smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)no1 1894827 FZLIBLPYVZNDSB-XFXZXTDPSA-N 393.515 3.665 10 40 GHCB aggregator COc1ccc(N2C(=O)N=C(O)/C(=C\c3ccc(N4CCCCC4)o3)C2=O)cc1 2237349 ZMFKZWBIEWWXEB-GHRIWEEISA-N 395.415 3.785 10 40 GHCB O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2F)SC1=S 5374129 SYUMGYJBXUIHIZ-CNYBTUBUSA-N 387.457 3.723 10 40 GHCB Cc1ccc(C2=N/C(=C/c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C(=O)O2)cc1 6912415 JMRNXPMRAMQINX-SFQUDFHCSA-N 377.400 3.848 10 40 GHCB CN(C)c1ccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)cc1 12414026 DRIZUSKVXOXVBK-QINSGFPZSA-N 378.519 3.599 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)Nc1ccc(C)c(C)c1 112119870 PMWKKZJOLDFQKU-PGMHBOJBSA-N 377.444 3.955 10 40 GHCB Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1[N+](=O)[O-] 223644286 CTEJYINAIUQBMG-UHFFFAOYSA-N 396.424 3.935 10 40 GHCB O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/Nc1ccc(Cl)cc1 100401391 LRKLZUNILLTGKW-FMIVXFBMSA-N 376.199 3.572 10 40 GHCB COC(=O)c1c(NC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)O)sc2c1CCCC2 4651476 FNFQUUVVMMQRLD-ZIAGYGMSSA-N 391.489 3.799 10 40 GHCB CCOc1cc(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c1 408872103 KLAYXGRANMGQHR-ZROIWOOFSA-N 388.782 3.544 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)c1C 409095184 HKGUWRBQYIJLGT-MHWRWJLKSA-N 387.892 3.610 10 40 GHCB COC(=O)C1=CN(c2ccc(C(C)C)cc2)c2ccc(F)cc2S1(=O)=O 64979230 HOROFVFOFYZAGC-UHFFFAOYSA-N 375.421 3.889 10 40 GHCB Cc1ccccc1C(=O)NC[C@@H](c1ccc2c(c1)CCN2C)N1CCCCC1 13007671 CZXMEJLJCXUJAQ-QHCPKHFHSA-N 377.532 3.944 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)CCc3ccccc3)N3CCCC3)ccc21 8963304 FJAHARSEJTZAPY-QHCPKHFHSA-N 377.532 3.565 10 40 GHCB CC(=O)O[C@@H](C)c1cc2c(s1)C(=O)c1scc([C@H](C)OC(C)=O)c1C2=O 1652353 JFEMGTTXNHRUOR-YUMQZZPRSA-N 392.454 3.833 10 40 GHCB COc1ccc(N2C(=O)c3ccc(Oc4ccc(N)cc4)cc3C2=O)cc1OC 2944677 GHYHNKPGQFLOLU-UHFFFAOYSA-N 390.395 3.879 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(N4CCCCC4)cc3)CC2)cc1 7504913 IWKGGVYPMQCZOQ-UHFFFAOYSA-N 379.504 3.648 10 40 GHCB Cc1nc(COC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)oc1C 58309318 BCOGKEKHBRPVBW-UHFFFAOYSA-N 382.416 3.827 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/Nc3ccc(Cl)cc3Cl)C2=O)c1 100925625 RRYMXVDNEVNWPH-LCYFTJDESA-N 390.226 3.881 10 40 GHCB O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C/Nc1ccc(F)cc1F 408530011 IJKJMSAWFMKAQT-RVDMUPIBSA-N 393.349 3.697 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1Cl 408780883 MQBBEPXBUVSRBY-DHDCSXOGSA-N 384.819 3.632 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3cccn3CCOc3cc(C)ccc3C)C(=N)N2O1 17355391 LEPBMXMHASVGSJ-RVNILFKFSA-N 390.443 3.634 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)c2C)cc1 22008111 YRJZVEMHFVWOMR-UHFFFAOYSA-N 376.416 3.525 10 40 GHCB Cn1cc(/C=C2/SC(=S)N(NC(=O)c3cccs3)C2=O)c2ccccc21 409347332 PQCVGOGIHWPKTA-OQLLNIDSSA-N 399.522 3.786 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccccc1 408813896 YWAUAMIRHQFMJN-HMMYKYKNSA-N 398.418 3.932 10 40 GHCB CCN(CC)c1ccc(CNC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 224762121 VJRPKQMGZAEDPZ-UHFFFAOYSA-N 387.505 3.991 10 40 GHCB CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C\c1ccc2c(c1)OCO2 13603098 IEPBLSKNHBUBGH-NVNXTCNLSA-N 385.217 3.984 10 40 GHCB O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 6061375 YOXUOPFXFNNIAV-KFXIKWRMSA-N 387.457 3.723 10 40 GHCB O=C1NN(c2ccc(F)c(Cl)c2)C(=O)/C1=C\c1ccc(Cl)c([N+](=O)[O-])c1 5749356 HYQUAGYUSRYQBT-YHYXMXQVSA-N 396.161 3.502 10 40 GHCB O=C1/C(=C\c2nc3ccccc3[nH]2)C(O)=NC(=S)N1c1ccc(Cl)cc1 6813986 CDICUBDJWVPZDQ-XFXZXTDPSA-N 382.832 3.888 10 40 GHCB Cc1occc1C(=O)NN1C(=O)/C(=C/c2ccc3ccccc3n2)SC1=S 13690986 NWVWIVTWGQZDJV-YBEGLDIGSA-N 395.465 3.682 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)c(C)n1-c1ccccc1 17299994 SPXGKDMELWNCBN-XSFVSMFZSA-N 391.471 3.889 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/Nc1ccc(C(=O)N(C)C)cc1 103807146 DDBCDTKBGRIJTH-LDADJPATSA-N 382.851 3.760 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N(CNc2ccccc2OC)C1=O 408722442 UFOPSSQIENTAJD-GZTJUZNOSA-N 386.498 3.975 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1Cl 408781216 BBCWSBXUWQUZIW-RIYZIHGNSA-N 388.782 3.544 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 408895990 WSQYAGQBKRGXNJ-PDGQHHTCSA-N 378.384 3.780 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=S)N(c2cc(C)cc(C)c2)C1=O 408988705 IXPKYPAEFFFORP-SFQUDFHCSA-N 380.469 3.533 10 40 GHCB Cc1ccc(O)c([C@H]2CC(c3ccccc3Cl)=NN2C(=O)/C=C\C(=O)O)c1 80316250 GCDGNYGEFLSAQN-XZVRFQMRSA-N 384.819 3.673 10 40 GHCB CCCOc1ccc(-c2c3c(nc4nc(N)nc(N)c24)-c2ccccc2C3=O)cc1 10339128 QBFDOHRYRXPRQF-UHFFFAOYSA-N 397.438 3.856 10 40 GHCB COc1ccc(NS(=O)(=O)c2ccc(-n3c(C)ccc3C)cc2)c(OC)c1 58850508 DQQDQGVSYABVFP-UHFFFAOYSA-N 386.473 3.912 10 40 GHCB CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2cc(C)n(C(C)C)c2C)C1=O 409229145 KHTZAHDJYITPLI-SFQUDFHCSA-N 395.459 3.751 10 40 GHCB Cc1ccc(OS(=O)(=O)c2cccc3c2C(=O)c2ccccc2C3=O)cc1 5234072 LBALJCREZLZDCO-UHFFFAOYSA-N 378.405 3.538 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)cc1C 408859127 SYRMYCHKIJVION-RIYZIHGNSA-N 399.790 3.531 10 40 GHCB CCOc1ccc([C@@]2(O)CN(c3cccc(C)c3C)C3=[N+]2CCCS3)cc1 17307547 MGACWSMWVPIEBW-QFIPXVFZSA-N 383.537 3.873 10 40 GHCB COC(=O)c1c(NC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)O)sc2c1CCCC2 4651478 FNFQUUVVMMQRLD-UONOGXRCSA-N 391.489 3.799 10 40 GHCB C[C@H](Oc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 10907221 PJISWGYYKLERID-INIZCTEOSA-N 388.895 3.603 10 40 GHCB CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cccc(C(N)=O)c1 29030125 BBRWSYDBDBOSAI-UHFFFAOYSA-N 395.484 3.732 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2ccccc2)c1 408939354 RVDDHGJPBXJIEI-QNGOZBTKSA-N 398.418 3.932 10 40 GHCB COc1cc(OC)c(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1Cl 409084216 XEEIHFAKAVYCJS-URXIRXLPSA-N 399.921 3.737 10 40 GHCB CCn1cc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c2ccccc21 13810446 PRCFKUVSFGLLEX-BOPFTXTBSA-N 393.830 3.981 10 40 GHCB CC(=O)Nc1cc(C)cc(/N=N/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)c1O 16267111 YRAINWPKPRBSTH-ISLYRVAYSA-N 375.297 3.596 10 40 GHCB CCOc1ccccc1N1C[C@@](O)(c2ccc(Cl)cc2)[N+]2=C1SCCC2 27525059 QNRSUCKWUAMJBI-HXUWFJFHSA-N 389.928 3.909 10 40 GHCB C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(O)c(Cl)c3)cc2F)C[C@@H](C)O1 57372509 QKGPGZONIWNWKU-CHWSQXEVSA-N 392.858 3.728 10 40 GHCB C[C@@H](NC(=O)NCC1(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 65435216 ZHJLHNCMCKUJFN-GOSISDBHSA-N 379.504 3.615 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nnc(-c4cccc(C)c4)n3c2=O)cc1 9189356 RLMCSACUAMSAME-RGEXLXHISA-N 390.512 3.520 10 40 GHCB COc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)c(Cl)c3)C2=O)cc1 408740309 JYGOFRCTYDXLSB-MDWZMJQESA-N 391.210 3.668 10 40 GHCB Cc1ccc(NC2=NC(=O)/C(=C/c3ccc(O[C@H](C)C(=O)O)cc3)S2)cc1 210836625 UXZMRJURIWHVGJ-GPLLRDDGSA-N 382.441 3.929 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C\c3ccc(C)cc3)SC2=S)cc1 1417320 SBOYTLXUMHTFKK-LFIBNONCSA-N 384.482 3.550 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)c3ccc(O)c(Cl)c3)cc2F)C[C@H](C)O1 57372507 QKGPGZONIWNWKU-STQMWFEESA-N 392.858 3.728 10 40 GHCB O=[N+]([O-])c1ccc(OC(F)F)c(CNCCCSc2nccs2)c1 72289951 BFDCAHWRZTWLNO-UHFFFAOYSA-N 375.422 3.925 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)c(C)n1-c1ccc(F)cc1 409197680 MCATYTDSIIZFRX-UNOMPAQXSA-N 395.434 3.638 10 40 GHCB CCOc1ccc([C@@]2(O)CN(c3cc(C)ccc3C)C3=[N+]2CCCS3)cc1 17307531 DPJSBNATTJNQGI-QFIPXVFZSA-N 383.537 3.873 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(-c3ccccc3F)o2)SC1=S 5429131 MUFFOAIRBWYSLL-PFMRQGHBSA-N 377.418 3.760 10 40 GHCB COc1ccc2ccccc2c1/C=C1\C(=O)NN(c2ccc(Cl)cc2)C1=O 859648 PYNCSKTWUGLVCT-LDADJPATSA-N 378.815 3.963 10 40 GHCB COC(OC)(c1ccccc1)c1n[nH]c2c3c(ccc12)C(=O)c1ccccc1C3=O 4817781 ARZFYNKIHZOZHO-UHFFFAOYSA-N 398.418 3.832 10 40 GHCB COc1ccc(/C=C2\SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)c(OC)c1 5372580 JKQOROKEPQHHSB-ZDLGFXPLSA-N 397.456 3.745 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCCCCC1 5555128 JLHYZVGJCMYRJC-WYMLVPIESA-N 380.560 3.742 10 40 GHCB Cc1nn(-c2ccccc2)c2c1CC1(C(=O)c3ccccc3C1=O)[C@H]1CCCN21 6558865 CRPRWBVHNBNMBO-HXUWFJFHSA-N 383.451 3.771 10 40 GHCB COc1ccc(OC)c(/C=C2\SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)c1 54164268 URZWHZJYHZLDFO-YVLHZVERSA-N 398.440 3.793 10 40 GHCB COc1ccc([C@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)c(OC)c1 89434783 MFJBFMGBOWFOOG-GOSISDBHSA-N 392.411 3.994 10 40 GHCB Cc1cc2c(cc1/C=C1\C(=O)NC(=S)N(C)C1=O)[C@H](C)CC(C)(C)N2C(C)C 223587125 DXBHFNMKAQTNGX-NGWPFTMJSA-N 399.560 3.752 10 40 GHCB COc1ccc(N2CCN(C(=O)c3oc4ccc(OC)cc4c3C)CC2)cc1 7642922 DUIVFMJBKMTDFB-UHFFFAOYSA-N 380.444 3.721 10 40 GHCB CCN(CC)c1ccc(CNc2ccc(N3CCOCC3)c(C(=O)OC)c2)cc1 4705460 VYXZXTFOAHZQIF-UHFFFAOYSA-N 397.519 3.768 10 40 GHCB Cc1noc(C)c1COc1ccccc1C(=O)NCc1ccc(N(C)C)cc1 28020649 ATKIMTPKIVYTRU-UHFFFAOYSA-N 379.460 3.866 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCCC4)cc3)C2=O)cc1 408901768 ZVRIZPDJEILYLE-HMMYKYKNSA-N 389.455 3.652 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(C)c1 408988824 RRNBEMHVSFPNAD-SXGWCWSVSA-N 384.819 3.632 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccccc2F)o1 1424491 CLGXQBFSHFXRAN-FOWTUZBSSA-N 376.343 3.752 10 40 GHCB CCOC(=O)c1ccc(C)c(NC(=S)NCCCN2CCc3ccccc32)c1 225560587 QVYNEVDFIJCAHB-UHFFFAOYSA-N 397.544 3.911 10 40 GHCB S=C(NCCCN1CCCc2ccccc21)Nc1ccc2c(c1)OCCO2 225745865 MZFZCQYBMVMQAW-UHFFFAOYSA-N 383.517 3.587 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)sc2c1CC[C@H](C)C2 17080416 KNTLMNCJNFJXAY-YNEHKIRRSA-N 393.505 3.879 10 40 GHCB COc1ccc(-c2cc(=O)oc3c(CNCc4cccnc4)c(O)ccc23)cc1 6673205 JOUNQJJZFDJBJV-UHFFFAOYSA-N 388.423 3.859 10 40 GHCB CCCN1C(=O)/C(=C\c2ccc(I)cc2)SC1=S 35351509 KLDRCOKJPUHUOC-DHZHZOJOSA-N 389.283 3.902 10 40 GHCB CN(C)c1ccc(CN2CCOC[C@H]2c2nc(-c3ccc(F)cc3F)c[nH]2)cc1 225400064 HJESDRYQJILAJC-NRFANRHFSA-N 398.457 3.994 10 40 GHCB biogenic,in-vitro COc1cccc(OC)c1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 5746099 DMYNSNMNYBUUCC-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB Cc1ccc(COc2ccccc2/C=C2/SC(N3CCOCC3)=NC2=O)cc1 16661779 OJLXGKRLBOFELX-XSFVSMFZSA-N 394.496 3.877 10 40 GHCB CN(C)c1ccc(CN2CCCC[C@@H]2c2cc(=O)[nH]c(-c3ccccn3)n2)cc1 19584971 HNQBBBCRJWNNMK-OAQYLSRUSA-N 389.503 3.625 10 40 GHCB COC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2C)C1=O 409066636 PEBLTKRSHQOABW-IQGJIOQQSA-N 388.489 3.583 10 40 GHCB Cc1cccc(COc2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c1 409337997 BAWDXQRZKCUHEG-YVLHZVERSA-N 399.493 3.860 10 40 GHCB CCN1C(=O)/C(=C/c2cc(OC)c(N3CCCC3)cc2OC)SC1=S 409378154 MSIUWGDZXZLTGT-YBEGLDIGSA-N 378.519 3.525 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(Br)cc2)c1 7496762 HXEABDMQSXYRJC-UHFFFAOYSA-N 391.265 3.547 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S 966991 JXPDZYUODGTZMZ-GPLLRDDGSA-N 399.493 3.940 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(c2ccc(C(=O)O)c(O)c2)C1=O 4356812 PMZQLQGQIFIKPD-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB COc1ccc(N2C(=O)N=C(O)/C(=C\c3cc(C)c(O)c(C)c3)C2=O)c(OC)c1 38173695 HCGHAWJDDMHABF-OQLLNIDSSA-N 396.399 3.533 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2ccccc2F)SC1=S)N1CCCCCC1 4176461 DVPRIVYBOGIOKN-SSZFMOIBSA-N 392.521 3.820 10 40 GHCB COc1ccc(NS(=O)(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1OC 6235027 QFDPJXFGISXDQU-UHFFFAOYSA-N 386.473 3.912 10 40 GHCB CCN(CC)c1ccc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)cc1 33696473 SGJLFPWANRLALC-NTCAYCPXSA-N 378.519 3.599 10 40 GHCB O=C(O)COc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1 1416187 ANHOIRAJFZJBRQ-XNTDXEJSSA-N 377.487 3.684 10 40 GHCB CN(C)c1ccc(CNC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1 7243791 VHTOVNGPIRTGLR-UHFFFAOYSA-N 383.492 3.707 10 40 GHCB COc1ccc(NCN2C(=O)/C(=C\c3ccccc3OC)SC2=S)cc1 408722191 RASXEGNZGHMMFE-GZTJUZNOSA-N 386.498 3.975 10 40 GHCB COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 408802874 IPPCBDRMKIURRW-RIYZIHGNSA-N 391.210 3.668 10 40 GHCB CC(C)Cn1cc(C(F)F)c(C(=O)NCc2ccc3c(c2)CCCN3C)n1 134873379 RSOLXHRQFZWHGQ-UHFFFAOYSA-N 376.451 3.789 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(Cl)cc1Cl 5715306 YWQPRGLXVWHPIX-NTUHNPAUSA-N 379.174 3.799 10 40 GHCB CCN1CCC2(CC1)Oc1ccccc1[C@@H]1CC(c3ccc(O)c(OC)c3)=NN12 5093400 CYILUWOXRHDJTG-IBGZPJMESA-N 393.487 3.756 10 40 GHCB O=C1NC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C(=O)/C1=C\c1ccco1 408942633 ZUGAQHSJAJKXKE-YFHOEESVSA-N 384.697 3.618 10 40 GHCB CCc1ccc(N2C(=O)/C(=C/c3ccc(N(C)C)cc3)C(O)=NC2=S)cc1 33850385 HLGCEEBLEAIKOI-QGOAFFKASA-N 379.485 3.987 10 40 GHCB COc1ccc(C2=C/C(=C/c3cc(OC)c(OC)cc3[N+](=O)[O-])C(=O)O2)cc1 5720469 JDNHRAPNAJWXBL-ZSOIEALJSA-N 383.356 3.602 10 40 GHCB COc1ccc(N2CCN(CC(=O)c3c[nH]c4ccc(OC)cc34)C[C@@H]2C)cc1 35369238 YCSNFBNKAMBTGJ-INIZCTEOSA-N 393.487 3.579 10 40 GHCB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCc3ccc(N4CCCC4)cc3)c12 36616228 FVHFCTXCNTVJTC-UHFFFAOYSA-N 389.503 3.684 10 40 GHCB Cc1cc(C(=O)[C@H](C)OC(=O)C2=COCCO2)c(C)n1-c1ccc(Cl)cc1 3545492 QAOGACSISNJOKR-AWEZNQCLSA-N 389.835 3.750 10 40 GHCB O=C1c2ccccc2C(=O)c2c1oc1c3c(ccc21)OCN(Cc1ccccn1)C3 19863950 RGCDNJSMYYQKOU-UHFFFAOYSA-N 396.402 3.955 10 40 GHCB Cc1cccc(Nc2cc(NCCO)c(N)c3c2C(=O)c2ccccc2C3=O)c1 4624146 NJWCQYAUNRELFU-UHFFFAOYSA-N 387.439 3.500 10 40 GHCB COc1cc(NC(=O)CSc2ncc(-c3ccccc3)n2C)cc(OC)c1 7423201 PKMYBNCMNDWEJR-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\Nc3ccc4c(c3)CCC4)C(=O)NC2=S)cc1C 101072488 YENZZDDMEZBLEB-UNOMPAQXSA-N 391.496 3.536 10 40 GHCB COc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OC(=O)c1cccs1 1219244 SXPZVVLYVCSCNQ-ZROIWOOFSA-N 391.495 3.807 10 40 GHCB Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N1CCCCC1 6973035 BFSKGROPULQOQA-UHFFFAOYSA-N 394.338 3.954 10 40 GHCB COc1ccc(N2CCN(C(=O)/C=C/c3cc(C)n(C4CC4)c3C)CC2)cc1 7220037 IGTUKELSQJXNFQ-NYYWCZLTSA-N 379.504 3.810 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)Nc1cc(C)cc(C)c1 17077200 YDKLSKFNHKBTGP-PGMHBOJBSA-N 377.444 3.955 10 40 GHCB c1ccc(CN2CCC(N3CCCN(c4ccc5c(c4)OCO5)CC3)CC2)cc1 72347939 SJLLEAYZSPTSEU-UHFFFAOYSA-N 393.531 3.592 10 40 GHCB COc1ccc([C@@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)c(OC)c1 89434781 MFJBFMGBOWFOOG-SFHVURJKSA-N 392.411 3.994 10 40 GHCB O=C(O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(O)c3ccccc23)c1 226860758 SQEBQOMFJAZDIG-UHFFFAOYSA-N 377.805 3.698 10 40 GHCB O=C(c1cc2cc(Cl)ccc2o1)N1CCN(c2ccc3c(c2)OCO3)CC1 408610510 RPBSQKHUGITHFC-UHFFFAOYSA-N 384.819 3.777 10 40 GHCB CCOc1cc(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)c1 408874334 AFGBOYVMVTWFTA-BOPFTXTBSA-N 398.846 3.968 10 40 GHCB O=S(=O)(Cc1ccccc1Cl)NCc1ccc(N2CCCCC2)cc1 10113265 KXFKUEIMRIWTEW-UHFFFAOYSA-N 378.925 3.950 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3cccc4nccnc34)SC2=S)cc1 13721925 BHJGIHHSJBODCY-GDNBJRDFSA-N 393.449 3.734 10 40 GHCB COc1ccc(-n2c(C)cc(/C=C3\C(=O)NN(c4ccccc4)C3=O)c2C)cc1 6961777 TUQIZSWJEQBXKY-KGENOOAVSA-N 387.439 3.564 10 40 GHCB