GIGF COc1ccc(Cl)cc1C#Cc1ccc(F)c(C(=O)CBr)c1 587915419 OAMRPCGSQJXBKC-UHFFFAOYSA-N 381.628 4.465 50 1 GIGF Cc1cc(Cl)cc(C(=O)NNCc2ccccc2F)c1NC(=O)C(C)(C)C 103211815 ZXVZMMGILNKTED-UHFFFAOYSA-N 391.874 4.207 50 1 GIGF Cc1ccc(/C=N\NC(=O)[C@@H](C)Oc2cc(Cl)c(Cl)cc2Cl)o1 103188061 XETQVIWYDFNDKX-RDIJIJPQSA-N 375.639 4.466 50 1 GIGF COc1cc2c3c(c1)O[C@]1(c4ccsc4CC[C@H]1Br)[C@@H](C2)C3=O 587453634 RNLWFFQZXCQRPQ-WBHUJUFNSA-N 391.286 4.109 50 1 GIGF O=C1c2ccc(O)cc2O[C@](CCl)(c2cscn2)[C@@H]1c1ccc(F)cc1 587374565 PDZQOWQDWTWUOR-IEBWSBKVSA-N 389.835 4.481 50 1 GIGF C[C@@H](c1ccc(CBr)cc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 586973338 HYWQLBPBMIXDSS-VIFPVBQESA-N 377.213 4.447 50 1 GIGF Cc1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)[nH]1 587541582 CIMUFAPOJSPJKK-WIYYLYMNSA-N 383.831 4.433 50 1 GIGF Cc1cc(C)c(C)c([C@]2(CCl)NCCc3ccc(C(=O)N(C)C)cc32)c1C 962934116 JUYWSOGTABVUDJ-HSZRJFAPSA-N 384.951 4.250 50 1 GIGF CC=CC[C@@H]1O[C@H]([C@@H]2C[C@H](Br)[C@@H](CC)O2)C[C@@H]1Br 2356782369 DXFOROLMOVEIQX-XQZGEAEESA-N 382.136 4.205 50 1 GIGF CC(C)(F)[C@@H](Br)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587087935 ZCWBCWGKHWMCAO-VIFPVBQESA-N 395.026 4.418 50 1 GIGF COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(Br)cc1)[C@@H](C2)C3=O 587419024 RGPNWOFYBVVUHI-KSSFIOAISA-N 393.664 4.339 50 1 GIGF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(C(=O)Cl)c1ccc(F)cc1 587573730 XCIWTDWDPCOOEU-DYESRHJHSA-N 398.773 4.154 50 1 GIGF