O=C1N/C(=C\c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccc(F)cc1 6269168 PYGINVLQWBIKOM-ZHZULCJRSA-N 379.435 3.909 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)cc1 4291563 VRXCBIGFTALWJV-YBEGLDIGSA-N 399.453 3.959 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)c3ccc(O)c(Cl)c3)cc2F)C[C@@H](C)O1 57372505 QKGPGZONIWNWKU-BETUJISGSA-N 392.858 3.728 10 40 GHCB CSc1nccn1-c1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 58770263 LEFKANZFDWAEMT-UHFFFAOYSA-N 392.528 3.907 10 40 GHCB CCOC(=O)CN1C(=O)S/C(=C\c2cc(C)n(-c3ccccc3)c2C)C1=O 106742154 GBKFCZJLFUCXAX-BOPFTXTBSA-N 384.457 3.694 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C\C=C\c1ccco1 12363095 XPWBUEHPRHCINX-PZXDNKHOSA-N 393.251 3.974 10 40 GHCB O=C(NCc1ccccc1O)c1csc(-c2cnn(-c3ccccc3)c2)n1 89857595 KHWSWRDHZZTZPT-UHFFFAOYSA-N 376.441 3.631 10 40 GHCB O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C\c1cccc(Br)c1 5649288 LBNFBZKJINTBOD-ZSOIEALJSA-N 377.625 3.564 10 40 GHCB CNc1c(Cl)c(Cl)c(N(C)C(C)=O)c2c1C(=O)c1ccccc1C2=O 4832113 ZSKYXNGALCHSNQ-UHFFFAOYSA-N 377.227 3.793 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)c2C)cc1 15009103 OSPPUGAZAZROEF-CXUHLZMHSA-N 386.498 3.688 10 40 GHCB CN(C)c1ccc(/C=C2/NC(=O)N(c3ccccc3)C2=O)cc1Br 409012290 QCIRAPHTJVFWCG-RVDMUPIBSA-N 386.249 3.612 10 40 GHCB CN1CCN(c2ccc(CNC(=O)CCc3ccc(C(C)(C)C)cc3)cc2)CC1 216943221 IZBPXBSEGZCXQV-UHFFFAOYSA-N 393.575 3.985 10 40 GHCB Cc1cc(/C=C2\C(=O)N(C)C(=O)N=C2O)c(C)n1-c1ccc(F)c(Cl)c1 33423847 VJWYIRZKDHTUGF-QPEQYQDCSA-N 375.787 3.819 10 40 GHCB CCC1=NN2C(=N)/C(=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C(=O)N=C2S1 18118711 FCVVSMJWVGDSJW-ULKQKBTCSA-N 395.400 3.884 10 40 GHCB CN(C)c1ccc([C@@H](CNC(=O)c2ccco2)N2CCc3ccccc3C2)cc1 5098791 SDIOKOJNPJJPAF-JOCHJYFZSA-N 389.499 3.875 10 40 GHCB COC(=O)c1ccccc1N/C(C)=C1\C(=O)N(c2ccc(OC)cc2)N=C1C 100423113 SYCCLQDFQXHPLK-UYRXBGFRSA-N 379.416 3.590 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 967109 DHUZZZSRYGMFNN-MHWRWJLKSA-N 385.466 3.551 10 40 GHCB CCN1CCC[C@@H]1CNC(=S)N(Cc1ccccc1O)c1ccc(F)cc1 32909056 UCIDFUFQHOMRNC-LJQANCHMSA-N 387.524 3.897 10 40 GHCB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/c1cccc(Cl)c1Cl 408994334 YNNUBSPJCLJEMM-FMIVXFBMSA-N 377.252 3.825 10 40 GHCB CCN(CC)c1ccc(/C=C2/N=C(c3ccc(OC)c(OC)c3)OC2=O)cc1 729878 ADQRILNTCRFRLJ-QGOAFFKASA-N 380.444 3.895 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 408892156 GRAQVVDPAIWIOC-PTNGSMBKSA-N 382.347 3.611 10 40 GHCB Cc1c(-c2c3oc4c(O)c(O)ccc4c3nc3c2c(O)nn3C(C)C)cnn1C 95480897 NXDBVGRQMDOYTB-UHFFFAOYSA-N 393.403 3.737 10 40 GHCB Oc1ccccc1CN(Cc1noc(Cc2ccccc2)n1)C[C@H]1CCCO1 95957568 UTVXQZCUSOPLKM-LJQANCHMSA-N 379.460 3.547 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C\Nc2ccc(Cl)cc2Cl)C1=O 408534505 VUJFEXWKIFOODX-FMIVXFBMSA-N 390.226 3.881 10 40 GHCB CC(C)c1ccccc1O[C@@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217024248 XGXIRPGTNMESAA-IBGZPJMESA-N 395.547 3.646 10 40 GHCB COC(=O)c1cccc(NC(=S)NCCCN2CCCc3ccccc32)c1C 225745946 ARGWBNVMYMINMI-UHFFFAOYSA-N 397.544 3.911 10 40 GHCB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(Sc2ccccc2)o1 2211533 XZWGZXRTYIBFOH-LFIBNONCSA-N 394.408 3.686 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C\c1ccc(F)cc1 5372979 IZXBZCHHLBCYMW-AQTBWJFISA-N 385.439 3.757 10 40 GHCB COc1ccc(/C=C2\SC(=S)NC2=O)cc1OC(=O)c1ccc(C)cc1 2792923 SIZQKGNPASUHPG-YBEGLDIGSA-N 385.466 3.712 10 40 GHCB Cc1nnc(NC(=O)CSc2ncc(-c3ccc(Cl)cc3)n2C)s1 7423382 RQQPMSBBCZCYBY-UHFFFAOYSA-N 379.898 3.631 10 40 GHCB CN(Cc1ccccc1O)C(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1 53916314 WDPJGDQSFGUPJL-INIZCTEOSA-N 381.501 3.877 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(O)c(Cl)c1 226086944 LJWZNGNRASYYGV-KPKJPENVSA-N 393.251 3.530 10 40 GHCB O=C(c1ccc([N+](=O)[O-])o1)N1N=C(c2ccsc2)C[C@@H]1c1ccccc1O 58268758 CQZTVEVDEDDHIS-CQSZACIVSA-N 383.385 3.946 10 40 GHCB COC(=O)C1=CN(c2ccc(F)c(Cl)c2)c2cc(F)ccc2S1(=O)=O 64979207 GTMRXXYOTBSWAZ-UHFFFAOYSA-N 385.775 3.558 10 40 GHCB CCOc1ccc(-n2c(C)cc(C(=O)COc3ccccc3C(N)=O)c2C)cc1 6510769 KIDDMQPCENHGKD-UHFFFAOYSA-N 392.455 3.853 10 40 GHCB Cc1cc(C(=O)Oc2ccc(N3CCOC3=O)cc2)c(C)n1-c1ccccn1 95356821 ANMHRDMTTKRIRE-UHFFFAOYSA-N 377.400 3.665 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1O 35648709 PMNDYASYYXMQDV-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB CCOc1ccc(-n2cccc2/C=C2/C(=N)N3N=C(C)SC3=NC2=O)cc1 41108070 GTHZWZOBWIBUTM-VXBULBDJSA-N 379.445 3.515 10 40 GHCB CC(=O)c1ccc(N2C(=O)/C(=C3/C(=O)Nc4ccc(F)cc43)SC2=S)cc1 4291586 VBXCXCUSYYVXGP-NXVVXOECSA-N 398.440 3.756 10 40 GHCB COc1cccc(/C=C2\C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)c1O 409037560 CZNIZGUWDIMCDO-TWGQIWQCSA-N 398.287 3.902 10 40 GHCB COc1cccc(N2C(=O)N=C(O)/C(=C/c3cn(C)c4ccccc34)C2=O)c1 8994361 DFTBLBLATSUWBL-YVLHZVERSA-N 375.384 3.694 10 40 GHCB Cc1ccc(NC(=O)CN2CCN(Cc3c(O)ccc4ccccc34)CC2)cc1 22794425 QHVNNUPDMRXZBI-UHFFFAOYSA-N 389.499 3.610 10 40 GHCB O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)c1ccc(O)c(O)c1 23561887 XDJJPWGARUDHJD-UHFFFAOYSA-N 393.424 3.914 10 40 GHCB COc1ccc2c3c(n(Cc4cccnc4)c(=O)c2c1OC)-c1ccccc1C3=O 604404980 NCJYDJSJWQVJQR-UHFFFAOYSA-N 398.418 3.673 10 40 GHCB biogenic Cc1nn(-c2ccccc2)c(O)c1/C=C1\SC(=S)N(Cc2ccco2)C1=O 12372225 MDLWEPPMJSVEEY-YBEGLDIGSA-N 397.481 3.881 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C1\C(=O)Nc2ccc(Br)cc21 100164569 OANRGMPHFRLJNE-NXVVXOECSA-N 382.217 3.578 10 40 GHCB CCc1cc(=O)oc2c(C)c3c(cc12)CN(c1ccc2c(c1)OCCO2)CO3 2122724 RZTJUAVZCJRRER-UHFFFAOYSA-N 379.412 3.792 10 40 GHCB biogenic CCN1C(=O)C(=CNc2ccccc2-c2ccccc2)C(=O)N(CC)C1=S 5557298 XVBYJEPSFZMOSK-UHFFFAOYSA-N 379.485 3.645 10 40 GHCB Cc1cc(NC(=S)NCCN(C)c2ccccc2)ccc1N1CCCC1=O 225572189 QYISMFCXAVTLRE-UHFFFAOYSA-N 382.533 3.545 10 40 GHCB O=C(Nc1ccc(Cl)cc1)c1cnn2c(O)cc(COc3ccccc3)nc12 19373564 RLSFZNZSOWEIQG-UHFFFAOYSA-N 394.818 3.920 10 40 GHCB CCOc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCC2)cc1 5098030 DBOIRFOIHXNNHH-QFIPXVFZSA-N 381.520 3.718 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)c3cccc(F)c3)N3CCCC3)ccc21 13008228 FNNXILWAPXLIEC-JOCHJYFZSA-N 381.495 3.775 10 40 GHCB CCN1CCC2(CC1)Oc1c(OC)cccc1[C@H]1CC(c3ccccc3O)=NN12 10214466 CYNQPDVNUARUOJ-LJQANCHMSA-N 393.487 3.756 10 40 GHCB CC(C)(C)C(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 6460382 MLLBTKGYBSNEII-UHFFFAOYSA-N 384.815 3.887 10 40 GHCB COc1ccc(N2N=C(C)/C(=C(\C)Nc3cccc(OC)c3OC)C2=O)cc1 100423141 IOAKHOOONZSUSQ-UYRXBGFRSA-N 381.432 3.821 10 40 GHCB Cc1ccc2nc(COC(=O)c3ccc(-n4c(C)ccc4C)cc3)cc(=O)n2c1 5198911 QTNDGNUYSSMZMS-UHFFFAOYSA-N 387.439 3.767 10 40 GHCB Cc1ccc(N/C=C2\C(=O)NC(=S)N(C3CCCCC3)C2=O)cc1Cl 5561096 GQJJCERUKNHBJL-GXDHUFHOSA-N 377.897 3.520 10 40 GHCB CCCCOc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3OC)C2=O)cc1 408899349 OPOIKSVKNVOYHY-JXAWBTAJSA-N 394.427 3.541 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 408891650 AODVODAVWWWNGD-ATVHPVEESA-N 378.384 3.780 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccc(OC)cc1 660194 HRKRCZNQAKDYJT-UYRXBGFRSA-N 379.412 3.581 10 40 GHCB Nc1nc(N)c(/N=N\c2ccc(S(N)(=O)=O)cc2)cc1/N=N\c1ccccc1 104090850 BBTGLPAPGOMLPD-HKOLQMFGSA-N 396.436 3.724 10 40 GHCB COc1ccc(C2=C/C(=C\c3cc([N+](=O)[O-])c(OC)cc3OC)C(=O)O2)cc1 408742089 MXSLLPVXULUZHT-RIYZIHGNSA-N 383.356 3.602 10 40 GHCB O=C(O)C[C@H](c1ccccc1)N1C(=O)/C(=C/c2cccc(O)c2)SC1=S 31776153 ZBJMXVOFRVUGRG-CCAPLTMGSA-N 385.466 3.809 10 40 GHCB COc1cc(/C=C2/C(=N)N3C(=NC2=O)Sc2cc(C)c(C)cc23)ccc1O 9111193 HPPYEKOQILCSGZ-PQJMHHKISA-N 379.441 3.887 10 40 GHCB COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1ccc(OC)cc1OC 408974852 HMIVGAWMFKNOIS-PDGQHHTCSA-N 385.460 3.709 10 40 GHCB CCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(C(C)C)cc3)C2=O)c1O 5654409 BVPMQFWPCPFYBE-ATVHPVEESA-N 394.427 3.581 10 40 GHCB Nc1ccc(Cn2cnc(-c3nc(-c4ccc(Br)cc4)no3)c2)cc1 67341782 VFSLZASLNZXIGH-UHFFFAOYSA-N 396.248 3.993 10 40 GHCB Cc1oc2c(CN[C@@H](C(=O)O)C(C)C)c(O)ccc2c(=O)c1Oc1ccccc1 19702921 XIOZQUAUBCZYNY-GOSISDBHSA-N 397.427 3.798 10 40 GHCB biogenic CCCCCN1C/C(=C2\SC(=S)N(CCC(=O)O)C2=O)c2ccccc21 2310431 XXOIWLNDGPTEPO-SAPNQHFASA-N 390.530 3.743 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2ccc(O)c(Cl)c2)C1=O 408897077 VFKWOCNEFYBVTR-YRNVUSSQSA-N 391.210 3.674 10 40 GHCB Cc1cccc(C(=O)N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)c1 6998703 GCVHXKQAMPPNAJ-XNTDXEJSSA-N 384.438 3.945 10 40 GHCB CN1C(=O)/C(=C\c2nc3ccccc3c(=O)n2Cc2ccccc2)c2ccccc21 13774863 UQGUQKOSFGDIDT-HKWRFOASSA-N 393.446 3.962 10 40 GHCB Cc1cc(N2CCCC2)c(F)cc1/C=C1\NC(=O)N(Cc2ccccc2F)C1=O 107900938 IHMPOIKGAFCYPL-UNOMPAQXSA-N 397.425 3.966 10 40 GHCB CCn1c(-c2ccccc2)cnc1SCC(=O)NCc1cccc(OC)c1 12506728 DKGXPBDZAZEYCJ-UHFFFAOYSA-N 381.501 3.987 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C3\C(=O)Nc4ccccc43)SC2=S)cc1 1782498 HHVFYPORFJLLDS-FOCLMDBBSA-N 382.466 3.813 10 40 GHCB CC(=O)NCCC(=O)Nc1nc(-c2cc(C)n(-c3ccccc3)c2C)cs1 6651914 OEHSEISVKTYEGN-UHFFFAOYSA-N 382.489 3.682 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)c(OCC)c1 409076748 CCPFBWHUAKNPLO-HAKPAVFJSA-N 393.530 3.864 10 40 GHCB CC[C@H]1CCc2c(sc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)O)c2C(=O)OC)C1 5476954 RSSRWUKYZJVTQJ-AVGNSLFASA-N 393.505 3.879 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)Cc3ccc(Cl)cc3)N3CCCC3)ccc21 8963240 DLNDXDXHJQQDBD-QFIPXVFZSA-N 397.950 3.828 10 40 GHCB COc1ccc(N2CCN(c3nnc(SCc4cccnc4)s3)CC2)cc1 23140011 HNOSIAZKOLWNNL-UHFFFAOYSA-N 399.545 3.561 10 40 GHCB CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(N(C)C)cc2)n2ncnc2N1 5377896 VYRPHBCGFZLEBY-HXUWFJFHSA-N 388.475 3.580 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\Nc3ccc(F)c(Cl)c3)C2=O)cc1C 408534250 PYJQNHWALQVNGJ-NTEUORMPSA-N 387.798 3.675 10 40 GHCB Cc1ccc(C)c(N2C(=O)NC(=O)/C(=C\c3ccc(OC(C)C)cc3)C2=O)c1 408819172 YJZFCKHVQLKJQG-LDADJPATSA-N 378.428 3.757 10 40 GHCB Cc1cc(C=C2C(=O)OC3(CCCC3)OC2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 857537 YAXYTCYVYGVEQY-UHFFFAOYSA-N 396.399 3.756 10 40 GHCB CCOc1ccccc1CNC(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O 12412476 MDHZIHMDDPSOAY-UHFFFAOYSA-N 385.419 3.791 10 40 GHCB COc1cc(OC)c(OC)cc1/C=C1/C(=O)N(c2ccc(C)cc2)C(=O)N=C1O 1192750 LLHHPEPZXVMQSR-OQLLNIDSSA-N 396.399 3.528 10 40 GHCB O=C1c2ccccc2N[C@H](c2ccc(O)c(O)c2)N1c1ccc2c(c1)OCCO2 8745812 VIBWJIAJJNPCLT-NRFANRHFSA-N 390.395 3.640 10 40 GHCB COc1ccc(N2CCN(C(=O)CSCc3cccc(Cl)c3)CC2)cc1 70718987 LWYRYBPPDXRBGM-UHFFFAOYSA-N 390.936 3.931 10 40 GHCB CC(=O)c1cccc(NC2=NC(=O)/C(=C\c3nc4ccccc4n3C)S2)c1 5236027 GYLFXHCFJNBIRP-GZTJUZNOSA-N 376.441 3.858 10 40 GHCB CCOc1ccc2ccccc2c1C[C@@H]1SC(=S)N(CCOC)C1=O 6964730 RGAWQICGPMYOLY-KRWDZBQOSA-N 375.515 3.656 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1-c1ccc(C(C)C)cc1 408996237 LSLXNWJQWIRIOQ-UHFFFAOYSA-N 379.460 3.651 10 40 GHCB CCc1nc(C(=O)NCc2ccccc2O)nn1-c1c(Cl)cccc1Cl 83830383 CDZBRGHNRIFAEZ-UHFFFAOYSA-N 391.258 3.772 10 40 GHCB CC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1 35040242 CIKLHMIZOIIGKK-MHWRWJLKSA-N 383.450 3.993 10 40 GHCB COc1ccc(N2CCN(C(=O)c3nc(Cl)sc3CC(C)C)CC2)cc1 96231594 MTNQXWSTPQHYIS-UHFFFAOYSA-N 393.940 3.966 10 40 GHCB CC[C@H](C)c1ccccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 20807203 DRMNDTDVQFZCHW-FPOVZHCZSA-N 398.547 3.771 10 40 GHCB COc1ccc(N2CCN(C(=O)CSCc3cc(C)cc(C)c3)CC2)cc1 7058702 QFJDGJCORRMSLX-UHFFFAOYSA-N 384.545 3.894 10 40 GHCB CC(C)(C)N1C(=O)NC(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)C1=O 17028290 VSORXOGOTUTJNW-QGOAFFKASA-N 378.428 3.526 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1ccc(OC)cc1OC 58883839 PCGHWJWKVKJPGG-UNOMPAQXSA-N 393.439 3.577 10 40 GHCB COc1ccc(NCN2C(=O)S/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 3211921 IAAVVWLNSIHMIH-PDGQHHTCSA-N 383.473 3.867 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(CCCN2CCOCC2)C1=O 27229685 ZGJZHZGPPWESHV-FLNGBNSUSA-N 388.558 3.556 10 40 GHCB Cc1cccc(-n2cccc2/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)c1 4747740 BUDXHUZGHISUJY-XMHGGMMESA-N 377.444 3.580 10 40 GHCB CC1=C(C(=O)O[C@@H]2CCC[C@@H](C)C2)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1 245333760 AMOMSDKTONIICD-XVSDVWIESA-N 387.549 3.667 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCC3)ccc21 8963351 BGECZPXOTFDARA-OAQYLSRUSA-N 385.458 3.524 10 40 GHCB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c(C)c1 4062681 YKKZJHWXDWCMIW-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)Cc3cccs3)N3CCCC3)ccc21 13008218 UBSHGFSCJFMFEK-NRFANRHFSA-N 383.561 3.626 10 40 GHCB CCOC(=O)[C@@H]1CCCN(C2=NC(=O)/C(=C/c3ccc(Cl)cc3)S2)C1 1068620 LLFQUIJEQNOOTM-NWFCWYBLSA-N 378.881 3.585 10 40 GHCB CC(C)C[C@@H](NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12)C(=O)O 4026331 KKAMOXGUTPOGNY-GOSISDBHSA-N 381.428 3.755 10 40 GHCB biogenic COc1ccc(N2N=C(C)/C(=C(\C)Nc3ccc(OC)cc3OC)C2=O)cc1 112121234 FGSKHXVVCJJVQG-MOSHPQCFSA-N 381.432 3.821 10 40 GHCB O=c1c2cc(Cl)ccc2nc2n1CC/C2=C\c1ccc(N2CCOCC2)cc1 96759129 GFVHUNIHUVIDMR-DTQAZKPQSA-N 393.874 3.831 10 40 GHCB Cc1ccc(C2=NN[C@H](c3cc(Br)cc4c3OCOC4)C2)c(O)c1 26534205 JOAJTMIMLQOPTE-INIZCTEOSA-N 389.249 3.768 10 40 GHCB biogenic CN1CCCc2cc([C@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCC3)ccc21 13008251 HCEFOGUTZVATCD-QFIPXVFZSA-N 399.485 3.914 10 40 GHCB CCOC(=O)c1ccc(Oc2coc3c(CN(C)C)c(O)ccc3c2=O)cc1 20358308 XYJKGZIJDWLKDE-UHFFFAOYSA-N 383.400 3.529 10 40 GHCB biogenic COc1ccc(C[C@@H]2SC(=S)N(CCc3ccccc3)C2=O)c(OC)c1 8115221 RMVKRHSNETUMIY-SFHVURJKSA-N 387.526 3.718 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2c(C)n(C)c3ccccc23)C1=O 59679079 DXZPGNIVALOPSG-AQTBWJFISA-N 387.439 3.716 10 40 GHCB C[C@@H]1CN(c2ccc(CNC(=O)CCC(=O)c3ccccc3)cc2F)C[C@@H](C)O1 48365414 SKLPOZAARUQOMB-IAGOWNOFSA-N 398.478 3.719 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)cc1Cl 4682275 ATNCNVASFPJZIE-KMHUVPDISA-N 399.834 3.579 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(C)=C2C(=O)OC)ccc1O 408798087 UGDPZNPFERVMQB-BOPFTXTBSA-N 397.402 3.807 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 408903047 OJZATTZFXAGKTI-HTMJNSLASA-N 382.391 3.669 10 40 GHCB C[C@@H](NC(=S)Nc1c(F)cccc1F)c1ccc(N2CCOCC2)cc1 225838710 LWOCQOFFDRCMFZ-CYBMUJFWSA-N 377.460 3.849 10 40 GHCB COc1ccc(-n2c(C)ccc2[C@H]2[C@@H](c3ccccn3)NC(=S)N2C)cc1 222764337 POOOHSAKXBDATK-UXHICEINSA-N 378.501 3.792 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(c3ccc(C(=O)O)c(O)c3)C2=O)cc1 4356733 UTODQUACKLHOJH-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB O=C1S/C(=C/c2ccc(N3CCOCC3)cc2)C(=O)N1CCc1ccccc1 4739747 LOZTYHNTMYDODT-CAPFRKAQSA-N 394.496 3.802 10 40 GHCB COc1cc(/C=C2/SC(NC3CCCCC3)=NC2=O)cc(OC)c1OC 96669681 BNZGNEPIVKZEGF-LFIBNONCSA-N 376.478 3.605 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C\c2nc3ccccc3n2C)S1 20227150 JLBKVRNOYDROQC-MHWRWJLKSA-N 392.440 3.662 10 40 GHCB COc1cc2ccccc2cc1C(=O)NCc1ccc(N2CCOCC2)cc1 44883969 FOLGKAURCGYZNI-UHFFFAOYSA-N 376.456 3.615 10 40 GHCB O=C1/C(=C\c2cccc(Br)c2)SC(=S)N1C[C@@H]1CCCO1 1288061 HIROVLNEBLWMHZ-OXBCTQFSSA-N 384.320 3.829 10 40 GHCB CCN(CC)CCC[C@H](C)Nc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O 5839644 KAFNBNCBBLYFOI-AWEZNQCLSA-N 396.487 3.796 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)c3cccc(F)c3)N3CCCC3)ccc21 13008230 FNNXILWAPXLIEC-QFIPXVFZSA-N 381.495 3.775 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(OCC(C)C)cc2)c1 7496947 ODTNNTSMJCGOBN-UHFFFAOYSA-N 384.476 3.819 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(OC)cc1OC 408894371 QEKNKMFHBVEPKP-UNOMPAQXSA-N 393.439 3.889 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccc(F)cc3)o2)SC1=S 5032416 VFWZCEBSMLJBQZ-JNNKLVPLSA-N 377.418 3.760 10 40 GHCB CCOc1cc(/C=C2\SC(NC(=O)c3ccccc3)=NC2=O)c(C)cc1OC 409144374 FNPUFHIOBYFMLH-PDGQHHTCSA-N 396.468 3.803 10 40 GHCB Cc1ccc(C2=NN[C@@H](c3cc(Br)cc4c3OCOC4)C2)c(O)c1 26534201 JOAJTMIMLQOPTE-MRXNPFEDSA-N 389.249 3.768 10 40 GHCB biogenic COc1ccccc1-c1n[nH]c(=S)n1NCc1ccc(N2CCCC2)cc1 7365420 VIUCGCSHGXVSER-UHFFFAOYSA-N 381.505 3.960 10 40 GHCB Cc1cc(C(=O)CN2C(=O)NC3(CCCCCC3)C2=O)c(C)n1-c1ccccc1 4287888 AXPXXINPMGDQOK-UHFFFAOYSA-N 393.487 3.922 10 40 GHCB CC[C@@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(N2CCOCC2)cc1 113971356 ILTGZTITXWTRDC-OAQYLSRUSA-N 382.504 3.614 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C/c2nc3ccccc3[nH]2)SC1=S 5235968 FICGVQVINDYENS-DHDCSXOGSA-N 395.465 3.975 10 40 GHCB COc1ccc(CN2CCC[C@@H](c3cc(=O)[nH]c(-c4cccs4)n3)C2)c(O)c1 19551828 QVLFRRSQGWWRLB-CQSZACIVSA-N 397.500 3.592 10 40 GHCB CCCCCCN/C=C1\C(=O)NC(=S)N(c2cccc3ccccc23)C1=O 1758529 FKOKVOSXLMGERG-SAPNQHFASA-N 381.501 3.641 10 40 GHCB Cc1n(Cc2ccccc2)c2c([n+]1Cc1ccccc1)C(=O)c1ccccc1C2=O 1772768829 LRDBHKVNDVBLKB-UHFFFAOYSA-N 393.466 3.956 10 40 GHCB Cc1cccc(/C=C2\SC(N3CCN(c4ccc(F)cc4)CC3)=NC2=O)c1 9187974 LPXPGGPOFFFBOU-RGEXLXHISA-N 381.476 3.927 10 40 GHCB CN(C)c1ccc(/C=C2/C(=N)N3N=C(C4CCCCC4)SC3=NC2=O)cc1 4608176 BGWBJAAVLBMVJC-PSPCYXPKSA-N 381.505 3.952 10 40 GHCB COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 408795312 LZLNCTXPUKCRAJ-QIQQCEGHSA-N 391.423 3.819 10 40 GHCB COC(=O)[C@H](C)N1C(=O)S/C(=C\c2cc(C)n(-c3ccccc3)c2C)C1=O 409104014 YDADNHURTNITAF-FMNVXAMXSA-N 384.457 3.692 10 40 GHCB O=C(O)c1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 409335017 XHDJQHDPKLYAOM-RIYZIHGNSA-N 386.410 3.699 10 40 GHCB CC1=NN(c2cccc(C)c2)C(=O)/C1=C\N=c1[nH]nc(-c2ccccc2)s1 408531413 NXSXVHANZIHHHS-ATVHPVEESA-N 375.457 3.654 10 40 GHCB Cc1ccc(C(C)C)c(OCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 225394755 RTHBUSNMBVMCAV-UHFFFAOYSA-N 395.547 3.565 10 40 GHCB CC[C@H](C)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 2236582 RVSGHJRMKCMCIP-AUQXIXNCSA-N 391.471 3.933 10 40 GHCB COc1cccc(CNC(=O)COC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 4541430 DPGBGEIWFQDDRE-UHFFFAOYSA-N 392.455 3.576 10 40 GHCB Cc1cc(C(=O)NCCNc2ccccc2[N+](=O)[O-])c(C)n1-c1ccccc1 24320263 QQMRPDILDUJTQT-UHFFFAOYSA-N 378.432 3.844 10 40 GHCB CC1=C(C(=O)O[C@@H]2CCC[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 5002899 AMOMSDKTONIICD-OMWUSAIZSA-N 387.549 3.667 10 40 GHCB CC1=NN(c2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)CC1 54037677 WVSMWIJORWNWCZ-UHFFFAOYSA-N 394.544 3.756 10 40 GHCB Cc1c(/C=C2\SC(c3ccccc3)=NC2=O)c(=O)n(-c2ccccc2)n1C 15016666 GSBAVEMGZLBFJZ-AQTBWJFISA-N 375.453 3.546 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 15188530 SJHGOZOUDCCWAQ-UYRXBGFRSA-N 391.423 3.961 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc(Cl)c1O 409080748 MOFHPRAMSDRERU-ZEVOCZHWSA-N 399.921 3.825 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 408896235 WVZUDWCAJYESBE-PTNGSMBKSA-N 382.347 3.611 10 40 GHCB COC(=O)C1=C(C)N(C(C)C)C(=O)/C1=C\c1cc(Br)ccc1OC 59959480 MHFXCDDXZNWUDT-ZROIWOOFSA-N 394.265 3.539 10 40 GHCB O=C1/C(=C/c2cccc(Br)c2)SC(=S)N1C[C@H]1CCCO1 13712793 HIROVLNEBLWMHZ-YFBAIUBQSA-N 384.320 3.829 10 40 GHCB CN(C)c1ccc(/C=C/C(O)=C2/C(=O)N[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 101321398 LWIRVQAYQOXBEA-LLIPNOFHSA-N 376.456 3.990 10 40 GHCB CC[C@@H](C)c1ccccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 20807206 DRMNDTDVQFZCHW-TZIWHRDSSA-N 398.547 3.771 10 40 GHCB Cc1cc(/C=C/C(=O)Nc2ccc(S(C)(=O)=O)nc2)c(C)n1-c1ccccc1 60740019 DXEVOARTFTWMOE-PKNBQFBNSA-N 395.484 3.545 10 40 GHCB CCN(CC)CCOC(=O)c1c(C)oc2cc(CN(C)C)c(O)c(Cl)c12 1740561 MILGJKHRSPOMNP-UHFFFAOYSA-N 382.888 3.660 10 40 GHCB O=C(C1=CN(c2ccccc2)c2cc(F)ccc2S1(=O)=O)N1CCCCC1 49003892 DDCYHTXCORWUNJ-UHFFFAOYSA-N 386.448 3.605 10 40 GHCB Cc1cc(/C=C2/NC(=O)NC2=O)c(C)n1-c1ccc(OCc2ccccc2)cc1 409053422 CLVCPIWIEXSCDL-FYJGNVAPSA-N 387.439 3.853 10 40 GHCB COc1ccc2ccccc2c1/C=C1\C(=O)NC(=S)N(c2ccccc2)C1=O 1197459 OHSGJXJUWYJXHH-QGOAFFKASA-N 388.448 3.680 10 40 GHCB COc1cccc(Cc2cc(O)n3ncc(C(=O)Nc4ccc(C)cc4)c3n2)c1 19210716 TXVALGHIKLQPRU-UHFFFAOYSA-N 388.427 3.595 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(O)c(OCC)c2)SC1=S 5372105 UHXLRUIWMIQOJE-DYTQJMLRSA-N 395.502 3.636 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\Nc1cccc(Cl)c1Cl 2742175 MAFBSGMBYQRGMG-LUAWRHEFSA-N 376.199 3.572 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccc(F)cc3)o2)SC1=S 5032421 VFWZCEBSMLJBQZ-ZJTXEKFPSA-N 377.418 3.760 10 40 GHCB CCOc1ccccc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 6747964 SKURDGRHALRMIB-FQEVSTJZSA-N 382.504 3.973 10 40 GHCB CN(C)CCCN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 96019450 MJGDMDMSUIVXDX-RAXLEYEMSA-N 385.352 3.602 10 40 GHCB Cc1c(C)c2ccc(O)c(CN(C)C[C@H]3CCCN4CCCC[C@@H]34)c2oc1=O 1565519803 HRDURUSTQFCTOI-XLIONFOSSA-N 384.520 3.812 10 40 GHCB biogenic COc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N2CCCC2)cc1 16838187 DIVSZZDKIVGKHV-QHCPKHFHSA-N 393.531 3.645 10 40 GHCB COc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccco3)SC2=S)c1 4745457 JVRGSSGZAARZFO-RVDMUPIBSA-N 388.470 3.518 10 40 GHCB O=C(O)COc1ccccc1/C=C1\SC(=S)N(c2ccccc2F)C1=O 210432337 OYVNLVJIVZOFMD-DHDCSXOGSA-N 389.429 3.695 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)cc3Cl)C2=O)c1 408739559 CQVBITNCTLYZNP-RIYZIHGNSA-N 375.211 3.968 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccc(Cl)c2)SC1=S)c1cccs1 409329406 FKDGGOXCWQJFQC-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB N=C1/C(=C/c2ccc(OCc3ccc(F)cc3)cc2)C(=O)N=C2SC=NN12 33458120 GEGGLLPPGCAVMA-CSCXBHOMSA-N 380.404 3.654 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)N1CCCCC1 39704718 NMIGTDJTVRXJFZ-SFHVURJKSA-N 385.533 3.834 10 40 GHCB COc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)o1 858906 CVNOAUGSNWTLCE-UHFFFAOYSA-N 399.355 3.617 10 40 GHCB COc1ccc(OC)c(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)c1 7052467 WNNUSONCQAPIPR-UHFFFAOYSA-N 376.459 3.628 10 40 GHCB CCOc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 8613799 LRMHHAUCHYBTSK-JOCHJYFZSA-N 382.504 3.973 10 40 GHCB COC(=O)c1cc(N/C=C2\C(=O)N(c3ccc(F)cc3)N=C2C)ccc1Cl 5575901 FJPJPZFVAFGLAS-YBEGLDIGSA-N 387.798 3.984 10 40 GHCB COc1ccc(N(C)CCNC(=S)Nc2ccc(Br)cc2)cc1 225797543 MTKIIBGEBRNEOO-UHFFFAOYSA-N 394.338 3.881 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1 5372292 WOTCSRUVFZOVMP-WQRHYEAKSA-N 399.493 3.868 10 40 GHCB O=S(=O)(c1ccccc1)N1N=C(c2ccccc2)C[C@H]1c1ccccc1O 4248182 FVFWVAXNHNTNGO-FQEVSTJZSA-N 378.453 3.932 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 27530350 ZAWFGMLFIUCERG-MHWRWJLKSA-N 399.453 3.959 10 40 GHCB COc1cc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1C 409178112 IQKPGYCVVVKRKG-LFIBNONCSA-N 384.482 3.550 10 40 GHCB COc1cccc(CNc2ncc(Br)cc2Br)c1O 18136781 KECAOEBSADERDC-UHFFFAOYSA-N 388.059 3.933 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)Nc1ccc(Cl)cc1 112121486 LRTRVRJQZRUCTK-UYRXBGFRSA-N 383.835 3.992 10 40 GHCB CN1C(=O)/C(=C/c2cccn2-c2nnc(-c3ccccc3)s2)SC1=S 4971205 BBEASTGQEAODTC-RAXLEYEMSA-N 384.511 3.827 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3c(C)n(C)c4ccccc34)C2=O)cc1C 408828101 VSBGYDPQAIRDGX-XDHOZWIPSA-N 387.439 3.770 10 40 GHCB CCCNc1nc(-c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cs1 13069621 PXGREMFAOAFZQT-UHFFFAOYSA-N 390.534 3.687 10 40 GHCB CC(/C=C1\SC(=S)N(CC(=O)N2CCCCC2)C1=O)=C\c1ccccc1 4745627 QIQBVZHADIMXBB-GXDIDPINSA-N 386.542 3.847 10 40 GHCB Cc1ccc(N2CCN(CN3C(=O)/C(=C\c4ccco4)SC3=S)CC2)cc1 19905183 OBLCNVWLSYMORZ-QGOAFFKASA-N 399.541 3.569 10 40 GHCB CC(C)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 408849970 BXKKXKNVCYYXRO-WOJGMQOQSA-N 382.391 3.527 10 40 GHCB COC(=O)c1c(N/C=C2\C(=O)N(c3ccccc3)N=C2C)sc(C(C)=O)c1C 44827028 DAYOUXPDQGCUMS-GDNBJRDFSA-N 397.456 3.764 10 40 GHCB CC(C)[C@H]1CC(=O)Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c21 96115762 BTPCABAYRDUCFJ-LLVKDONJSA-N 382.368 3.626 10 40 GHCB biogenic O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCc2cccc(F)c2)cc1 107823992 DQDBRJPIXLOYCF-STZFKDTASA-N 388.398 3.866 10 40 GHCB CCOc1ccc(/C=C2\SC(NC(=O)c3ccccc3)=NC2=O)cc1OCC 409146090 JEDIGGVHRKJIKI-AQTBWJFISA-N 396.468 3.884 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C\c3ccccc3C)SC2=S)cc1 6925026 GHLISXPGCCJUAR-LFIBNONCSA-N 384.482 3.550 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)NCc1ccco1 924821 XKLMZZVDIGSWTM-SFHVURJKSA-N 397.500 3.731 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccc(C)cc2)C1=O 1305949 DDEYJMLUMXLRHK-WJDWOHSUSA-N 384.482 3.550 10 40 GHCB CCc1ccccc1-n1c(C)cc(/C=C2\SC(=O)N(CC(=O)O)C2=O)c1C 408966403 LKPCRJFZJFBNJV-YVLHZVERSA-N 384.457 3.777 10 40 GHCB CC(C)(C)c1cc(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)on1 65597216 MAFHFHKTAYOOEK-UHFFFAOYSA-N 379.407 3.965 10 40 GHCB COc1ccc2ccc(O)c(CN3CCC(c4nnc5ccccn45)CC3)c2c1 14184717 QELYRDGAYZDRPM-UHFFFAOYSA-N 388.471 3.976 10 40 GHCB CCOC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1ccc(C(=O)OC)cc1 8872617 BMQXEYIKMVUDEJ-RGEXLXHISA-N 397.471 3.869 10 40 GHCB CCOc1ccc(/C=C2\SC(N3CCN(c4ccccc4)CC3)=NC2=O)cc1 16684081 VUVKXXMLSTZXGD-SILNSSARSA-N 393.512 3.878 10 40 GHCB Cc1cc(C(=O)COC(=O)c2ccc3c(c2)OCCO3)c(C)n1-c1ccccc1 2658636 HXMSRACFZNTINA-UHFFFAOYSA-N 391.423 3.905 10 40 GHCB COC(=O)c1ccc(CN2C(=O)S/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 101792706 AZPMIESRZCAZFG-LDADJPATSA-N 396.468 3.776 10 40 GHCB CC[C@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(N2CCOCC2)cc1 113971355 ILTGZTITXWTRDC-NRFANRHFSA-N 382.504 3.614 10 40 GHCB COC(=O)CCCCCN1C(=O)/C(=C\c2ccc(N(C)C)cc2)SC1=S 1768386 XDQGFMPNUJYNOR-DTQAZKPQSA-N 392.546 3.687 10 40 GHCB COCCN/C(C)=C1\C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 4999680 FSTOJJZNLMWBAK-JXAWBTAJSA-N 392.484 3.557 10 40 GHCB COc1cc(/C=C2/SC(=S)NC2=O)ccc1OC(=O)c1ccc(F)cc1 3034722 HLYYXTLBEKAVQI-OQLLNIDSSA-N 389.429 3.542 10 40 GHCB Cc1cccc(CC(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007775 BLXWIYCFXARJDP-XMMPIXPASA-N 391.559 3.873 10 40 GHCB Cc1ccc(/C=C2\SC(=S)N(CCC(=O)N3CCC(C)CC3)C2=O)cc1 1181302 BTFJGLBTJPNQBR-LGMDPLHJSA-N 388.558 3.845 10 40 GHCB O=C(COc1ccccc1F)Nc1cccc2c1C(=O)c1ccccc1C2=O 6476160 KNYLELRVKYPDJA-UHFFFAOYSA-N 375.355 3.619 10 40 GHCB COc1ccc(N2CCCN(C[C@H](O)COc3c(C)ccc(C)c3C)CC2)cc1 84147786 TVVMLLPSGZRSOX-QFIPXVFZSA-N 398.547 3.572 10 40 GHCB COC(=O)C[C@H](c1c(O)c(O)c(O)c2c(=O)cc(-c3ccccc3)oc12)C(C)C 96221824 FXNUPXSZXYWPKE-ZDUSSCGKSA-N 398.411 3.880 10 40 GHCB biogenic COC(=O)c1ccc(/C=C2\SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cc1 4342044 YYJPISKOPJUFCR-DHDCSXOGSA-N 399.449 3.577 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)Cc3ccc(F)cc3)N3CCCC3)ccc21 13008224 WLCTYGFQWRLCEP-HSZRJFAPSA-N 395.522 3.704 10 40 GHCB CCN1/C(=C/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)Sc2ccccc21 100856086 OVVBVPYYWHASTA-MIXLFBTASA-N 391.452 3.669 10 40 GHCB O=C(OCc1cc(=O)oc2cc(O)c(O)cc12)c1ccc(Cl)c(Cl)c1 7981610 XIUVKKRYISVKNU-UHFFFAOYSA-N 381.167 3.868 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(c3ccc(C(=O)O)c(O)c3)C2=O)cc1 27530362 UTODQUACKLHOJH-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB CC(C)(C)NC(=O)CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S 2244371 KGCGOFMXJNGYPI-RAXLEYEMSA-N 382.938 3.846 10 40 GHCB Cc1ccc(-n2cccc2/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1 4703713 KQRZQHVRIZFGDL-RGEXLXHISA-N 385.423 3.761 10 40 GHCB Cc1cc(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c(C)n1-c1ccccc1 5894334 VOZRLRLIWGACDV-UHFFFAOYSA-N 397.500 3.597 10 40 GHCB CN1C(=O)C(=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)C(=O)N(C)C1=S 1063309 MEYZVVONWHLWQL-UHFFFAOYSA-N 394.374 3.564 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)c2nn(CC)c(=O)c3ccccc23)cc1 12536376 ORJGYAQGSBUUPK-UHFFFAOYSA-N 392.503 3.535 10 40 GHCB O=C1/C(=C/c2ccccc2Br)SC(=S)N1C[C@H]1CCCO1 9190102 SDBQLZVMIJAPLA-JYVXZMADSA-N 384.320 3.829 10 40 GHCB Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccccc1O 222741180 JKCUIGXEHSWDIR-PMACEKPBSA-N 378.501 3.797 10 40 GHCB CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(OC)c(Cl)c2)cc1 223132659 VKHOEFFXLMISKE-UHFFFAOYSA-N 382.913 3.673 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@H](C(=O)O)[C@@H](C)CC)C2=O)cc1 5373644 CHJJPBZLESNBNE-DEMBHLBLSA-N 379.503 3.786 10 40 GHCB O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCCCCC1 47065436 SCCHFSYKIACPHO-UHFFFAOYSA-N 385.430 3.628 10 40 GHCB CCc1cc(Br)ccc1NS(=O)(=O)c1cccc2nsnc12 13948559 HCVCVOLANRCQLJ-UHFFFAOYSA-N 398.307 3.817 10 40 GHCB CCOC(=O)CN1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2C)C1=O 409039321 CMRWJDSVHFIXFG-SFQUDFHCSA-N 388.489 3.585 10 40 GHCB CN(C)C(=O)c1ccc([C@@H]2CCCN(Cc3ccc4c(c3)CCCN4C)C2)nc1 19705603 CKOXZDJOAWORKK-OAQYLSRUSA-N 392.547 3.545 10 40 GHCB CN1C(=O)/C(=C\c2ccc(C(=O)Nc3ccncc3Cl)cc2)SC1=S 5374814 WHTCFQWVWFXKAG-RIYZIHGNSA-N 389.889 3.818 10 40 GHCB Cc1cccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 6747944 PJMZSSWPTFLSGS-QFIPXVFZSA-N 382.504 3.648 10 40 GHCB CN1CCN(Cc2c(O)c(Cl)cc3c(-c4ccccc4)cc(=O)oc23)CC1 19908967 XFBSPFIQPJJIEQ-UHFFFAOYSA-N 384.863 3.566 10 40 GHCB COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\c1ccc(F)cc1 408584080 LMERQSAQEAIYCR-BOPFTXTBSA-N 382.347 3.611 10 40 GHCB CCCCN1C(=O)/C(=C\c2cc(OCC)c(O)c([N+](=O)[O-])c2)SC1=S 36617151 LCIKLDLSWGKZGG-UKTHLTGXSA-N 382.463 3.700 10 40 GHCB Cc1ccc(N2C[C@](O)(c3ccc(OC(F)F)cc3)[N+]3=C2SCCC3)cc1 4086725 DZVYFNRDYLXMOW-FQEVSTJZSA-N 391.463 3.767 10 40 GHCB CC1=C(C(=O)Nc2cc(C)cc(C)c2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 4189213 URPKTGWJEJGRBO-HXUWFJFHSA-N 394.544 3.801 10 40 GHCB O=C(O)CCN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 967016 XRUZQMALKZLVGA-SFQUDFHCSA-N 399.493 3.942 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C\c2ccc(Br)s2)SC1=S 21323374 TXNKHVLNWOLSCS-SOFGYWHQSA-N 392.321 3.577 10 40 GHCB Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)n1-c1ccccc1 223635632 BDXPCPFKIRKDQM-SFTDATJTSA-N 392.528 3.536 10 40 GHCB CCOc1ccc(C(=O)NCCCN(C)c2ccc(OC)cc2)cc1OCC 225067067 UHBYCCVGIGJYMX-UHFFFAOYSA-N 386.492 3.749 10 40 GHCB COc1ccc(-c2ccc(C=C3C(=O)OC4(CCCC4)OC3=O)o2)c([N+](=O)[O-])c1 13915740 LYDMMVHQUUIAFD-UHFFFAOYSA-N 399.355 3.617 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 16157349 YRVNGDOPTRPBPN-AQTBWJFISA-N 397.862 3.853 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccs2)SC1=S)c1cccc(Cl)c1 6191572 LRSGXLBTBMPDGF-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB O=C(CCSc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 10113297 YRUDZOMOAKSNIR-UHFFFAOYSA-N 390.936 3.975 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)cc3)C2=O)cc1C 4704715 XNPOHOYZTGZBJV-XSFVSMFZSA-N 389.455 3.570 10 40 GHCB Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 7378468 BPXOFAPTPOUASK-UHFFFAOYSA-N 393.399 3.798 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1cc2ccccc2o1 12565021 SLAHTHBURPFOMA-ZHACJKMWSA-N 376.456 3.941 10 40 GHCB O=C(O)COc1cccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)c1 3768173 XVDTWXMTENSYSD-XNTDXEJSSA-N 377.487 3.684 10 40 GHCB CCn1c(-c2ccc(-c3ccccc3)cc2)cnc1SCC(=O)NC(N)=O 6605876 VNUUAEBTNQCBQC-UHFFFAOYSA-N 380.473 3.524 10 40 GHCB Cc1cc(C(=O)COC(=O)c2ccc(CO)cc2)c(C)n1-c1ccc(F)cc1 4895215 PVOYLMHOSNOULA-UHFFFAOYSA-N 381.403 3.765 10 40 GHCB CCOc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=CSC4=NC3=O)c2C)cc1 4404872 IISAMBKJSBIVGB-LVKBRKGQSA-N 393.472 3.742 10 40 GHCB CN(C)c1ccc(CN(C(=O)COc2ccc(F)cc2)c2ccccn2)cc1 28288139 IARGYJCXFMFPKY-UHFFFAOYSA-N 379.435 3.899 10 40 GHCB COCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc(C)n1-c1ccccc1 223033133 GQZWWWHCJIREGW-SFTDATJTSA-N 392.528 3.800 10 40 GHCB Cc1cc2oc(=O)c3c(c2c(O)c1C1=NN[C@H](c2ccc(F)cc2)C1)CCC3 12408690 WXQZFFUCQUDMEG-INIZCTEOSA-N 378.403 3.874 10 40 GHCB CC(=O)N1C(=O)/C(=C2\SC(Nc3ccc(Cl)cc3)=NC2=O)c2ccccc21 13778042 UXKHXBAGZOVEJL-NXVVXOECSA-N 397.843 3.686 10 40 GHCB Cc1cc2nc3s/c(=C\c4ccc(N5CCCC5)cc4F)c(=O)n3c2cc1C 409392623 MZNSOVYAZIBDAM-JAIQZWGSSA-N 393.487 3.813 10 40 GHCB COC(=O)C1=CN(c2cccc(C(F)(F)F)c2)c2ccccc2S1(=O)=O 64979170 KWEKEHDFLGJQNV-UHFFFAOYSA-N 383.347 3.645 10 40 GHCB CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)N2CCCCCC2)cc1 674550 NMOSKSWYOZEEAR-RELWKKBWSA-N 391.515 3.926 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3O)C2=O)cc1 1181611 NBZXQYBPOUZITD-SFQUDFHCSA-N 398.509 3.931 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/c1c[nH]n2c(=O)c3ccccc3nc12 16312072 URJWUMMGCDBOKQ-YBFXNURJSA-N 397.438 3.599 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc(C(=O)O)cc1 4699098 MFCSCUOTWJKZTK-PTNGSMBKSA-N 397.814 3.915 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N(c2ccc(O)c(C(=O)O)c2)C1=O 27530375 SUCFMCRATTUKDS-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(F)cc1 408859548 XYGZIKYZVVJSPX-DHZHZOJOSA-N 395.242 3.964 10 40 GHCB O=C(NCCc1c[nH]c2ccccc12)c1nc(-c2ccc(-n3cccc3)cc2)no1 4708965 ADICRYDACWAEJM-UHFFFAOYSA-N 397.438 3.981 10 40 GHCB CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)N2CCCCC2)cc1 820342 ALSDSRCOWVOSGV-HEHNFIMWSA-N 377.488 3.536 10 40 GHCB Cc1cc2oc(=O)c(C)c(C)c2c(O)c1C1=NN[C@@H](c2ccc3c(c2)OCO3)C1 13683785 TZYRCAXEVDGTMZ-CQSZACIVSA-N 392.411 3.591 10 40 GHCB CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C\c1c(Cl)cccc1Cl 408768398 IOHFLQWGTJSKOO-RAXLEYEMSA-N 384.259 3.703 10 40 GHCB COc1ccc([N+](=O)[O-])cc1/C=C1/SC(=S)N(n2c(C)ccc2C)C1=O 409197638 LAVZDOJCQHJTMG-OQLLNIDSSA-N 389.458 3.559 10 40 GHCB Cc1ccccc1NC1=NC(=O)/C(=C/c2ccc(N3CCOCC3)cc2)S1 59459397 CGKADHZHSDAYSO-RGEXLXHISA-N 379.485 3.914 10 40 GHCB COC(=O)c1ccccc1S(=O)(=O)Nc1ccc(-n2c(C)ccc2C)cc1 3997653 DLDNFAPIBXTKPD-UHFFFAOYSA-N 384.457 3.682 10 40 GHCB Cc1cccc(Cn2cccc(C(=O)N(C)[C@H](C)c3ccccc3O)c2=O)c1 97019213 XEIYWAJOOFPLQA-QGZVFWFLSA-N 376.456 3.744 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C\c2ccc(C(=O)O)cc2)SC1=S 35040254 TVDNAMQHNWSOEY-OVCLIPMQSA-N 399.449 3.797 10 40 GHCB COc1ccc(/C=C2\C(=O)N(C(=O)c3ccc(Cl)cc3)N=C2C)cc1OC 13780836 VDOJIDANOLMWHT-YBEGLDIGSA-N 384.819 3.799 10 40 GHCB COc1ccc(C2(Nc3ccc(C(=O)O)cc3)C(=O)c3ccccc3C2=O)cc1 7500001 AZPMVFRUTMJRAC-UHFFFAOYSA-N 387.391 3.780 10 40 GHCB O=C(c1ccco1)N1N=C(c2cccs2)C[C@@H]1c1cc([N+](=O)[O-])ccc1O 36055739 BYZUFJDZLGEQJG-CQSZACIVSA-N 383.385 3.946 10 40 GHCB O=C1N/C(=C\c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccccc1F 4688439 VRQOIAPWZZTMMT-ZHZULCJRSA-N 379.435 3.909 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc2c(c1)OCO2 5853442 XBTBUVCGUVXUMN-ZROIWOOFSA-N 397.814 3.946 10 40 GHCB O=C(O)COc1ccc(/C=C2\SC(Nc3ccc(Cl)cc3)=NC2=O)cc1 15227557 RNNDUEBAAWPXSW-DHDCSXOGSA-N 388.832 3.886 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\C=C\c2ccco2)SC1=S 27533574 XUMNCGLQAXIZJU-QZPYEJFPSA-N 385.466 3.733 10 40 GHCB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc(N(CC)CC)cc2)C1=O 6325336 QXFLNYUEGZBGJI-HKJJFUAXSA-N 376.478 3.521 10 40 GHCB COCCOC(=O)c1c2c(n3cc4ccccc4cc13)C(=O)c1ccccc1C2=O 2053614 FVLRQDDRLUAIEJ-UHFFFAOYSA-N 399.402 3.671 10 40 GHCB biogenic COCCN1C(=O)/C(=C/c2ccc(OCCC(C)C)c(OC)c2)SC1=S 2268541 APLJANBCBJTASH-ATVHPVEESA-N 395.546 3.968 10 40 GHCB COc1cc(/C=C2\SC(=S)NC2=O)ccc1OC(=O)c1ccccc1F 20921923 XXRBOVUCNVIBDV-DHDCSXOGSA-N 389.429 3.542 10 40 GHCB COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2C)C1=O 408801880 WIMXXKGMOAHIQJ-XNTDXEJSSA-N 384.819 3.632 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3ccc(F)cc3)N3CCCCC3)ccc21 13007722 XJTJWOCXKFVVGI-QFIPXVFZSA-N 381.495 3.775 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cccc4ccccc34)CC2)cc1 13709138 XFXDFZMYPBEZQG-SFHVURJKSA-N 390.483 3.965 10 40 GHCB Cc1cc(C(=O)CN2CCN(C)CC2)c(C)n1-c1cccc(C(F)(F)F)c1 22580390 WPNXBWGPSIIXGM-UHFFFAOYSA-N 379.426 3.543 10 40 GHCB CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 641350 ARXUYRBPDVWNPL-HXUWFJFHSA-N 394.544 3.801 10 40 GHCB O=C([C@@H]1CCCN(Cc2cc(Br)ccc2O)C1)N1CCCCCC1 1246106 KGTFRLMZACQVPP-OAHLLOKOSA-N 395.341 3.769 10 40 GHCB COc1ccc(-n2c(C)cc([C@@H]3NC(N)=Nc4nc5ccccc5n43)c2C)cc1 12571294 LZQFNAZMDIQWTN-HXUWFJFHSA-N 386.459 3.549 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1=Cc2cc(Cl)ccc2OC1 16182019 RLGYEPRINUULAF-UHFFFAOYSA-N 398.890 3.611 10 40 GHCB Cc1cc(C(=O)N2CC[C@@H](OCc3ccccn3)C2)c(C)n1-c1ccccc1 79110766 BQBJDMMQFMEZLB-OAQYLSRUSA-N 375.472 3.920 10 40 GHCB Cc1cccc(OCC2=NN3C(=N)/C(=C/c4ccc(C)o4)C(=O)N=C3S2)c1 3890174 FUINWPMMYFRHMH-KTVYXKAUSA-N 380.429 3.595 10 40 GHCB Cc1ccc(CNC(=O)COC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1 3376696 RMUSPHPAMSXDEW-UHFFFAOYSA-N 376.456 3.876 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)C(=O)NC2=S)cc1Cl 409242198 VJWIYOPTRDITRM-YBEGLDIGSA-N 399.903 3.546 10 40 GHCB CN1CCc2c(sc3c2C(O)=N[C@H](c2cc(Br)ccc2O)N3)C1 6732672 JROGYPQNSRRQEU-AWEZNQCLSA-N 394.294 3.633 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1cc(OC)ccc1OC 408981089 YYYPUMPJLNLUFZ-UYRXBGFRSA-N 393.439 3.577 10 40 GHCB COc1ccc(/C=C2/C(=O)N(c3cccc(C)c3C)C(=O)N=C2O)cc1OC 59860866 MKWZXSQSLKQPLY-XNTDXEJSSA-N 380.400 3.827 10 40 GHCB CC[C@H](Oc1cc(C)ccc1C)C(=O)NCc1ccc(N2CCOCC2)cc1 20460367 YYIDAQNZPQUQPW-NRFANRHFSA-N 382.504 3.614 10 40 GHCB O=C1/C(=C/c2ccc3nccnc3c2)SC(=S)N1c1ccc2c(c1)OCO2 54361146 AQYZEJXUKWVVON-IUXPMGMMSA-N 393.449 3.764 10 40 GHCB O=C1c2ccccc2N[C@H](c2cccc(O)c2O)N1c1ccc2c(c1)OCCO2 8774433 AYRBMCZQABJOEM-NRFANRHFSA-N 390.395 3.640 10 40 GHCB CC(=O)N[C@@H](CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 9975981 WPQDJJVMWCTOQM-FQEVSTJZSA-N 399.560 3.964 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)cc(Br)c1O 3570139 LSLPLXQTKDLMGU-XFFZJAGNSA-N 388.308 3.775 10 40 GHCB COc1cc(/C=C2\C(=N)N3C(=NC2=O)Sc2cc(C)c(C)cc23)ccc1O 13554264 HPPYEKOQILCSGZ-IIQNZDCVSA-N 379.441 3.887 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1 14011199 IOCDFCKTUPJQFP-XMHGGMMESA-N 377.444 3.508 10 40 GHCB CN(C)C(=O)c1ccc(C2CCN(Cc3ccc4c(c3)CCCN4C)CC2)nc1 19705806 RGSPMXGNHWRJAO-UHFFFAOYSA-N 392.547 3.545 10 40 GHCB Cc1ccc(NC(=S)NCCCN(C)c2ccccc2)cc1N1CCCC1=O 225748938 PPBCYLGICANAIO-UHFFFAOYSA-N 396.560 3.935 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3cc(C)ccc3C)C2=O)o1 409242242 WCRUHBNYBPPCKE-FOWTUZBSSA-N 397.500 3.574 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)c(OCC)c1 4836789 TYDMPYGBOAZXTF-SDKMPEEESA-N 390.505 3.564 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1cccc(O)c1 408891921 FIQLLQCIHYIYRU-UYRXBGFRSA-N 379.412 3.668 10 40 GHCB CC[C@H](C)[C@@H](NCc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12)C(=O)O 20111208 IJAAWTXJFCQYFT-ORAYPTAESA-N 397.427 3.880 10 40 GHCB biogenic CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3CC)C2=O)cc1Cl 408781153 AKPUQPUIDKCVBX-RVDMUPIBSA-N 398.846 3.968 10 40 GHCB Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccccc1O 222741014 JKCUIGXEHSWDIR-WOJBJXKFSA-N 378.501 3.797 10 40 GHCB CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1 16444851 RZASFLPSNVOABX-UHFFFAOYSA-N 384.435 3.533 10 40 GHCB COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)NC1CCCCCC1 17081715 VGFVYMAGZXCLSN-QNGOZBTKSA-N 399.491 3.547 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C/c3ccc4c(c3)OCO4)S2)c(OC)c1 5551726 LUAKQYDWUNHGLF-IUXPMGMMSA-N 384.413 3.515 10 40 GHCB Cc1cccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007798 RYKJADPZSGZFHK-HSZRJFAPSA-N 377.532 3.944 10 40 GHCB Cc1ccc(NC(=O)c2c(C)oc3ccc(O)c(CN4CCN(C)CC4)c23)cc1 19794021 SKTIDQPWKYMUOJ-UHFFFAOYSA-N 393.487 3.755 10 40 GHCB COc1ccc(C2=C/C(=C\c3cc(OC)c(OC)cc3[N+](=O)[O-])C(=O)O2)cc1 33692046 JDNHRAPNAJWXBL-RIYZIHGNSA-N 383.356 3.602 10 40 GHCB Cc1c(C)c2ccc(O)c(CN(C)C[C@@H]3CCCN4CCCC[C@H]34)c2oc1=O 524731031 HRDURUSTQFCTOI-FXAWDEMLSA-N 384.520 3.812 10 40 GHCB biogenic Cc1cccc(/C=C2\SC(N3CCN(Cc4ccccc4)CC3)=NC2=O)c1 9188905 YONIYCKBHIJBGA-HKWRFOASSA-N 377.513 3.783 10 40 GHCB Cc1cc(O[C@@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 54285556 HPOSXICXJCXURM-INIZCTEOSA-N 388.895 3.569 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1248795 NBFWSTXCHOBPOQ-NTEUORMPSA-N 376.409 3.511 10 40 GHCB O=C1C(=Cc2ccccc2O)SC(=S)N1CNc1ccc([N+](=O)[O-])cc1 2049236290 GRFVWIJERNOQKZ-UHFFFAOYSA-N 387.442 3.571 10 40 GHCB CCCN/C(C)=C1\C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccc(OC)cc1 112123982 COFFADDINZWYQZ-RGEXLXHISA-N 394.431 3.628 10 40 GHCB CCOC(=O)c1ccc(N/C(C)=C2\C(=O)N(c3ccc(OC)cc3)N=C2C)cc1 112123343 GIRWSXZMAIOBPI-ZHZULCJRSA-N 393.443 3.981 10 40 GHCB CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c1 408867545 LLTIPMNECDKYCX-LICLKQGHSA-N 384.819 3.714 10 40 GHCB COc1cc(N2N=C(C)/C(=C/Nc3ccc(C(=O)O)cc3)C2=O)ccc1Cl 408536978 YPMXYTKMFPJIFD-GDNBJRDFSA-N 385.807 3.765 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(OC(C)C)cc3)C2=O)cc1 408986844 NKELJJPHROUDSD-UYRXBGFRSA-N 378.428 3.703 10 40 GHCB COC(=O)c1sc(NCc2ccc(N3CCSCC3)cc2)nc1Cl 53573348 DFRVGHUVDWFJKG-UHFFFAOYSA-N 383.926 3.748 10 40 GHCB Cc1cc(C)c(-n2c(C)cc(C=C3C(=O)N(C)C(=S)N(C)C3=O)c2C)c(C)c1 1095372 WXVFDWDPPUVYRT-UHFFFAOYSA-N 395.528 3.618 10 40 GHCB COc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=C(C)SC4=NC3=O)c2C)cc1 34716310 GYPUFIATGBWBLK-LVKBRKGQSA-N 393.472 3.742 10 40 GHCB CC1CCN(c2ccc([C@H](C)NC(=O)c3ccc4oc(=O)n(C)c4c3)cc2)CC1 36752753 YWEQBWNQSCWYGC-INIZCTEOSA-N 393.487 3.859 10 40 GHCB COCCCN[C@H](CC(=O)Nc1ccc(/N=N\c2ccccc2)cc1)C(=O)O 101090837 PRTGFJCXPROHHV-ANEHGGCBSA-N 384.436 3.510 10 40 GHCB Cc1cc(C(=O)Cn2nc(-c3cccs3)oc2=O)c(C)n1-c1ccccc1 7114123 MYBFMJSCMRRRBU-UHFFFAOYSA-N 379.441 3.855 10 40 GHCB COc1cccc([C@H]2CC(c3cccs3)=NN2C(=O)CN2CCCCC2)c1O 8774951 OCZHFKUHICNPSV-QGZVFWFLSA-N 399.516 3.626 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3ccccc3F)N3CCCCC3)ccc21 13007708 WANJVHDOKOQNHW-JOCHJYFZSA-N 381.495 3.775 10 40 GHCB COc1ccc(-c2cc(CC3(NCc4ccc(N(C)C)cc4)COC3)no2)cc1 72321951 ZUVUOJXXPSEILX-UHFFFAOYSA-N 393.487 3.518 10 40 GHCB biogenic,in-vitro CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc2c(c1)OCO2 409032512 JSOIQIBMQUHNMR-RUDMXATFSA-N 396.271 3.917 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C\c2csc(Br)c2)SC1=S 32789558 RDBDTOIUZUXWPL-XBXARRHUSA-N 392.321 3.577 10 40 GHCB CCCCc1cc(=O)oc2c(CN[C@H](Cc3ccccc3)C(=O)O)c(O)ccc12 35686307 SFOHVNOYPYRRLD-LJQANCHMSA-N 395.455 3.627 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1 408803558 QLNDQZVDHHASFX-QGOAFFKASA-N 378.428 3.759 10 40 GHCB COc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(C2CCCCC2)C1=O 17299979 OVVBIPWODFLCHE-QGOAFFKASA-N 378.428 3.643 10 40 GHCB CCOC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1ccc(OCC)c(OC)c1 408585948 KKNHEJZCWZMSTL-BOPFTXTBSA-N 387.476 3.813 10 40 GHCB O=C1NC(=S)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(-c2ccccc2)o1 409013451 ABYBJIPEUNOXGI-SFQUDFHCSA-N 392.411 3.917 10 40 GHCB Cc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCC2)cc1C 8963335 YYSOUVOUFWZKPX-QHCPKHFHSA-N 377.532 3.863 10 40 GHCB O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1Cc2cc(Cl)ccc2O1 54035272 SRISLDMSLNAXJM-LJQANCHMSA-N 388.920 3.513 10 40 GHCB COc1ccc(/C=C2/SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)c(OC)c1 35042519 ROZYRRARLJDOPT-RQZCQDPDSA-N 398.440 3.793 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 223536382 NIWUQLOTIJNECK-KGLIPLIRSA-N 377.510 3.567 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1-c1cccc2ccccc12 1097209 OKPPQDZFGXOEST-UHFFFAOYSA-N 387.439 3.681 10 40 GHCB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@@H]2c1c(O)ccc2ccccc12 7499337 RREWOSFCBNTOGT-NRFANRHFSA-N 397.438 3.851 10 40 GHCB COc1ccccc1[C@H](c1ccc2c(OC)cccc2c1O)N1CCOCC1 20625046 DYHRMNRAJQLQAP-JOCHJYFZSA-N 379.456 3.984 10 40 GHCB COc1ccc2c(c1)c(/C=C1\SC(Nc3ccccn3)=NC1=O)c(C)n2C 54361090 FADXJGRVJLKIIM-BOPFTXTBSA-N 378.457 3.973 10 40 GHCB CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 22518469 APRKWYYKGDIQRF-JOCHJYFZSA-N 382.504 3.818 10 40 GHCB O=C1c2ccccc2N[C@H](c2ccc(N3CCOCC3)cc2)N1Cc1ccco1 7112546 CWXMAWDRNRRSIC-QFIPXVFZSA-N 389.455 3.883 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/Nc1ccc(Cl)c(Cl)c1 5650165 ZKWUADZMZJNPSZ-FMIVXFBMSA-N 376.199 3.572 10 40 GHCB COc1ccccc1/C=C1\C(=O)NC(=S)N(c2ccc(C(C)C)cc2)C1=O 409238084 YYYXZTQDJVSBRG-SFQUDFHCSA-N 380.469 3.650 10 40 GHCB COc1cc(NC(N)=O)ccc1Nc1c2ccc(N)cc2nc2cc(N)ccc12 5390322 ZUAARCDNMVJQEF-UHFFFAOYSA-N 388.431 3.795 10 40 GHCB CC(C)OC(=O)CCCCCN1C(=O)/C(=C/c2ccccn2)SC1=S 3267788 KPFDMBDFVHMNDI-QINSGFPZSA-N 378.519 3.795 10 40 GHCB COc1ccc(N2CCN([C@H](C(=O)O)c3c[nH]c4ccc(Cl)cc34)CC2)cc1 20722992 JWRAFCAHRGEZFK-FQEVSTJZSA-N 399.878 3.778 10 40 GHCB COc1ccc(-c2nc(/N=N/c3n[nH]c(-c4ccc(OC)cc4)n3)n[nH]2)cc1 102417926 DMAPXBCLYGPSGA-OCEACIFDSA-N 376.380 3.689 10 40 GHCB COc1ccc(NC(=O)CN2C(=O)/C(=C/c3cccs3)SC2=S)cc1 1255852 VLRIJDBCKNRQRX-ZROIWOOFSA-N 390.511 3.597 10 40 GHCB Cn1cc(/C=C2\C(=O)N(CCc3ccc(F)cc3)C(=O)N=C2O)c2ccccc21 13775398 LSOQJRLDRFPCRI-PDGQHHTCSA-N 391.402 3.862 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C/c2ccc3cccc(Cl)c3n2)SC1=S 6661002 JSLYKDAOGZLDOV-LCYFTJDESA-N 392.889 3.954 10 40 GHCB Cc1ccc(C)n1N1C(=O)/C(=C/c2coc3ccccc3c2=O)SC1=S 9233914 ZXRNPFSEQGXSPH-SXGWCWSVSA-N 382.466 3.749 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 32707955 NGBAEILFTMJJAC-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB O=C1NC(=S)S/C1=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 40942091 DXFADSFNYYVWTP-PFONDFGASA-N 386.885 3.746 10 40 GHCB CN1C(=O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)C(O)=NC1=S 1242059 KVESKEYFFRUBFS-GZTJUZNOSA-N 375.453 3.786 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3cccnc3)C2=O)cc1Cl 15013733 ATNCNVASFPJZIE-CDCQXCROSA-N 399.834 3.579 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCCC3)ccc21 13007786 JJFZODNMRPUAJM-QFIPXVFZSA-N 399.485 3.914 10 40 GHCB Cc1ccsc1/C=C1\SC(N2CCN(c3ccc(F)cc3)CC2)=NC1=O 9189284 HVVVZNDBJHKRJL-ATVHPVEESA-N 387.505 3.988 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(Cl)c(Cl)c1 4703303 NWJUCMHYYKSGBP-KPKJPENVSA-N 379.174 3.799 10 40 GHCB CN1C(=O)/C(=C/c2ccc3c(c2)CCCN3Cc2ccccc2)C(O)=NC1=S 9009942 AVZUDASLUWHGRZ-QGOAFFKASA-N 391.496 3.736 10 40 GHCB Cc1ccccc1NC(=O)C[C@@H]1SC(=S)N(CCc2ccccc2)C1=O 9024658 MKHCAFLATJSBRX-KRWDZBQOSA-N 384.526 3.795 10 40 GHCB COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 408795315 LZLNCTXPUKCRAJ-RMENWYJGSA-N 391.423 3.819 10 40 GHCB Cc1cccc(/C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 35648372 HTWWZDSNWWCQHG-WLSWZUKCSA-N 383.494 3.892 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(O)c(OC)c1 58883941 DANQYIVQEVUJJH-SXGWCWSVSA-N 399.830 3.931 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1cccc(OC)c1OC 59435668 BOGSQRXDLCOLPW-AQTBWJFISA-N 393.439 3.577 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccc(F)c1 408856228 JOMLCSIWBKGVKQ-DHZHZOJOSA-N 395.242 3.964 10 40 GHCB CC1=NN(CCc2nc(-c3ccccc3)cs2)C(=O)/C1=C1\CCCCCN1 5695209 UIRXNZGGFVRAOI-LVZFUZTISA-N 380.517 3.988 10 40 GHCB COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 89904568 FNINFASGRZVDQQ-JKSUJKDBSA-N 397.475 3.522 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)sc2c1CC[C@@H](C)C2 5020623 UFWMPQNXIXEGJU-FRRDWIJNSA-N 391.489 3.655 10 40 GHCB Cc1cc(/C=C2\C(=O)N=C(O)N(Cc3ccco3)C2=O)c(C)n1C1CCCC1 1254736 ZRYRCVXDJUYJPL-WOJGMQOQSA-N 381.432 3.679 10 40 GHCB COc1ccc(/C=C2/N=C(c3ccccc3)N(c3nccs3)C2=O)cc1OC 2363522 JNLSHZMRPKEAMI-FOWTUZBSSA-N 391.452 3.995 10 40 GHCB CCOc1ccc(-n2c(C)cc(C(=O)COc3ccc(C(N)=O)cc3)c2C)cc1 6289965 WOZYLKSZVFBDLD-UHFFFAOYSA-N 392.455 3.853 10 40 GHCB COc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 14011097 FSJQEJIEKOUJCC-ZROIWOOFSA-N 391.210 3.668 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3cccc(C)c3)C2=O)cc1 408962958 LKTZKMINHXFTIY-XSFVSMFZSA-N 385.423 3.761 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)c1 408899287 OAANFFFRMHAYEZ-LDADJPATSA-N 378.428 3.757 10 40 GHCB CC(C)c1ccc(CCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 217031657 ATAUOWBBGKYUOF-UHFFFAOYSA-N 379.548 3.811 10 40 GHCB Cc1ccc(/N=N\c2c(O)nc3ccccc3c2O)c(S(=O)(=O)N(C)C)c1 13125933 OUECECSFOVBXOS-MRCUWXFGSA-N 386.433 3.620 10 40 GHCB in-vitro Cc1cc(Cl)ccc1OCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 12536691 OQWHNIRKSYEAIL-UHFFFAOYSA-N 388.895 3.522 10 40 GHCB CC1=C(C(=O)O[C@H]2CC[C@@H](C)[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 4043515 PGIBQQKMAPFGKC-ZQCAWNDQSA-N 385.508 3.748 10 40 GHCB C/C(NC[C@H]1CCCO1)=C1/C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 112120127 MITOPCRTFFUUAJ-GCFJHJGGSA-N 379.435 3.619 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 5953556 UPCFBIXNWOABJF-ATVHPVEESA-N 398.509 3.940 10 40 GHCB Cc1ccc(S(=O)(=O)Nc2sc3c(c2C(N)=O)CCCCCC3)cc1 995057 HJBKZQDOUPLIBK-UHFFFAOYSA-N 378.519 3.615 10 40 GHCB CC(=O)NC1=NN(c2ccccc2)C(=O)[C@H]1/N=N/c1cccc(C(F)(F)F)c1 4545047 REOJGFICRHLHSD-KGHZBTQCSA-N 389.337 3.654 10 40 GHCB CCCOc1ccc(/C=C2/C(=O)N(C(=O)c3ccccc3)N=C2C)cc1OC 408945476 WNHIBAWRFFICCO-QGOAFFKASA-N 378.428 3.926 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=c3\sc4nc5ccccc5n4c3=O)c2C)nc1 408967193 TXQNBWNNTJKELE-ODLFYWEKSA-N 386.480 3.568 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccccc3C(C)C)CC2)cc1 20111099 BGXOUCHVIJUGJE-SFHVURJKSA-N 382.504 3.935 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(Cl)s1 636306 VGISSPXECNEJOX-YRNVUSSQSA-N 383.281 3.886 10 40 GHCB CN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3Cl)o2)C(=O)NC1=S 13942809 ISFNSXIHYAKDED-XFFZJAGNSA-N 381.240 3.510 10 40 GHCB Cc1ccc(C(=O)O)cc1NC(=O)CSc1nc2cc(Cl)ccc2[nH]1 9094759 GGKDCYYODUJWMB-UHFFFAOYSA-N 375.837 3.954 10 40 GHCB Cc1cc2oc(=O)c3c(c2c(O)c1C1=NN[C@@H](c2cccc(F)c2)C1)CCC3 12321914 LAJDKZJYILAEML-MRXNPFEDSA-N 378.403 3.874 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)NC2=S)c(C)c1 409139190 BCGTYYQYOFORNZ-LDADJPATSA-N 394.496 3.922 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1Cl 6132909 QEXVKIONJYLVAK-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])SC2=S)cc1 4470719 OLWSAEFWAJGVKK-MHWRWJLKSA-N 399.453 3.959 10 40 GHCB Cc1oc(-c2cccs2)nc1CC(=O)NCc1ccc2c(c1)CCCN2C 84053220 BJMYSULDFZHWPZ-UHFFFAOYSA-N 381.501 3.953 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S)c1cccs1 409342473 FFNLLGJUZUGESO-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB Cc1noc(C)c1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1 224370205 XFDRWQAMEPMTSD-UHFFFAOYSA-N 390.848 3.977 10 40 GHCB O=C1N=C(O)/C(=C/c2ccc([N+](=O)[O-])o2)C(=O)N1c1cccc(C(F)(F)F)c1 16399236 KZUJNSKDDIVGCE-XFFZJAGNSA-N 395.249 3.713 10 40 GHCB Cn1cc(/C=C2\SC(Nc3ccccc3C(=O)O)=NC2=O)c2ccccc21 27230642 MZWWMCQXGDZJBU-YVLHZVERSA-N 377.425 3.959 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc2c(c1)OCO2 409002386 UEYNAIGPEIYTLM-ZDLGFXPLSA-N 391.423 3.909 10 40 GHCB CCOc1ccc(-n2c(C)cc(/C=C3/C(=O)N(CC)C(=O)N=C3O)c2C)cc1 5947711 HOJRRUYLPQQGCK-LDADJPATSA-N 381.432 3.815 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c(C)n1C 408776189 NCUSLHRLQHVZSA-NTUHNPAUSA-N 392.242 3.615 10 40 GHCB COc1ccc(N2CCN(C[C@H](O)c3ccc(C(F)(F)F)cc3)CC2)cc1 51092647 VCSNTPALGPDVIM-IBGZPJMESA-N 380.410 3.570 10 40 GHCB CCCc1cc2c(-c3ccccc3)cc(=O)oc2c(CN2CCOCC2)c1O 19926590 DUOPNEJBYYEMBO-UHFFFAOYSA-N 379.456 3.950 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)c(OCC)c1 1246487 TYDMPYGBOAZXTF-GBBOCIJVSA-N 390.505 3.564 10 40 GHCB CCOc1ccc(/C=C2/SC(N3CCN(c4ccccc4)CC3)=NC2=O)cc1 1471555 VUVKXXMLSTZXGD-CAPFRKAQSA-N 393.512 3.878 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccs2)SC1=S 6133312 YXNAFKSTVBIXPB-PCRWRXJSSA-N 375.496 3.645 10 40 GHCB C[C@@H](N1C(=O)NC(=O)/C(=C\c2cccs2)C1=O)C12CC3CC(CC(C3)C1)C2 16576084 KFXYLMXZWGPGMO-OMJVHFJTSA-N 384.501 3.815 10 40 GHCB COc1ccc(N2CCN(C[C@H](O)COc3ccccc3C(C)(C)C)CC2)cc1 96134159 KOPOEFLWKCWVCH-FQEVSTJZSA-N 398.547 3.555 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1N1CCOCC1 409067397 CUCHRHQNGBFKOQ-LDADJPATSA-N 397.862 3.582 10 40 GHCB CC[C@@H]1CCCCN1C(=O)CN1C(=O)/C(=C\c2cccs2)SC1=S 4745373 CYNITCHGIRLGFU-HLVNSREUSA-N 380.560 3.740 10 40 GHCB Cc1cc2oc(=O)c3c(c2c(O)c1C1=NN[C@@H](c2ccc(F)cc2)C1)CCC3 12408689 WXQZFFUCQUDMEG-MRXNPFEDSA-N 378.403 3.874 10 40 GHCB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2cccc(F)c2)o1 2099499 QCPCFLRTZVCUPT-SFQUDFHCSA-N 392.411 3.917 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 6061398 YOXUOPFXFNNIAV-YLQKULKDSA-N 387.457 3.723 10 40 GHCB O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C/c2nc3ccccc3[nH]2)SC1=S 2195955 FTUMZFGDFHFZCL-SCOADAFUSA-N 395.465 3.590 10 40 GHCB O=C1N=C(O)/C(=C/c2ccc(O)c(Br)c2)C(=O)N1c1ccccc1 27904382 IUOZDNVNFMBUQU-WQLSENKSSA-N 387.189 3.661 10 40 GHCB CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(OC(C)C)cc2)C1=O 409247628 DWXGCNHTKFJXRM-GHRIWEEISA-N 394.427 3.539 10 40 GHCB Cc1cc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccccc32)ccc1F 49003796 YEJJDFZXXNDJTG-UHFFFAOYSA-N 386.448 3.523 10 40 GHCB CN(C)Cc1c(O)ccc2c(-c3cc4cc(Cl)ccc4oc3=O)cc(=O)oc12 4339978 FFZOZZSZGFOVGS-UHFFFAOYSA-N 397.814 3.987 10 40 GHCB biogenic CCc1ccc(N2C(=O)/C(=C\c3cc(C)n(CC)c3C)C(=O)NC2=S)cc1 6006686 LDBOFENLMPMJGP-PDGQHHTCSA-N 381.501 3.519 10 40 GHCB C/C(NCC(C)C)=C1/C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 112120146 HECXDQPITMUDFG-CYVLTUHYSA-N 378.432 3.865 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2sccc2[C@@H]1C1CC1 7255665 VESKIFVZZIVEGF-QFIPXVFZSA-N 383.561 3.782 10 40 GHCB Cc1cccc(/C=C2/SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)n1 409334304 WXOMQIZJJHWPAD-NTEUORMPSA-N 389.889 3.590 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C\Nc2ccc(C)c(Cl)c2)C1=O 408535168 XVAAGQUWTLURBX-RVDMUPIBSA-N 383.835 3.790 10 40 GHCB COc1ccc(N2C(=O)/C(=C\c3cc(C)n(C(C)C)c3C)C(=O)NC2=S)cc1 1160757 IHBNIZRKHNMYKG-WQRHYEAKSA-N 397.500 3.526 10 40 GHCB COC(=O)c1ccc(Cn2c3c(c4ccccc4c2=O)C(=O)c2ccccc2-3)o1 604404266 AQXNWXCXCHXEQL-UHFFFAOYSA-N 385.375 3.641 10 40 GHCB biogenic CC1=NN(c2ccc(C)cc2)C(=O)/C1=C1/C(=O)Nc2ccc(Br)cc21 5544076 FNWDRQNGIBSYOY-WUKNDPDISA-N 396.244 3.886 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C(C)C)cc3)C2=O)cc1 1200809 CBVLBJOCCWBENM-CPNJWEJPSA-N 378.428 3.875 10 40 GHCB CCN(CCNC(=S)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(C)cc1 225794396 CSQRUEMWLWBKIB-UHFFFAOYSA-N 384.549 3.510 10 40 GHCB CCOC(=O)c1ccc(NC(=S)NCCCN(C)c2ccccc2)c(C)c1 225748497 TWMRYQDWTLLGBU-UHFFFAOYSA-N 385.533 3.985 10 40 GHCB CCOc1ccc(O)c(CN2CCC(NC(C)=O)(c3ccc(F)cc3)CC2)c1 12344538 HDCSGTWGUSFBJF-UHFFFAOYSA-N 386.467 3.557 10 40 GHCB CCCN1C(=O)/C(=C/c2cc(C)n(-c3ccc([N+](=O)[O-])cc3)c2C)N=C1S 3667617 QIOOYAYYEKTHQI-BOPFTXTBSA-N 384.461 3.881 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@@H](CC)C(=O)O)C2=O)cc1OCC 2700861 FBRFPKJWIBDEAF-GQVHDAKQSA-N 395.502 3.548 10 40 GHCB CCN(CC)c1ccc(CN2CC[C@H]3[C@@H]2CC(=O)N3Cc2csc(C)n2)cc1 2056226156 LURSBTPRODSSSG-SFTDATJTSA-N 398.576 3.673 10 40 GHCB COc1ccc(NC(=O)N/C=C2\C(=O)N(c3cccc(Cl)c3)N=C2C)cc1 102522388 OSEFYOKLLCIDDR-BOPFTXTBSA-N 384.823 3.777 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1cccc(OC)c1O 59959372 PQGNPLCNDZTLMF-PDGQHHTCSA-N 393.439 3.582 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(OC)cc1OC 408768740 KARPFDWWHJZWRM-UNOMPAQXSA-N 393.439 3.889 10 40 GHCB CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C\c1cc2c(cc1Cl)OCO2 16160876 ZTLZSSSFEILDFL-NSIKDUERSA-N 384.775 3.573 10 40 GHCB Cc1cc(N2CCOCC2)ccc1CN(Cc1ccccc1)C1CCN(C)CC1 19717705 QJWAXZWZDQCLBH-UHFFFAOYSA-N 393.575 3.928 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)Nc1nccs1 1155832 CWLWDIRXNNJTAB-FMIVXFBMSA-N 393.490 3.512 10 40 GHCB O=C1[C@@H](Cc2ccc3c(c2)OCO3)SC(=S)N1Cc1ccc(F)cc1 409160858 JPTCXFWRJCNZLM-MRXNPFEDSA-N 375.446 3.526 10 40 GHCB Cc1ccc(C)c(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)NC2=S)c1 409235009 AMNQPOOGPDFPBA-SFQUDFHCSA-N 394.496 3.922 10 40 GHCB CC[C@@H](Oc1ccc(C)cc1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 222950911 QTHVREXGHUSHEY-OAQYLSRUSA-N 382.504 3.818 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2cc(OC)ccc2OC)SC1=S 5371390 QPKBHMSFKKBDLP-OJNRTJSBSA-N 395.502 3.548 10 40 GHCB CC(C)N1C(=O)/C(=C/c2cc3ccccc3nc2N2CCOCC2)SC1=S 20310823 YGAJNZDYTPGHOV-ATVHPVEESA-N 399.541 3.681 10 40 GHCB CCc1cc2c(=O)c(-c3nc4ccccc4n3C)coc2c(CN(C)C)c1O 625840 SEOOJQZAXYFUBN-UHFFFAOYSA-N 377.444 3.676 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)sc2c1CCCC2 4291925 JXLFVINTYJJOLS-NWDGAFQWSA-N 379.478 3.633 10 40 GHCB Cc1cc(C)cc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)c1 5516593 SQQDNVDEXXTPAC-DVUFLMGDSA-N 377.473 3.960 10 40 GHCB CCCCCCN1C(=O)N=C(O)/C(=C/c2ccc(OC)c(OC)c2OC)C1=O 6782988 WELAFDKRYAOTDV-OWBHPGMISA-N 390.436 3.595 10 40 GHCB COc1ccc2[nH]cc(C3=CCN(c4cc(C5CC5)nc5ncnn45)CC3)c2c1 79046803 IKRDMCNSRFZEAC-UHFFFAOYSA-N 386.459 3.785 10 40 GHCB CCOc1ccc(/C=C2/SC(Nc3ccccc3C(=O)O)=NC2=O)cc1OC 35042695 SANFOIZJBOHSDC-GZTJUZNOSA-N 398.440 3.875 10 40 GHCB CC(C)N1CCC2(CC1)N=C(c1ccccc1O)C[C@@H](c1ccccc1O)N2 80324866 ZJYVMECYMISWOH-IBGZPJMESA-N 379.504 3.822 10 40 GHCB COC(=O)c1cc(NC(=S)NCCN(C)c2ccc(C)cc2)ccc1Cl 225796068 XPIPFZXSLHEBMF-UHFFFAOYSA-N 391.924 3.858 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1C(C)C 223702165 ZUVBHDXVCYTDMO-UHFFFAOYSA-N 388.533 3.897 10 40 GHCB Cc1cc(C)c(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc1C 98002424 HLVPDIXHJNCVGR-QGOAFFKASA-N 390.574 3.535 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 685980 ZJKGNMJEKVTERL-PDGQHHTCSA-N 392.411 3.776 10 40 GHCB CCc1cc2c(C)cc(=O)oc2c(CN(C)Cc2ccc3c(c2)OCCO3)c1O 12972037 STTRENAYTQXANX-UHFFFAOYSA-N 395.455 3.773 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl 408776074 TXWJCSPFTRVSKP-QPEQYQDCSA-N 391.210 3.668 10 40 GHCB COc1c(C(C)C)c(O)c(O)c2c1[C@@H](OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13 67912651 DHNUPRDARUHAJK-IWQHBPENSA-N 390.476 3.920 10 40 GHCB endogenous,in-man Cc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(N3CCCCC3)cc2)C1=O 14133126 LVCLATWSRQAEOD-XDJHFCHBSA-N 389.455 3.652 10 40 GHCB O=C(NN1C(=O)/C(=C/c2cccc(F)c2)SC1=S)c1ccc(F)cc1 1257918 UPYAFJAAGLQDTK-ZROIWOOFSA-N 376.409 3.511 10 40 GHCB CC(C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 408812256 SABXHKPJFWGTPB-LICLKQGHSA-N 384.819 3.794 10 40 GHCB Cc1cc2c(cc1C)N1C(=N)/C(=C\c3ccc(C(=O)O)cc3)C(=O)N=C1S2 13541644 JNYRWAIQTUNXCG-OVDNTTTISA-N 377.425 3.871 10 40 GHCB CN(C)c1ccc([C@@H]2CC(c3ccc(Cl)cc3)=NN2C(=O)CCC(=O)O)cc1 4834599 QEXXSDPLTRYSMZ-IBGZPJMESA-N 399.878 3.949 10 40 GHCB CCN1C(=O)/C(=C\c2cccn2CC)C(=O)N(c2ccc(Cl)cc2)C1=S 409020672 RXOWEAMIHYUSGP-FOWTUZBSSA-N 387.892 3.725 10 40 GHCB CC[C@@H](C)Oc1ccc(C=C2C(=O)N(CC)C(=S)N(CC)C2=O)cc1Cl 409017931 WLDKVDPGUXMWGO-GFCCVEGCSA-N 394.924 3.896 10 40 GHCB CC(C)N1c2ccc(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc2[C@@H](C)CC1(C)C 223550176 SVKIOGNDVMLDSY-AWEZNQCLSA-N 383.492 3.621 10 40 GHCB Cc1onc(C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1CN(C)C 19714801 TULUQJMRHFLUIK-INIZCTEOSA-N 384.524 3.772 10 40 GHCB C[C@@H](NC(=O)c1cc(-c2cccc(F)c2)no1)c1ccc(N2CCOCC2)cc1 19718148 OEHBWWCBEREEFJ-OAHLLOKOSA-N 395.434 3.808 10 40 GHCB Cn1c(-c2ccccc2)cnc1SCC(=O)Nc1ccc2c(c1)OCCO2 7129210 HESLBNVMFGBWST-UHFFFAOYSA-N 381.457 3.589 10 40 GHCB COc1cc2c(cc1C[C@H]1SC(=S)N(CCC3CCCC3)C1=O)OCO2 8114101 OHVLKWGUYNIYIX-QGZVFWFLSA-N 393.530 3.776 10 40 GHCB CC(=O)N1C(=O)/C(=C2\SC(=S)N(c3ccc(C)cc3)C2=O)c2ccccc21 1011268 IIFBFMIVSIHNQT-MSUUIHNZSA-N 394.477 3.664 10 40 GHCB CC(=O)Nc1ccc(NC2=NC(=O)/C(=C\c3ccc(N(C)C)cc3)S2)cc1 35043496 DJPNVFKGUZJVQH-LDADJPATSA-N 380.473 3.793 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)NC1CCCCC1 12032343 VUKIYQLTRNTZOT-FOWTUZBSSA-N 392.521 3.866 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)Cn3nnc(-c4ccccc4)n3)c2C)cc1 2659020 WHENVXBQKKXYGP-UHFFFAOYSA-N 387.443 3.639 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=O)N(Cc3cccc(C)c3)C2=O)c(OC)c1 639619 BKOYGRNNCBUZIR-DEDYPNTBSA-N 393.487 3.943 10 40 GHCB CCN1CCc2cc(/C=C3\C(=O)N(c4ccc(F)cc4)C(=O)N=C3O)ccc21 1846621 KWSJOKWOLFZBDQ-ATVHPVEESA-N 379.391 3.715 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 4356719 NGBAEILFTMJJAC-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C\c3ccc(O)c(O)c3)SC2=S)cc1 5345613 MOKQHRDINZGAGS-GZTJUZNOSA-N 387.482 3.550 10 40 GHCB Cc1cccc(N2C(=O)/C(=C\c3c(C)n(C)c4ccccc34)C(=O)NC2=S)c1 4649284 XUVGFTUJMICVKP-PDGQHHTCSA-N 389.480 3.626 10 40 GHCB CCCCN/C=C1\C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccc(OC)cc1 9434903 SKJARAVYUWSATN-RGEXLXHISA-N 394.431 3.628 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C\c2ccc(-c3ccc(Br)cc3)o2)S1 408720018 VSWZKJBDWRSGLJ-RIYZIHGNSA-N 391.246 3.816 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCC(=O)OC(C)C)cc1 409188490 ZTLCADHLKDDTRE-DEDYPNTBSA-N 378.428 3.823 10 40 GHCB COC(=O)C1=CN(c2ccc(F)c(Cl)c2)c2ccc(F)cc2S1(=O)=O 64979250 ILGOYSIVOUZYSR-UHFFFAOYSA-N 385.775 3.558 10 40 GHCB CCN(CC)c1ccc(CNS(=O)(=O)c2cc(C)c(OC)cc2C)cc1 223781260 VGUFJKIXDXKMPW-UHFFFAOYSA-N 376.522 3.637 10 40 GHCB CCOc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)ccc1OC 1200331 WTIRMSSTAUJXBI-LFIBNONCSA-N 380.400 3.909 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)Sc2scc(-c3ccc(O)c(O)c3)[n+]21 1636441 LYYRIQMBKOTXAS-APSNUPSMSA-O 399.429 3.809 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(C)cc4)on3)CC2)cc1 11916452 XRASNJUFWQIKJE-UHFFFAOYSA-N 377.444 3.621 10 40 GHCB COc1cccc(/C=C2\SC(=S)N([C@@H](C(=O)O)c3ccccc3)C2=O)c1 12032583 YBJFBVHJAYUQFB-UVQBRAAOSA-N 385.466 3.722 10 40 GHCB O=C1/C(=C\c2cnc3ccccc3n2)SC(=S)N1c1ccc2c(c1)OCO2 13691709 ZPYCXNHGFKZRLA-REZTVBANSA-N 393.449 3.764 10 40 GHCB COc1ccc(N2N=C(C)/C(=C\Nc3cc([N+](=O)[O-])ccc3Cl)C2=O)cc1 101112584 XWTWKROBAQMEJB-XNTDXEJSSA-N 386.795 3.975 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1Cl 408781565 BUWKBHWAXGEPKC-DHDCSXOGSA-N 384.819 3.632 10 40 GHCB COCCCN1C(=O)S/C(=C/c2ccc(N3CCCCC3)c(F)c2)C1=O 409222006 AUFDRVDYJSEJMS-GHRIWEEISA-N 378.469 3.889 10 40 GHCB CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(Cl)ccc2O)cc1 7988840 UQJRFPWDEGAQMR-GOSISDBHSA-N 388.895 3.933 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)ccc1O 409035855 QMRKWKJVTZTJGC-WEVVVXLNSA-N 398.287 3.902 10 40 GHCB COc1ccc(NC(=S)NCCCN2CCc3ccccc32)c2cccnc12 225561704 WOZXFCQNAWSTCO-UHFFFAOYSA-N 392.528 3.983 10 40 GHCB Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)n1-c1ccccc1 223635499 BDXPCPFKIRKDQM-NHCUHLMSSA-N 392.528 3.536 10 40 GHCB COc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1OC 7052469 BZVYORMGOFANOB-UHFFFAOYSA-N 376.459 3.628 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)O)sc2c1CCC2 5408484 FELSALOMWGPMNN-KBPBESRZSA-N 391.489 3.799 10 40 GHCB CCN1c2cc(C)c(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc2[C@H](C)CC1(C)C 113790439 AMOPHHONDKLJQP-CQSZACIVSA-N 383.492 3.541 10 40 GHCB CCOC(=O)CCc1c(C)c2cc(CN3CCCCC3)c(O)c(C)c2oc1=O 9476735 XOHJPALVJKSUSH-UHFFFAOYSA-N 387.476 3.597 10 40 GHCB CCC(=O)N[C@H](C)[C@H](c1cccs1)N1CCN(c2ccc(OC)cc2)CC1 23181503 VVQIVVCYGKKCRM-IIBYNOLFSA-N 387.549 3.535 10 40 GHCB Oc1ccc(F)cc1C1=NN[C@H](c2cc(Br)cc3c2OCOC3)C1 1504464 SNLYBWVQESYLOP-HNNXBMFYSA-N 393.212 3.599 10 40 GHCB CCN1CCc2c(sc3c2C(O)=N[C@H](c2cc(Cl)cc(OC)c2O)N3)C1 4556398 HOZUUFPYKKEUMS-INIZCTEOSA-N 393.896 3.923 10 40 GHCB CCCCN1C(=O)/C(=C\c2cc(Br)ccc2O)C(C(=O)OC)=C1C 408584293 NVXPJWWKJUSXGG-UVTDQMKNSA-N 394.265 3.627 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(Nc3ccc(OC)cc3OC)=NC2=O)cc1 35043246 KFEJNQLCRRIGCF-LICLKQGHSA-N 398.440 3.573 10 40 GHCB CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)cc1 260572623 JZUFUTCRRYLJCP-KRWDZBQOSA-N 388.533 3.800 10 40 GHCB COCCn1c(-c2ccccc2)cnc1SCC(=O)Nc1nc(C)cs1 44085849 LDFKLJQMSHWQHD-UHFFFAOYSA-N 388.518 3.692 10 40 GHCB COc1ccc(N2C(=O)/C(=C\c3cn(C)c4ccccc34)C(O)=NC2=S)cc1 4180982 DFQFHCADUQTFJB-BOPFTXTBSA-N 391.452 3.859 10 40 GHCB biogenic Cc1ccc(C2=NN3C(=N)/C(=C/c4ccc(N(C)C)cc4)C(=O)N=C3S2)cc1 27546762 BNDURNVGBVMDKH-SABKFZPKSA-N 389.484 3.728 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 408996602 JBZHJOFOTKVTPN-PDGQHHTCSA-N 378.384 3.780 10 40 GHCB Cc1nccn1-c1ccc([C@@H](C)NCc2ccc(N3CCN(C)CC3)cc2)cc1 95459050 WWDJBKVZVTWRLB-LJQANCHMSA-N 389.547 3.783 10 40 GHCB O=C(O)COc1ccc(/C=C2/SC(Nc3ccc(Cl)cc3)=NC2=O)cc1 20428804 RNNDUEBAAWPXSW-OQLLNIDSSA-N 388.832 3.886 10 40 GHCB CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 20480975 GZDCYPYPXWDQKG-JOCHJYFZSA-N 382.504 3.614 10 40 GHCB COC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)c(C)c1 408819848 UKPIUZAYFLPYSL-YVLHZVERSA-N 384.457 3.855 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(O)c(Cl)c2)SC1=S)c1cccs1 409347308 PFAVDEPEKGRKGA-KPKJPENVSA-N 396.902 3.653 10 40 GHCB O=C(c1ccccc1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 223650783 OPPOCHOHOHWJFJ-UHFFFAOYSA-N 382.397 3.627 10 40 GHCB O=C1c2ccccc2C(=O)c2c1oc1c3c(ccc21)OCN(C[C@@H]1CCCO1)C3 49563737 WSCPPQUBHLUYHW-ZDUSSCGKSA-N 389.407 3.539 10 40 GHCB CCc1ccc(N2C(=O)N=C(O)/C(=C\c3ccc(OC)c([N+](=O)[O-])c3)C2=O)cc1 1164149 POVVSUYVJYKDHW-XNTDXEJSSA-N 395.371 3.673 10 40 GHCB Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)c(C)n1-c1ccccc1F 10211853 HRMIYNZMZMAMGH-UHFFFAOYSA-N 394.233 3.980 10 40 GHCB COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)cc(OC)c1O 408970138 BHWUESMMPCRSID-JYRVWZFOSA-N 392.333 3.758 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\SC(=S)N(C[C@@H]2CCCO2)C1=O 4675422 NRZJQXUDQHOYLE-KMTKGMGQSA-N 388.558 3.975 10 40 GHCB COc1cccc(-n2c(C)cc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)c2C)c1 20236965 KZRSNEZWODLXOD-CMVSNXJPSA-N 376.416 3.553 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 409349918 WLYYVHOUKIHDJU-LZYBPNLTSA-N 399.449 3.608 10 40 GHCB CC(C)c1ccc(/C=C2/C(=N)N3N=C(c4cccnc4)SC3=NC2=O)cc1 33474434 QFLTUOCBZYJDFY-QNMDCZIWSA-N 375.457 3.872 10 40 GHCB Cc1cccc(CC(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N2CCCC2)c1 16838242 VVGVKVMTDSTPQD-DEOSSOPVSA-N 391.559 3.873 10 40 GHCB COc1ccc(N2CCN([C@@H](c3cccs3)[C@H](C)NC(=O)C3CC3)CC2)cc1 23181585 UWNHEZYWERCZFZ-HRAATJIYSA-N 399.560 3.535 10 40 GHCB COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(OC)cc3)C2=O)cc1 1238468 OQUXARYYEBVOGF-WJDWOHSUSA-N 385.466 3.888 10 40 GHCB CN(C)c1ccc(CNC2(Cc3cc(-c4ccc(F)cc4)on3)COC2)cc1 67897867 VACVGTOUFDXYNN-UHFFFAOYSA-N 381.451 3.648 10 40 GHCB biogenic,in-vitro COc1ccc(C[C@H](C)NC(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 15108334 PPQPYEVGANUNLA-HNNXBMFYSA-N 399.446 3.832 10 40 GHCB CN(C)c1ccc(/C=C2\SC(=O)N(CCC(=O)Nc3ccccc3)C2=O)cc1 4192400 FBLKIZUWEPCKKZ-JXAWBTAJSA-N 395.484 3.818 10 40 GHCB COc1ccc(C2=NN(C(C)=O)[C@H](c3ccc(Br)cc3)C2)c(O)c1 5163503 LLEZIRBHICTNNA-KRWDZBQOSA-N 389.249 3.861 10 40 GHCB Cc1cccc(CC(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007778 BLXWIYCFXARJDP-DEOSSOPVSA-N 391.559 3.873 10 40 GHCB COc1ccc(OC)c(NC(=O)CSc2ncc(-c3ccccc3)n2C)c1 7128727 BSIBQEQNBQOWMY-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB CCOc1ccc(N/C=C2\C(=O)N=C(S)N(CCC3=CCCCC3)C2=O)cc1 103125365 MUIIXGSTUOQNRO-NBVRZTHBSA-N 399.516 3.926 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OC)C(C(=O)OC)=C2C)cc1 408894475 QPKVTNIYLMWUPH-RGEXLXHISA-N 393.439 3.971 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C/c2ccccc2OC(C)C)C(=O)NC1=S 409235481 BLJIQUQSMIEHTD-FOWTUZBSSA-N 380.469 3.614 10 40 GHCB COc1cc(C)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1C(C)C 225669094 VMPXBPWNJDKZAU-UHFFFAOYSA-N 395.547 3.809 10 40 GHCB COc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc1C(C)C 223742261 PCEKSGNRAZALQY-UHFFFAOYSA-N 376.522 3.705 10 40 GHCB COc1cc(/C=C2/SC(=S)NC2=O)ccc1OCc1ccc(F)cc1 2119429 FBWUKRHOPLWAPA-CXUHLZMHSA-N 375.446 3.902 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3cccc(F)c3)SC2=S)cc1O 5374153 NDXQYYKPTVIBSI-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB O[C@@]1(c2ccccc2)CN(c2ccc(Br)cc2)C2=[N+]1CCCS2 17178364 JPGQJXLJBPAGIL-GOSISDBHSA-N 390.326 3.620 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)NCc3cccs3)N3CCCC3)ccc21 36705362 XQLUEPIXQFMVTR-OAQYLSRUSA-N 398.576 3.767 10 40 GHCB CCCCCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 6635150 BKZYGNHWVVYWLL-UHFFFAOYSA-N 393.439 3.914 10 40 GHCB CC(C)c1nnc(NC(=O)c2ccc(C(=O)C(=O)c3ccccc3)cc2)s1 1770293 AAULNLGHDSELTK-UHFFFAOYSA-N 379.441 3.979 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cc(C)cc(C)c3C)CC2)cc1 20453562 ZJZSUFZBIDKXBP-LJQANCHMSA-N 382.504 3.737 10 40 GHCB CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc3ccccc3n2)cc1 8341184 OILBZYAURIUXKM-IBGZPJMESA-N 390.487 3.517 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccccc1Cl 408722374 HUIYIHQBDOAVLB-UKTHLTGXSA-N 377.252 3.825 10 40 GHCB CCCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCN(c2ccccc2)CC1 22665096 BJJZYNWITXHWDN-QHCPKHFHSA-N 394.563 3.532 10 40 GHCB COc1ccccc1/C=C1\SC(N2CCN(c3ccccc3C)CC2)=NC1=O 2423745 CPNHNMWZEBXCHF-HKWRFOASSA-N 393.512 3.796 10 40 GHCB CC1=CSC2=NC(=O)/C(=C\c3cccn3-c3ccc([N+](=O)[O-])cc3)C(=N)N12 4909206 CQWDVEJGEUPBFS-QBIJJOOHSA-N 379.401 3.552 10 40 GHCB CCc1ccc2c(CN3CCN(c4ccc(OC)cc4)CC3)cc(=O)oc2c1 57548115 UOZRGYJRJFBAQA-UHFFFAOYSA-N 378.472 3.686 10 40 GHCB Cc1cccc(/C=C2/SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 35648374 HTWWZDSNWWCQHG-QRYYFKOISA-N 383.494 3.892 10 40 GHCB COC(=O)COc1ccccc1/C=C1\SC(=S)N(c2ccccc2)C1=O 15011344 RBPBGBAXAMWTCV-WJDWOHSUSA-N 385.466 3.644 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 5337655 DBXFRMLKCQOUEO-YBEGLDIGSA-N 394.387 3.628 10 40 GHCB COc1ccc(N2CCN(C(=O)c3csc(Nc4ccccc4)n3)CC2)cc1 23136752 URBSKTKQHWGMQO-UHFFFAOYSA-N 394.500 3.858 10 40 GHCB COc1ccc(-c2cc3ccc(O)c(CN4CCCC4)c3oc2=O)cc1OC 1237922 SBBPSSHBFOXAGV-UHFFFAOYSA-N 381.428 3.779 10 40 GHCB biogenic COc1ccc(NC2=NC(=O)/C(=C/c3cc(OC)c(O)c(OC)c3)S2)cc1 28605531 BDNJBQHXQJKVBF-YBEGLDIGSA-N 386.429 3.500 10 40 GHCB COc1ccccc1OCCOc1cccc(/C=C2\SC(=S)NC2=O)c1 4591044 MVUQEEZRRBRBSE-ATVHPVEESA-N 387.482 3.642 10 40 GHCB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1 2210878 GMMISOORLXTWLH-MHWRWJLKSA-N 396.786 3.855 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1O 5374173 BUBKQWXTIWZDEK-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB O=Cc1ccc(/C=C2\SC(=S)N([C@H](C(=O)O)c3ccccc3)C2=O)cc1 5375026 OASNUWFMEQCZFZ-IZNAZMGOSA-N 383.450 3.526 10 40 GHCB CCOc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCC2)cc1 8963338 MJTLFZRECXEZBN-HSZRJFAPSA-N 393.531 3.645 10 40 GHCB COc1ccc([C@@H]2CC(c3c(C)cc4oc(=O)c5c(c4c3O)CCC5)=NN2)cc1 12296397 QNGRYTQBOXEJHD-KRWDZBQOSA-N 390.439 3.743 10 40 GHCB biogenic CCOC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1ccc(N(C)C)cc1 4741592 LUVXYSQSPZEDJH-HXUWFJFHSA-N 376.460 3.954 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Cl 408804386 FGWIMZNRYSFRGC-RVDMUPIBSA-N 384.819 3.795 10 40 GHCB COc1cc(/C=C2/SC(=S)N(c3ccc(N(C)C)cc3)C2=O)ccc1O 15008433 WZAYNTUUTRVDBT-GZTJUZNOSA-N 386.498 3.873 10 40 GHCB COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cccc(Br)c1 59427955 UDVIURCRQXVYPY-DHDCSXOGSA-N 378.266 3.778 10 40 GHCB Cc1ccc(OS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 5234073 MTKALGAYAYXXBE-UHFFFAOYSA-N 378.405 3.538 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=S)N(c2ccc(C)cc2C)C1=O 409146236 KFXUNOQOJCGSNO-FOWTUZBSSA-N 380.469 3.533 10 40 GHCB CN1/C(=C/C2=CC3=S=C(c4ccccc4)C(=O)N3C=N2)Sc2ccccc21 409415786 GXSMZWPZIALSLE-WQRHYEAKSA-N 389.505 3.922 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3cccc(Br)c3)C2=O)c1C 408865207 BWKMERLYTAMYLD-XNTDXEJSSA-N 399.244 3.732 10 40 GHCB CC1CCN(c2ccc([C@H](C)NC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1 218298815 RMODPWGEDDOMMG-JTSKRJEESA-N 380.488 3.940 10 40 GHCB Cc1ccc(NC(=O)COc2ccc(/C=C3\SC(=S)NC3=O)cc2)cc1 15055967 JXFDJEYHUZBGLW-YBEGLDIGSA-N 384.482 3.501 10 40 GHCB CC(/C=C1\SC(=S)N(CC(=O)NC2CCCC2)C1=O)=C\c1ccccc1 5370999 ZDQOIEOOEPCRNC-YYMXQEISSA-N 386.542 3.893 10 40 GHCB COc1ccc(/C=C2/SC(N3CCN(c4cccc(C)c4)CC3)=NC2=O)cc1 12378265 QQQMYLIPGLLFAO-HMMYKYKNSA-N 393.512 3.796 10 40 GHCB O=C(C1=CN(c2cccc(Cl)c2)c2ccccc2S1(=O)=O)N1CCCC1 49003777 NHRQOJDSMAKVHH-UHFFFAOYSA-N 388.876 3.729 10 40 GHCB CCN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)C(C(=O)OC)=C1C 409022922 WHFVGXDUUNTMTF-ZHZULCJRSA-N 377.440 3.958 10 40 GHCB CC1=NN(c2ccc(Br)c(C)c2)C(=O)/C1=C\NC(=O)c1ccccc1 408526708 CEGTYXTWIKDSAF-WJDWOHSUSA-N 398.260 3.794 10 40 GHCB O=C1N=C(Nc2ccc(O)c(C(=O)O)c2)S/C1=C\c1c[nH]c2ccccc12 5374510 ZSIQTUBVHZSGJV-APSNUPSMSA-N 379.397 3.654 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3cc(C)cc(C)c3)C(=O)N=C2O)c(OC)c1 102558476 SGVHTWNRZMTTHT-LFIBNONCSA-N 395.415 3.740 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)cc3)C2=O)cc1 408961333 RQLRYPXUXIYHNP-HMMYKYKNSA-N 389.455 3.516 10 40 GHCB O=C(O)Cc1ccc(-n2c3c(c4ccccc4c2=O)C(=O)c2ccccc2-3)cc1 604406126 WYIQJYWRLINHNN-UHFFFAOYSA-N 381.387 3.829 10 40 GHCB biogenic CCN(CC)c1ccc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)o1 16956232 RTTYDINDKZRLFW-PTNGSMBKSA-N 387.436 3.937 10 40 GHCB COc1ccccc1NC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 10262358 NCXRVPBZSSJJOK-IBGZPJMESA-N 383.492 3.974 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C/c1ccc2c(c1)OCO2 4860514 QOBLRJUBWCAVFE-LICLKQGHSA-N 377.396 3.601 10 40 GHCB Cc1cc(/C=C2\SC(=O)NC2=O)c(C)n1-c1ccc([N+](=O)[O-])c(Cl)c1 408812614 NMDTZWVXAOERNG-NSIKDUERSA-N 377.809 3.980 10 40 GHCB O=C(O)CN1C(=O)S/C(=C/c2ccc(N3CCCC3)c3ccccc23)C1=O 409128962 QBVQBXOPDQQMBX-GZTJUZNOSA-N 382.441 3.561 10 40 GHCB COc1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C)c(OC)c1 886481 DDMJGFNRBUIGCF-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1 36634377 VHXSJAYORWUFBA-UHFFFAOYSA-N 387.483 3.692 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COc3cccnc3[N+](=O)[O-])c2C)cc1 12532622 XPKRLYDBBZQXTB-UHFFFAOYSA-N 381.388 3.668 10 40 GHCB Cc1ccc(C(=O)NN2C(=O)/C(=C\c3ccc[nH]3)SC2=S)c(Cl)c1 409330647 LIPKMOPHAPWKTB-MDWZMJQESA-N 377.878 3.523 10 40 GHCB COc1ccc(-c2cc3ccc(O)c(CNCC(C)C)c3oc2=O)cc1OC 13722200 ADGRFBHWJWIXRI-UHFFFAOYSA-N 383.444 3.928 10 40 GHCB O=C1c2ccccc2C(=O)c2c1oc1c3c(ccc21)OCN(Cc1cccnc1)C3 19863954 PAXGYQWMAWLURI-UHFFFAOYSA-N 396.402 3.955 10 40 GHCB CC1=NN(c2nnn[nH]2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1 102570493 FSMXTXYEMXAQIB-YRNVUSSQSA-N 389.202 3.573 10 40 GHCB COc1ccccc1[C@H]1CC(c2c(C)cc3oc(=O)c(C)c(C)c3c2O)=NN1 12321721 TXYLTMWFXLNDPD-OAHLLOKOSA-N 378.428 3.871 10 40 GHCB O=C1/C(=C/c2ccc3c(c2)OCO3)N=C(c2ccccc2)N1c1nccs1 5399557 UGCHAOSUFPWNIC-GDNBJRDFSA-N 375.409 3.706 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)c1 408961875 PAUJMOWELSVHEC-RIYZIHGNSA-N 399.790 3.531 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OC(=O)c4ccc(C)cc4)cc3)C(=N)N2O1 41078398 IHXGFEDXDFOTOJ-ZXTIBJMCSA-N 387.395 3.665 10 40 GHCB Cc1ccc(NC(=O)CN2C(=O)S/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 409156158 SKQDCMPIOXOHHW-LDADJPATSA-N 395.484 3.736 10 40 GHCB CC(C)OCCS(=O)(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 95461774 RVCPMBZQCAQXQK-KRWDZBQOSA-N 377.506 3.710 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)cc1[N+](=O)[O-] 408971582 JLSJOMYTLXUUAV-LCYFTJDESA-N 391.305 3.952 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)S2)c(OC)c1 35043548 XSSDQRRMGVADIE-CXUHLZMHSA-N 385.401 3.694 10 40 GHCB Cc1ccc(O)c([C@H]2CC(c3ccccc3Cl)=NN2C(=O)CCC(=O)O)c1 80316238 WYKJGHKPMLYESS-QGZVFWFLSA-N 386.835 3.897 10 40 GHCB CN(C)c1ccc(CNC(=O)c2cnn3c(-c4ccccc4)ccnc23)cc1F 58971396 WFAJEEDQFKXBPG-UHFFFAOYSA-N 389.434 3.531 10 40 GHCB O=S(=O)(c1ccccc1)N1N=C(c2cccs2)C[C@@H]1c1ccccc1O 4248189 COXATANIZCLHHA-QGZVFWFLSA-N 384.482 3.994 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408769006 KWWPQPHFAISNAU-ATVHPVEESA-N 379.412 3.581 10 40 GHCB COc1cc([C@@H]2CC(=O)Nc3c(-c4ccccc4)nsc32)c(OC)c(O)c1O 35324563 SDEBBUFMKHWZRE-LBPRGKRZSA-N 398.440 3.713 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1=S 5372165 CJUNOPFJYVQKME-ADVGAGMGSA-N 378.519 3.597 10 40 GHCB C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc21 208222119 RKIQXARDWMMXQH-OXFWXOROSA-N 390.530 3.694 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccc(Cl)c(C)c3)CC2)cc1 59317901 XFTPLBXOQQJQLT-MRXNPFEDSA-N 388.895 3.773 10 40 GHCB Cc1ccccc1NC(=O)c1c(C)oc2ccc(O)c(CN3CCN(C)CC3)c12 19794017 AHMQDXJZWIDGGL-UHFFFAOYSA-N 393.487 3.755 10 40 GHCB Cc1noc2nc(C3CC3)cc(C(=O)NCc3ccc(N4CCCC4)cc3)c12 36617425 MEUDMYTVMXSLFP-UHFFFAOYSA-N 376.460 3.939 10 40 GHCB CC(C)c1ccccc1O[C@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217024286 XGXIRPGTNMESAA-LJQANCHMSA-N 395.547 3.646 10 40 GHCB Cc1cc(C(=O)OCC(=O)NCCCc2ccccc2)c(C)n1-c1ccccc1 2628973 LXFHYCFSNTWPNG-UHFFFAOYSA-N 390.483 4.000 10 40 GHCB O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc(Br)c1 1059636 OIMYEUGBINLUFN-ZROIWOOFSA-N 377.625 3.564 10 40 GHCB Cc1ccc(N2C=C(C(=O)N3CCCCC3)S(=O)(=O)c3ccccc32)cc1 44169777 QSSHGPIOLXSNGB-UHFFFAOYSA-N 382.485 3.774 10 40 GHCB Cc1ccc(NC(=O)COc2cccc(/C=C3/SC(=S)NC3=O)c2)cc1C 409384229 BKYWKWLAYQLGIU-LICLKQGHSA-N 398.509 3.810 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 15013133 SQFQNHXGCQXWSD-LVLBFHFTSA-N 398.459 3.834 10 40 GHCB O=C1/C(=C\c2ccc3c(c2)OCO3)Sc2scc(-c3ccc(O)c(O)c3)[n+]21 1636164 HCSZLOLPWYTKLS-UBKPWBPPSA-O 398.441 3.630 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc(N(C)C)cc3)S2)c(OC)c1 6570589 PFGRRHVYQRYQFU-WOJGMQOQSA-N 383.473 3.852 10 40 GHCB CC(C)CCNC(=O)CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 11641377 HAPBQUOUOZCFMA-GOSISDBHSA-N 387.549 3.984 10 40 GHCB Cc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3cccc(O)c3)C2=O)cc1 16739211 LTQJVARRUKZRGK-SXGWCWSVSA-N 384.482 3.541 10 40 GHCB Cc1nccn1-c1ccc([C@H](C)NCc2ccc(N3CCN(C)CC3)cc2)cc1 95459051 WWDJBKVZVTWRLB-IBGZPJMESA-N 389.547 3.783 10 40 GHCB CCOc1ccc([C@]2(O)CN(c3ccccc3OCC)C3=[N+]2CCCS3)cc1 27525102 SWNKNRABFJCICO-JOCHJYFZSA-N 399.536 3.655 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)sc2c1CC[C@@H](C)C2 5020619 UFWMPQNXIXEGJU-AGIUHOORSA-N 391.489 3.655 10 40 GHCB COc1c(-c2ccc(O)c(O)c2CC=C(C)C)oc2cc(O)cc(O)c2c1=O 14648316 MGFXFQXRHGAKQN-UHFFFAOYSA-N 384.384 3.800 10 40 GHCB biogenic,in-vitro CCOc1cc(C=C2C(=O)OC(C)(C)OC2=O)ccc1OCc1ccccc1 5953515 WBIOZJOKFIGAGK-UHFFFAOYSA-N 382.412 3.884 10 40 GHCB COc1ccc(/C=C2/C(=O)N(c3ccc(C)cc3C)C(=O)N=C2O)cc1OC 17056775 OCWNCUYFVLYVNV-XNTDXEJSSA-N 380.400 3.827 10 40 GHCB CC1CCN(c2ccc([C@@H](C)NC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1 218298761 RMODPWGEDDOMMG-VGSWGCGISA-N 380.488 3.940 10 40 GHCB CN(C)c1ccc([C@H](CNC(=O)Cc2cccc3ccccc23)N(C)C)cc1 5097799 QVKPANHKYGHYNJ-QHCPKHFHSA-N 375.516 3.867 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(OC)c(COC(C)C)c3)CC2)cc1 224429717 JSYZKMVHQIWWNI-UHFFFAOYSA-N 398.503 3.591 10 40 GHCB CCN(CC)c1ccc(/C=C2/SC(=S)N(C(=O)c3cccnc3)C2=O)cc1 3140362 AKNJCLQYMWTJKH-SFQUDFHCSA-N 397.525 3.969 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(O)c(OC)c1 12413419 UZWJGEQCFNOUAP-PDGQHHTCSA-N 393.439 3.977 10 40 GHCB CCN1CCN(Cc2c(O)ccc3c(C)c(-c4ccccc4)c(=O)oc23)CC1 20605104 AFVLEMHAUDMXRL-UHFFFAOYSA-N 378.472 3.612 10 40 GHCB biogenic COC(=O)c1[nH]c2ccccc2c1/C=C1\SC(=S)N(Cc2ccco2)C1=O 102731205 DBSIDOHDYRIESF-DHDCSXOGSA-N 398.465 3.949 10 40 GHCB CCCN1C(=O)N/C(=C/c2ccc(N(CC)CC)c(Br)c2)C1=O 409243202 QHAWSEHZKMSBFG-SDNWHVSQSA-N 380.286 3.598 10 40 GHCB S=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(Br)cn1 223949482 VNNWBCKIIYUDLO-UHFFFAOYSA-N 391.338 3.931 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)c3ccc(F)cc3)N3CCCC3)ccc21 13008223 KGDWGEDREIRPOF-QFIPXVFZSA-N 381.495 3.775 10 40 GHCB CCOC(=O)C=Cc1ccc(N(C)CCCN(C)C(=O)OC(C)(C)C)cc1 1857793064 RFSAVAVYWDFTFQ-UHFFFAOYSA-N 376.497 3.956 10 40 GHCB Oc1ccc(F)cc1C1=NN[C@@H](c2cc(Br)cc3c2OCOC3)C1 1504461 SNLYBWVQESYLOP-OAHLLOKOSA-N 393.212 3.599 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1cccc(OC)c1 408982728 FAVPDUVBBUYRFE-MOSHPQCFSA-N 377.440 3.876 10 40 GHCB CCCC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1cccc(OC)c1O 36617121 JHJIKOOAGQNAJP-FOWTUZBSSA-N 380.400 3.685 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c(O)c1 1306513 AEPIAYPXCREJCK-GZTJUZNOSA-N 397.406 3.884 10 40 GHCB CCc1ccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)NC2=S)cc1 409370308 ORDCYZVDYCLFKL-QGOAFFKASA-N 394.496 3.868 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1Cl 408806203 MDWNRVHTDQLRCX-NTEUORMPSA-N 384.819 3.632 10 40 GHCB CN(C)c1ccc(CNC(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)cc1 8170925 NUXGXWFHPURIBR-UHFFFAOYSA-N 397.482 3.930 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3Cl)C2=O)c(C)n1C 408777204 WQTMRNNEHURWMG-NTUHNPAUSA-N 392.242 3.615 10 40 GHCB COc1ccc(N2CCN([C@@H](CNC(=O)CC(C)(C)C)c3ccco3)CC2)cc1 56946204 SKQRIYBIESAZHQ-FQEVSTJZSA-N 399.535 3.704 10 40 GHCB CCOC(=O)/C=C/COc1ccccc1/C=C1\C(=O)N(c2ccccc2)N=C1C 11690119 OLLMTUJIUZEQHQ-LLQVVRDRSA-N 390.439 3.991 10 40 GHCB CC(C)C(=O)Nc1ccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 30990532 JYFJXDAKZNSEMB-UHFFFAOYSA-N 382.508 3.689 10 40 GHCB CC[C@@H]1CCCCN1C(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 5370746 PIWBHHSUEATUDO-MLJWKTOOSA-N 378.519 3.662 10 40 GHCB COc1cc(/C=C2\SC(Nc3ccccc3O)=NC2=O)cc(OC)c1OC 16770032 JINPBEDLKWVTRL-YBEGLDIGSA-N 386.429 3.500 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)NC1CCCC1 1181193 QCQIWQFQYHCJCG-RVDMUPIBSA-N 394.949 3.990 10 40 GHCB O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1c1ccc([N+](=O)[O-])cc1 5172455 KGAUDSHJZCUFLS-ZROIWOOFSA-N 387.398 3.909 10 40 GHCB Cc1cccc(NC2=NC(=O)/C(=C\c3ccc(N4CCOCC4)cc3)S2)c1 7163858 VIAZELKFVMOWFW-XMHGGMMESA-N 379.485 3.914 10 40 GHCB CCOc1ccc([C@]2(O)CN(c3cccc(C)c3C)C3=[N+]2CCCS3)cc1 17307549 MGACWSMWVPIEBW-JOCHJYFZSA-N 383.537 3.873 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)/C=C/c2ccc(C(=O)NC)cc2)cc1 32455293 FPMMAASLBZAYCE-LFIBNONCSA-N 379.504 3.564 10 40 GHCB CCC[C@H](NCc1c(C)cc2oc(=O)cc(-c3ccccc3)c2c1O)C(=O)O 4540335 MIAYPQQSTPAUKY-KRWDZBQOSA-N 381.428 3.817 10 40 GHCB CC(C)Oc1cccc(NC(=S)NCc2ccc(N3CCN(C)CC3)cc2)c1 225777105 XIQREAADFONMLM-UHFFFAOYSA-N 398.576 3.712 10 40 GHCB CCN(CC)Cc1c(O)ccc2c(=O)c(-c3ccc4c(c3)OCCO4)coc12 20358357 GQPQCJXHGVLEOY-UHFFFAOYSA-N 381.428 3.779 10 40 GHCB biogenic CCn1c(S[C@H](C)C(=O)Nc2ccc(N)cc2)nnc1-c1ccc(OC)cc1 930594 RVTYORAZGWTVPT-CYBMUJFWSA-N 397.504 3.675 10 40 GHCB COCCCN1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2F)C1=O 409250128 PSAWOXBKEFHPOJ-SFQUDFHCSA-N 378.469 3.889 10 40 GHCB Cc1ccc(NC(=O)CCCC[C@@H](C)NC[C@H](O)c2ccc(O)c(O)c2)cc1 1588622 JPIVNDIQZWPZMT-IERDGZPVSA-N 386.492 3.617 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2ccccc2nc1N1CCOCC1 103452241 CFXGYMDJVATGFD-LTGZKZEYSA-N 398.466 3.878 10 40 GHCB CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 53914734 DAXPWKHWTNCFGD-QGZVFWFLSA-N 386.879 3.556 10 40 GHCB CC(C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 921053 CYZMJEXONZUVTE-GZTJUZNOSA-N 384.819 3.794 10 40 GHCB Cc1ccc(C(C)C)c(OCC(=O)NCc2ccc(N3CCOCC3)cc2)c1 54285088 VCQWARQLQURGAS-UHFFFAOYSA-N 382.504 3.650 10 40 GHCB Cc1ccc(C)c(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)c1 408817593 WHRGQLUTAWTEAM-SFQUDFHCSA-N 378.428 3.757 10 40 GHCB Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2C)c1 5226292 UQWLIUSWLRFQPU-UHFFFAOYSA-N 379.416 3.664 10 40 GHCB CC1CCN(C2(NC(=O)c3cccc(Cl)c3)C(=O)c3ccccc3C2=O)CC1 226297586 GMRCRIPYVUYHJT-UHFFFAOYSA-N 396.874 3.577 10 40 GHCB COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1ccccc1Br 6348337 LZKQYAFQJKBQNA-ZROIWOOFSA-N 378.266 3.778 10 40 GHCB COC(=O)Cc1c(C)c2cc(Cl)c(O)c(CNC3CCCCC3)c2oc1=O 20650204 NONCHDNZRKZXNH-UHFFFAOYSA-N 393.867 3.598 10 40 GHCB CCN1C(=O)NC(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3Cl)o2)C1=O 665128 YCOCDCFOQOHGOO-XYOKQWHBSA-N 379.199 3.735 10 40 GHCB COCCn1c(C)cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=S)N=C2O)c1C 9013360 CHOSKRBPZYPNAV-LDADJPATSA-N 397.500 3.731 10 40 GHCB Cn1cc(/C=C2\SC(Nc3cccc(C(=O)O)c3)=NC2=O)c2ccccc21 16936384 CBRSIQLEHANWCQ-YVLHZVERSA-N 377.425 3.959 10 40 GHCB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/NCCc1c[nH]c2ccccc12 100149208 DRDCWIPPPVKSGW-CPNJWEJPSA-N 389.415 3.515 10 40 GHCB CN1C(=O)/C(=C2/C(=O)N(Cc3ccccc3F)c3ccccc32)SC1=S 4954194 YGJYCARLJXRCBT-NXVVXOECSA-N 384.457 3.574 10 40 GHCB Cc1ccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccc(F)cc32)cc1 48988577 MKDTZMQCIIPPRG-UHFFFAOYSA-N 386.448 3.523 10 40 GHCB Cn1cc(/C=C2\C(=O)N(Cc3ccc(F)cc3)C(=O)N=C2O)c2ccccc21 13773725 WELUUSWIZNGHRN-YVLHZVERSA-N 377.375 3.820 10 40 GHCB COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O 408801626 VAFBUBLDPFFYPX-FMIVXFBMSA-N 391.210 3.668 10 40 GHCB COc1ccc(OC)c(/C=C2/SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)c1 35042536 URZWHZJYHZLDFO-LICLKQGHSA-N 398.440 3.793 10 40 GHCB Cc1ccc(NC2=NC(=O)/C(=C\c3ccc(N4CCOCC4)cc3)S2)cc1 7164966 QCLCEHLWGGAHOF-XMHGGMMESA-N 379.485 3.914 10 40 GHCB CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C/c3ccc[nH]3)SC2=S)cc1 5552789 OYLLFBJBBLSJJW-PTNGSMBKSA-N 385.514 3.858 10 40 GHCB COc1ccc2ccc(O)c(CN3CCCc4cc(S(C)(=O)=O)ccc43)c2c1 59578956 NYVXUCXQJUUKRL-UHFFFAOYSA-N 397.496 3.910 10 40 GHCB CCc1cc2c(=O)c(-c3ccc4c(c3)OCO4)c(C)oc2c(CN(C)C)c1O 4746131 QLIAUBUSPMHXSA-UHFFFAOYSA-N 381.428 3.827 10 40 GHCB COc1ccc(N(C)C(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cn1 65591444 XYWHIZGOQOHRME-UHFFFAOYSA-N 393.443 3.546 10 40 GHCB CCN(CC)C(=O)CCCN1C(=O)/C(=C\c2ccc(OC)cc2)SC1=S 4795541 RWAQWSVRGLWVKX-DTQAZKPQSA-N 392.546 3.545 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)Nc3ccc(F)cc3)N3CCCC3)ccc21 35597201 JUJOLJUDGSFVJZ-OAQYLSRUSA-N 382.483 3.777 10 40 GHCB O=C(NC1(NC2CCCCC2)C(=O)c2ccccc2C1=O)c1cccc(Cl)c1 226298010 RPWMDGQWJBTBBW-UHFFFAOYSA-N 396.874 3.768 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@@H]1[C@H](c2ccccn2)N=C2S[C@H](C)CN21 260786587 YKFXZAXSVNLPJE-TYCQWZJGSA-N 394.544 3.816 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cccnc3)C2=O)cc1 17373747 KWCSSHMSDJDTKF-LFIBNONCSA-N 383.498 3.620 10 40 GHCB COc1ccc(/C=C/C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1OC 10113508 YYTTVHWFMOTRMU-UKTHLTGXSA-N 396.487 3.642 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2ccccc2cc1O 10906823 VVDILFGHNYVEGE-UHFFFAOYSA-N 376.456 3.654 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)cc1 27530348 VRXCBIGFTALWJV-MHWRWJLKSA-N 399.453 3.959 10 40 GHCB CCCC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NC[C@H]1CCCO1 112121851 ILGQKKGGYFRSLS-VVTMIQRTSA-N 384.505 3.842 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1ccccc1 408723082 QFXVKWRPPODTJB-XYOKQWHBSA-N 377.252 3.825 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N([C@H](C(=O)O)c2ccccc2)C1=O 13122585 LAVUPXNADVCYTE-QZFKAFNDSA-N 385.466 3.722 10 40 GHCB CCN(Cc1ccccc1)C(=O)CN1C(=O)/C(=C\c2ccccc2)SC1=S 5370675 OZXNYSAZVSKLII-QGOAFFKASA-N 396.537 3.937 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C/c2ccc(C(=O)O)cc2)SC1=S 5371698 TVDNAMQHNWSOEY-NVNXTCNLSA-N 399.449 3.797 10 40 GHCB CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)C=[N+]=[N-] 102370823 LCJFXSXAVBSADP-IBGZPJMESA-N 395.459 3.571 10 40 GHCB O=C1/C(=C/c2cc(Cl)c3c(c2)OCO3)SC(=S)N1c1cccnc1 8056805 WWBXNQHAALGVQK-MLPAPPSSSA-N 376.846 3.870 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])s2)C(O)=NC(=S)N1c1ccc(Cl)cc1 2283474 BTKYYBAYTYEVGS-YRNVUSSQSA-N 393.833 3.981 10 40 GHCB Cc1occc1C(=O)NN1C(=O)/C(=C/c2ccnc3ccccc23)SC1=S 13690142 JUNYQJPFRLCLAH-YBEGLDIGSA-N 395.465 3.682 10 40 GHCB COC(=O)c1cc(NC(=S)NCCN(C)c2ccccc2)ccc1Cl 225571378 SKIYSOGUUUYPQZ-UHFFFAOYSA-N 377.897 3.549 10 40 GHCB O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1C(=O)c1ccccc1F 5514703 OFZJEORNCTXVMQ-OVCLIPMQSA-N 387.413 3.596 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 4291564 ZAWFGMLFIUCERG-YBEGLDIGSA-N 399.453 3.959 10 40 GHCB Cc1ccc(-c2csc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)s1 2760880 PZRRONOPWBQAOE-UHFFFAOYSA-N 381.460 3.889 10 40 GHCB COc1ccc(N2CCN(CC(=O)Nc3cc(Cl)cc(Cl)c3)CC2)cc1 54225189 LMNFTFQSXLBXBI-UHFFFAOYSA-N 394.302 3.763 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc(C(=O)OC)cc1 12413425 UKMVUPTUCKHQLW-RGEXLXHISA-N 391.423 3.741 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl 408773397 IMUQNXAQHWSVFC-JYRVWZFOSA-N 391.210 3.668 10 40 GHCB COc1ccccc1-c1c(C)oc2c(CN3CCCOC3)c(O)ccc2c1=O 32501402 SJAWZPGSVGHGGO-UHFFFAOYSA-N 381.428 3.662 10 40 GHCB biogenic Cc1ccccc1C(=O)NC[C@@H](c1ccc2c(c1)CCCN2C)N1CCCC1 13008203 OOQIGYNPYJSIGA-QHCPKHFHSA-N 377.532 3.944 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 32770200 YCUKHLSMWPIJFA-UHFFFAOYSA-N 396.447 3.583 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1cccc(OC)c1OC 408788336 JPUPMDREYOIGBS-AQTBWJFISA-N 393.439 3.889 10 40 GHCB CCOc1cccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)C(=O)NC2=S)c1 4742285 XJHVOIDSGJJYIY-YBEGLDIGSA-N 386.860 3.570 10 40 GHCB Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)NC2=S)c1 409014345 OXWYFQCJOHEGDC-XDHOZWIPSA-N 394.496 3.922 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1Cl 409011731 IFKRWGYULXMEGE-PBJWJZLWSA-N 385.894 3.803 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)cc(OC)c1OC 17027421 LJWSQZLBPXRAKP-OQLLNIDSSA-N 396.399 3.528 10 40 GHCB CCOC(=O)c1c(-c2ccccc2)oc2ccc(O)c(CN3CCOCC3)c12 19593719 OGXGATRCXHSTEV-UHFFFAOYSA-N 381.428 3.814 10 40 GHCB biogenic COCCOc1nc(-c2ccc(Cl)c(Cl)c2)n(-c2ccc(N)cc2)n1 4400827 RYHKYWJDESUWAW-UHFFFAOYSA-N 379.247 3.849 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(c3ccccc3)C(C)=C2C(=O)OC)cc1OC 6964055 RXHRRCZTYMBVOW-AQTBWJFISA-N 393.439 3.971 10 40 GHCB CCOc1ccc(N2C(=O)N=C(O)/C(=C\c3ccc(N4CCCC4)o3)C2=O)cc1 59138517 RHAOKWSEXNRGMN-GHRIWEEISA-N 395.415 3.785 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc4c(c3)C[C@H](C)O4)C2=O)cc1Cl 408710740 IAEMMOLWTBKECA-RGZVIEDOSA-N 396.830 3.638 10 40 GHCB Cc1cc(/C=C2\SC(=S)NC2=O)c(C)n1-c1cc(C(=O)O)ccc1Cl 408996082 KVYNTKWQWRDVKT-AUWJEWJLSA-N 392.889 3.935 10 40 GHCB Cc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C=CSC4=NC3=O)cc2)cc1 4699121 RBRQICNMGDUWEM-SABKFZPKSA-N 389.436 3.991 10 40 GHCB Cc1ccccc1NC(=O)COc1ccc(/C=C2/SC(=S)NC2=O)cc1 14903963 DQJNJEBGRKNZHF-MHWRWJLKSA-N 384.482 3.501 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COC(=O)c3c(C)noc3C)c2C)cc1 3301690 ACENETIJNYTROC-UHFFFAOYSA-N 382.416 3.747 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCCCC4)o3)C2=O)cc1 408897397 JFBIFXNEIXBTKK-NBVRZTHBSA-N 393.443 3.635 10 40 GHCB Cc1cc(/C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 59250279 VUQHZLXUPQXQED-MKMNVTDBSA-N 376.821 3.770 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3Cl)C2=O)cc1Cl 408981877 COYUZFFIDWIFPE-JYRVWZFOSA-N 375.211 3.968 10 40 GHCB CCOC(=O)c1ccc(C)c(NC(=S)NCCCN(C)c2ccccc2)c1 225748452 ZRTIFNIKCGYLAN-UHFFFAOYSA-N 385.533 3.985 10 40 GHCB CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C/NCc1ccc2c(c1)OCO2 100111176 IFLAAGVWVFBVQM-SFQUDFHCSA-N 381.407 3.731 10 40 GHCB COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(O)c(OC)c1 408896244 WYEYMIKMZXQYPA-IIMQCXAKSA-N 393.439 3.835 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cccn2-c2ccccc2)C1=O 408847894 WOZHMPYQZLGSQB-XDJHFCHBSA-N 385.423 3.706 10 40 GHCB O=C(NCc1ccco1)[C@H]1Cc2ccccc2CN1Cc1cc(Cl)ccc1O 199407624 MEHJVLYBEOTZRM-HXUWFJFHSA-N 396.874 3.882 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)sc2c1CC[C@@H](C)C2 5717930 KNTLMNCJNFJXAY-FRRDWIJNSA-N 393.505 3.879 10 40 GHCB COc1ccc(N2CCN(C[C@@H](O)COc3ccccc3C(C)(C)C)CC2)cc1 20347319 KOPOEFLWKCWVCH-HXUWFJFHSA-N 398.547 3.555 10 40 GHCB COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(O)cc3)c2C)C1=O 409241114 RIZVDBSYGUEMRA-LDADJPATSA-N 386.473 3.873 10 40 GHCB C[C@H](NC(=O)c1ccccc1CN1CCCC1)c1ccc(N2CCOCC2)cc1 19662424 HPJYEPZKOJXTFY-IBGZPJMESA-N 393.531 3.610 10 40 GHCB CCN(CC)c1ccc(N/C=C2/C(=O)N=C(S)N(c3ccccc3)C2=O)cc1 103091459 LDBOBQIGKXLDJY-JXAWBTAJSA-N 394.500 3.688 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2ccc(-c3cccs3)cc2F)SC1=S 55038004 BNNLXOWWVUFLEC-QPEQYQDCSA-N 379.459 3.840 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccco2)SC1=S)Nc1cccc(F)c1 4745492 FJHWEBGMZTZFAP-GXDHUFHOSA-N 376.434 3.649 10 40 GHCB COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\c1ccc(C)cc1 408584795 VDLPTAOEEBTUBC-PDGQHHTCSA-N 378.384 3.780 10 40 GHCB Cc1ccc(-c2ccc(/C=C3/SC(=S)N(N4CCOCC4)C3=O)o2)cc1 5032683 WLXIBWCJKQBQHS-SFQUDFHCSA-N 386.498 3.703 10 40 GHCB CC1=CSC2=NC(=O)/C(=C\c3cccc(OC(=O)c4ccco4)c3)C(=N)N12 103563558 OVHWRHWRXIXNSQ-FZVWOUGZSA-N 379.397 3.666 10 40 GHCB O=C1N=C(Nc2ccccc2)S/C1=C\c1ccc(N2CCOCC2)c(F)c1 66255796 DQSOFPQBVFPNCE-AQTBWJFISA-N 383.448 3.745 10 40 GHCB COc1ccc(N2CCN(C(=O)c3c4c(nc5ccccc35)CCC4)CC2)cc1 5348729 GWYOVRVOECDFIF-UHFFFAOYSA-N 387.483 3.695 10 40 GHCB Cc1cc(C(=O)Nc2ccc(N(C)C)cn2)c(C)n1-c1ccc2c(c1)OCCO2 95385789 LFPIPDXYMALPAP-UHFFFAOYSA-N 392.459 3.579 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)cc1 35043237 FIRPCKHPKTUGOF-CXUHLZMHSA-N 396.424 3.562 10 40 GHCB CCCCOc1ccc(/C=C2\C(=O)NN(c3ccc(C)cc3)C2=O)cc1OC 2907205 VCJQBWHTNCXORX-QGOAFFKASA-N 380.444 3.644 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)cc3)C2=O)c1 4677808 NZXYSOGWABXJTQ-XSFVSMFZSA-N 389.455 3.570 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2cn(C)c3ccccc23)C1=O 409239601 HPKUCUUSVKDSKH-XNTDXEJSSA-N 393.830 3.807 10 40 GHCB Cc1cccc(NC2=NC(=O)/C(=C/c3ccc(OCC(=O)O)cc3)S2)c1C 210411350 OAHUVAWWVVADSG-YVLHZVERSA-N 382.441 3.849 10 40 GHCB CC(C)Sc1ccccc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217037122 JLGLEBKEHMNHIG-UHFFFAOYSA-N 383.561 3.869 10 40 GHCB O=c1c(-c2ccc3c(c2)OCCO3)coc2c(CN3CCCC3)c(O)ccc12 20461331 ABFOABXPWKRNOO-UHFFFAOYSA-N 379.412 3.533 10 40 GHCB biogenic O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(C(F)(F)F)c1 111504728 GGVNRDUEOMWHSO-ZROIWOOFSA-N 394.349 3.676 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nc4cc(C)c(C)cc4n3c2=O)c(O)c1 408721097 KMTKHNKVAHAMEP-JAIQZWGSSA-N 393.512 3.626 10 40 GHCB COc1ccc(CC(=O)c2ccc(O)c(CN3CCCCC3)c2O)cc1OC 23135303 PAYSATHYCYWPRN-UHFFFAOYSA-N 385.460 3.526 10 40 GHCB biogenic COc1ccc(CCN2C(=O)c3ccccc3N[C@H]2c2cccc(O)c2O)cc1 7884417 HIGJQTZHBVAZAK-JOCHJYFZSA-N 390.439 3.916 10 40 GHCB Cc1cc(C(=O)CN2C(=O)CC3(CCCC3)C2=O)c(C)n1-c1cccc(F)c1 9378913 SYONQNFZMMUWMW-UHFFFAOYSA-N 382.435 3.735 10 40 GHCB Cc1ccc(CN2C(=O)N/C(=C\c3ccc(N4CCCC4)cc3C)C2=O)cc1 27570988 FCOIBYRSWNVSFU-STZFKDTASA-N 375.472 3.997 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccccc3)C(C)=C2C(=O)OC)ccc1O 408896709 ZEUVYRSYWOTUMO-ATVHPVEESA-N 379.412 3.668 10 40 GHCB CC(=O)N(c1ccc(Br)c2c1C(=O)c1ccccc1C2=O)C(C)C 255188428 JUIKCVAOQYZPKP-UHFFFAOYSA-N 386.245 3.986 10 40 GHCB CCN(CC)c1ccc([N+](=O)[O-])cc1C=C1C(=O)OC2(CCCCC2)OC1=O 59489866 SIOMERPUOWREEK-UHFFFAOYSA-N 388.420 3.585 10 40 GHCB COc1ccc(N2COc3ccc4c5c(c(=O)oc4c3C2)CCC5)cc1OC 2123574 DMWXZAWLDVKIAG-UHFFFAOYSA-N 379.412 3.655 10 40 GHCB biogenic COc1cc(N2CCOCC2)c(OC)cc1CN1CCc2sccc2[C@@H]1C 19498349 APWFJKWCJUZFIR-HNNXBMFYSA-N 388.533 3.721 10 40 GHCB COc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCCN3C)N2CCCC2)cc1 16838185 DIVSZZDKIVGKHV-HSZRJFAPSA-N 393.531 3.645 10 40 GHCB Cc1cc(/C=C2\SC(NC(=O)c3ccccc3)=NC2=O)ccc1N1CCCC1 409140398 DYXJCCZCNVLHFW-RGEXLXHISA-N 391.496 3.996 10 40 GHCB Cc1ccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccccc32)cc1F 49003792 NNYVBNNXWCQLEK-UHFFFAOYSA-N 386.448 3.523 10 40 GHCB CCOc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O 408988422 HXOOBPQQLCLKMG-GDNBJRDFSA-N 384.819 3.714 10 40 GHCB COc1ccc(-c2ccc(/C=C3/SC(=S)N([C@@H](C)C(=O)O)C3=O)o2)cc1 13576379 ORTUCGOLAGIHNM-CNOAHFENSA-N 389.454 3.630 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1ccc(C(=O)N(C)C)cc1 5443086 MLQXMFRQWJWJIV-MOSHPQCFSA-N 376.460 3.724 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COc3ccc(C)nc3[N+](=O)[O-])c2C)cc1 8687623 UESVFZUIBJDQDX-UHFFFAOYSA-N 395.415 3.976 10 40 GHCB aggregator COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1ccccc1OC 408988826 RRSNPYNSAPZYGD-PDGQHHTCSA-N 379.412 3.581 10 40 GHCB CCc1nnc(NC(=O)CSc2ncc(-c3ccc(Cl)cc3)n2C)s1 7423387 POXAXAGLZDOZHA-UHFFFAOYSA-N 393.925 3.885 10 40 GHCB CCCOC(=O)c1ccc(Oc2coc3c(CN(C)C)c(O)ccc3c2=O)cc1 20394873 XZCFSVULVVMKIJ-UHFFFAOYSA-N 397.427 3.919 10 40 GHCB biogenic Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2n1 10907191 SAXQFZWKTSGBGU-UHFFFAOYSA-N 375.472 3.652 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3c(O)ccc4ccccc34)C2=O)cc1C 408782393 HSTSZAXAHVIUSW-XDHOZWIPSA-N 386.407 3.829 10 40 GHCB O=C(CCc1ccc2c(c1)OCCO2)NCc1ccc(N2CCCCC2)cc1 222642912 KWYIEAKITWMCEC-UHFFFAOYSA-N 380.488 3.697 10 40 GHCB O=C(O)c1cc(C(=O)O)cc(N2C(=O)/C(=C\c3cccs3)SC2=S)c1 5214773 OWZXZIAQTFKZCY-KPKJPENVSA-N 391.451 3.550 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 5372310 WKZYLLKMSVHMOK-APSNUPSMSA-N 399.449 3.828 10 40 GHCB Nc1nc(N)c(/N=N/c2ccc(S(N)(=O)=O)cc2)cc1/N=N\c1ccccc1 104090856 BBTGLPAPGOMLPD-XNMKTSCDSA-N 396.436 3.724 10 40 GHCB CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=S)N(CC)C2=O)c1C 409392959 UMGJERVLQMASDN-LDADJPATSA-N 395.528 3.612 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 32193767 XECZFUXVSQMNCW-QLENYVDCSA-N 378.428 3.839 10 40 GHCB O=C1c2ccccc2C(=O)c2c1c(C(=O)NCCc1ccccc1)c1ccccn21 95473394 QWTNQDHRQWLBMY-UHFFFAOYSA-N 394.430 3.687 10 40 GHCB Cn1cc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2O)c2ccccc21 1249219 RPAGJXAPAFJSHC-GXDHUFHOSA-N 379.416 3.989 10 40 GHCB Cc1ccc(N2C[C@@](O)(c3ccc(OC(F)F)cc3)[N+]3=C2SCCC3)cc1 4086724 DZVYFNRDYLXMOW-HXUWFJFHSA-N 391.463 3.767 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1O 15011630 NPJIBUAAPPAVSB-OQLLNIDSSA-N 388.426 3.715 10 40 GHCB CC(=O)c1cccc(N2C(=O)/C(=C3/C(=O)N(C)c4ccccc43)SC2=S)c1 2702154 WOXVNPXXXMTPDT-MSUUIHNZSA-N 394.477 3.642 10 40 GHCB Nc1c(N2CCCC2)cc(NCc2ccco2)c2c1C(=O)c1ccccc1C2=O 6663212 ORQGKNKWDJQVIW-UHFFFAOYSA-N 387.439 3.850 10 40 GHCB O=C1/C(=C\c2ccccc2[N+](=O)[O-])SC(=S)N1c1ccc2c(c1)OCO2 409339395 UWRBGPUDTPKCQG-VIZOYTHASA-N 386.410 3.729 10 40 GHCB Fc1ccc(NC(=S)NCc2ccc(N3CCOCC3)cc2)cc1Cl 53535805 JUZYBXVSEXLNPZ-UHFFFAOYSA-N 379.888 3.802 10 40 GHCB Cc1cc(/C=C2/NC(=O)NC2=O)c(C)n1-c1ccc(Br)c(Cl)c1 4663410 BFTVNJCFYZRDMP-MKMNVTDBSA-N 394.656 3.690 10 40 GHCB Oc1ccccc1CN(Cc1noc(Cc2ccccc2)n1)C[C@@H]1CCCO1 95957567 UTVXQZCUSOPLKM-IBGZPJMESA-N 379.460 3.547 10 40 GHCB Cc1ccccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 4258144 AVBVEAIKSYCLSR-UHFFFAOYSA-N 386.363 3.931 10 40 GHCB CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc3ccccc3n2)cc1 8341186 OILBZYAURIUXKM-LJQANCHMSA-N 390.487 3.517 10 40 GHCB O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(C(F)(F)F)cc1 1098505 XSMDNNPUUGUTQS-ZROIWOOFSA-N 394.349 3.676 10 40 GHCB CC1=NN(c2ccc(C(=O)OC(C)C)cc2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 5657165 DPVWHQVYVQUHIV-UNOMPAQXSA-N 393.399 3.966 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(c3ccc(F)cc3)C2=O)c2ccccc21 2605413 AVAPORBFZMBDCR-GZTJUZNOSA-N 377.375 3.671 10 40 GHCB COc1ccc(CN2C(=O)[C@H](Cc3ccc(OC)c(C)c3)SC2=S)cc1 8336406 YPFKRKVYTGIMFN-SFHVURJKSA-N 387.526 3.984 10 40 GHCB COCCn1c(C)cc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)c1C 12916667 LYYOTYZVQULGEJ-YBEGLDIGSA-N 376.503 3.746 10 40 GHCB Cc1ccc(NC(=S)NCCN(C)c2ccccc2)cc1N1CCCC1=O 225572232 RDULIINUWPMZJO-UHFFFAOYSA-N 382.533 3.545 10 40 GHCB CN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3Cl)o2)C(=O)NC1=S 5879177 ISFNSXIHYAKDED-YRNVUSSQSA-N 381.240 3.510 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(N2CCOCC2)cc1 12562612 IRXWVRVRJLCMJB-XSFVSMFZSA-N 381.863 3.983 10 40 GHCB C[C@H](NS(=O)(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1 4474204 RAWDRXZQNMAABG-AWEZNQCLSA-N 391.448 3.502 10 40 GHCB O=C1NC(=O)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/C=C/c1ccccc1 2287094 BINVLJAEFMLKBL-MBXCTOFRSA-N 386.329 3.928 10 40 GHCB COc1c(-c2ccc(O)c(O)c2)oc2cc(O)c(CC=C(C)C)c(O)c2c1=O 14648320 XREZFYPTHFWMDM-UHFFFAOYSA-N 384.384 3.800 10 40 GHCB biogenic CCCOc1ccc(/C=C2/C(=O)NN(c3cccc(Cl)c3)C2=O)cc1OC 5469433 NEIOYSRLFWZHIH-YBEGLDIGSA-N 386.835 3.599 10 40 GHCB Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1C 32526481 MERYSRNICCPHGM-UHFFFAOYSA-N 397.500 3.611 10 40 GHCB Cc1ccccc1NC(=O)C[C@H]1SC(=S)N(CCc2ccccc2)C1=O 9024654 MKHCAFLATJSBRX-QGZVFWFLSA-N 384.526 3.795 10 40 GHCB CS(=O)(=O)N1CCC(C(=O)Nc2ccc(/N=N/c3ccccc3)cc2)CC1 13789369 ITXWABZSNSEHSQ-QURGRASLSA-N 386.477 3.712 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\NCCc1ccccc1 100104854 WHNZCPQPKWGOJS-CYVLTUHYSA-N 378.432 3.814 10 40 GHCB O[C@@]1(c2cccs2)CN(c2ccc(Br)cc2)C2=[N+]1CCCS2 13635433 XFVLQWKDKBTJAP-MRXNPFEDSA-N 396.355 3.681 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(OCC(C)C)cc3)C2=O)cc1 408981310 APNOOLJFGIARHW-MOSHPQCFSA-N 392.455 3.950 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(c3ccccc3F)C2=O)c2ccccc21 2371941 HTSQRJIYJFZJLK-RVDMUPIBSA-N 377.375 3.671 10 40 GHCB Cc1cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c(C)n1-c1cccc(Cl)c1 2416850 HVRBTWWJGBRCAZ-IEERDHFISA-N 383.864 3.997 10 40 GHCB CC(C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O 408801749 BKBLCOONAZNUOC-SDNWHVSQSA-N 384.819 3.794 10 40 GHCB COCCn1c(-c2ccccc2)cnc1SCC(=O)N1CCc2ccccc21 44085837 GMENNUFYGOASKT-UHFFFAOYSA-N 393.512 3.878 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O 209584859 PZIOMVPYZSVPFI-RVDMUPIBSA-N 384.819 3.714 10 40 GHCB O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1c1ccc2c(c1)OCO2 1417238 KHEBCEFKKNGQHO-OMCISZLKSA-N 385.422 3.550 10 40 GHCB COc1ccc(NC(=S)NCCN(C)c2ccc(C)cc2)c2cccnc12 225797107 VPQLKPJNMMDJAD-UHFFFAOYSA-N 380.517 3.975 10 40 GHCB O=C1N=C(NC2CCCC2)S/C1=C\c1cc2c(cc1Br)OCO2 12563839 KTNBRDZEPNOLBN-NSIKDUERSA-N 395.278 3.680 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C\c3sccc3C)SC2=S)cc1 1412543 NAYYMERHHDWOFA-NTEUORMPSA-N 390.511 3.611 10 40 GHCB COc1ccc(OC)c(N/C(C)=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c1 112124338 RSJLHAZDGTWURE-UNOMPAQXSA-N 396.403 3.721 10 40 GHCB CCN1CCC2(CC1)Oc1ccccc1[C@H]1CC(c3ccc(O)c(OC)c3)=NN12 5093403 CYILUWOXRHDJTG-LJQANCHMSA-N 393.487 3.756 10 40 GHCB COc1ccc(N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 6320092 JYKGZFJXSXDPIK-UHFFFAOYSA-N 381.354 3.949 10 40 GHCB Cc1cc2oc(=O)cc(-c3ccccc3)c2c(O)c1CN[C@H](C(=O)O)C(C)C 4540331 ZKHLJRPPHRLYGR-FQEVSTJZSA-N 381.428 3.673 10 40 GHCB Cc1c(C)c2ccc(O)c(CNC3CCN(Cc4ccccc4)CC3)c2oc1=O 6759585 OVACHKRITAPERW-UHFFFAOYSA-N 392.499 3.870 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(Sc3ccccc3)o2)SC1=S 409330658 LPIZEDDYBMEMFB-XYOKQWHBSA-N 377.468 3.717 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)cc3C)C2=O)cc1 408959852 GXUDIJYQKFULAC-XSFVSMFZSA-N 389.455 3.570 10 40 GHCB Cc1ccc(S[C@@H](C)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 216930769 NKVFIQZQLOGFQT-SFHVURJKSA-N 383.561 3.544 10 40 GHCB COc1cccc(CN2CC3(CCOCC3)[C@H]2c2cnn(C(C)(C)C)c2)c1O 585093514 VIAZWJBUPPBDGE-HXUWFJFHSA-N 385.508 3.706 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NCc1cccnc1 103918105 QJCFPAIUKQMIPH-RGEXLXHISA-N 379.420 3.556 10 40 GHCB Cc1cc2nc3s/c(=C\C=C\c4ccc(N(C)C)cc4)c(=O)n3c2cc1C 409394106 VTGUPPIRDOKLBZ-NIGQNHAHSA-N 375.497 3.805 10 40 GHCB COc1ccc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2O)cc1OC 2263130 MJTKRVDUVQKIIJ-FMIVXFBMSA-N 386.404 3.515 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccc(O)cc1 1262383 UIGOTKLRKODFTP-PTNGSMBKSA-N 388.470 3.605 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3C)C2=O)o1 204986714 JOKLQWMNRYVCJS-FOWTUZBSSA-N 397.500 3.574 10 40 GHCB CCOc1ccc([C@]2(O)CN(c3cc(C)ccc3C)C3=[N+]2CCCS3)cc1 17307533 DPJSBNATTJNQGI-JOCHJYFZSA-N 383.537 3.873 10 40 GHCB CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Br)cc2)N(C)C)cc1 5097768 SWWKHGVQLBBHBT-GOSISDBHSA-N 390.325 3.548 10 40 GHCB CC(=O)N(c1nc(/C=C2/SC(=S)N(C)C2=O)cs1)c1ccccc1F 25059556 FNGBPYYIARPOEP-NTUHNPAUSA-N 393.490 3.798 10 40 GHCB CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Nc2ccc3c(c2)OCO3)cc1 10262372 FUKCEFMTYOMDQZ-IBGZPJMESA-N 397.475 3.694 10 40 GHCB O=C1/C(=C\c2nc3ccccc3[nH]2)C(O)=NC(=S)N1c1ccccc1Cl 6813989 VYGNMMQMSRFKFX-KTKRTIGZSA-N 382.832 3.888 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)[nH]n3)CC2)cc1 15680558 CMCCYUWMRKCLGF-UHFFFAOYSA-N 396.878 3.701 10 40 GHCB CC1CCN(C2=NN3C(=N)/C(=C/c4ccc(Cl)cc4)C(=O)N=C3S2)CC1 41084647 AKDKWGRAWFGPSX-UKMRQWHXSA-N 387.896 3.649 10 40 GHCB CC1CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1 98003909 QOROVKPPKHFKKN-VBKFSLOCSA-N 392.521 3.676 10 40 GHCB CC1=NN(c2cccc(Br)c2)C(=O)/C1=C1/C(=O)Nc2ccccc21 16694199 NERNNQLOHSDVPS-FOCLMDBBSA-N 382.217 3.578 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(OC)c1 4675938 UWKAYLGXJJYHQG-CPNJWEJPSA-N 379.460 3.634 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)c(OC)c1 5235966 DQHPSIVZVCMMDW-YBEGLDIGSA-N 397.481 3.986 10 40 GHCB CC/C(=C(/CC)c1ccc(O)c(CN(CCO)CCO)c1)c1ccc(O)cc1 1594245 RFVWDSLZDOERFY-QURGRASLSA-N 385.504 3.615 10 40 GHCB COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C\N(C)C)cc1 8683184 CHDVKJGNCQECBB-QINSGFPZSA-N 378.457 3.501 10 40 GHCB COc1ccc(Br)c(C(=O)NCc2ccc(N3CCCC3)cc2)c1 32914725 DCIBUJXYIOBMAH-UHFFFAOYSA-N 389.293 3.988 10 40 GHCB CCc1ccccc1OCCn1cccc1/C=C1\C(=N)N2OC(C)=CC2=NC1=O 41082709 JOGCNQFIARQFRJ-ZBLGNAECSA-N 390.443 3.580 10 40 GHCB Cc1ccc2nsnc2c1S(=O)(=O)Nc1ccccc1Br 5260188 GOMFTRWINCBSDW-UHFFFAOYSA-N 384.280 3.563 10 40 GHCB CN(C)c1ccc(CNC(=O)CCC(=O)c2ccc(Br)cc2)cc1 18215100 MPRUFIZWIOTTGV-UHFFFAOYSA-N 389.293 3.794 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3ccc(Cl)cc3)N=C2C)c([N+](=O)[O-])c1 100316591 DLLGCTNXMGUYPC-XNTDXEJSSA-N 386.795 3.975 10 40 GHCB COCCn1c(C)cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)c1C 59087187 AUCAKQVGNQMITQ-LDADJPATSA-N 381.432 3.566 10 40 GHCB Cc1ccc(C(=O)CN2C(=O)S/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 17185974 XSFQJXIPJRXINO-XDHOZWIPSA-N 380.469 3.980 10 40 GHCB Cc1cccc(-n2cccc2/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 100992418 VBEJPQIOOSEMCS-RGEXLXHISA-N 385.423 3.761 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(F)c2)C1=O 409089433 NPXBYAAVBQVGGX-OQLLNIDSSA-N 388.782 3.544 10 40 GHCB CCc1nnc(S/C(=C\c2ccc(N(C)C)c(Br)c2)C(=O)O)o1 213416776 MNORZWVZZOGFEJ-WQLSENKSSA-N 398.282 3.678 10 40 GHCB CCN1CCN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)CC1 20395325 JTLYLIWWPNIZKT-UHFFFAOYSA-N 378.472 3.612 10 40 GHCB biogenic O=C1/C(=C2\C(O)=Nc3ccc([N+](=O)[O-])cc32)SC(=S)N1Cc1ccco1 17137844 LFTPPMYCFCQNKD-OUKQBFOZSA-N 387.398 3.561 10 40 GHCB Cc1c(Cl)cccc1N1C[C@@](O)(c2ccc(F)cc2)[N+]2=C1SCCC2 27525627 RZQDDDNRXWSNNX-LJQANCHMSA-N 377.892 3.958 10 40 GHCB COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccc2c(c1)OCO2 4672701 FUSQRDHCDLAFKV-JVVDOCDTSA-N 391.423 3.849 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/Nc1cc(Cl)ccc1Cl 5648021 FHIIIZXUVKNCHI-FMIVXFBMSA-N 376.199 3.572 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)c(C)cc1OC 409081143 GLRJLOPEPGTGIJ-AYCSXLNKSA-N 393.530 3.783 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)cc1 408814618 ZLWNOBLDIGLBAX-XMHGGMMESA-N 394.427 3.541 10 40 GHCB O=C(COc1ccc(Cl)cc1Cl)NCc1ccc(N2CCOCC2)cc1 13648235 JOEYFHJJDLDSDN-UHFFFAOYSA-N 395.286 3.525 10 40 GHCB COc1ccc([C@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)cc1OC 4942494 KUTOVKLALJKPHB-QGZVFWFLSA-N 392.411 3.994 10 40 GHCB CCN1C(=O)C(=Cc2ccc(-c3cccc(Cl)c3)o2)C(=O)N(CC)C1=S 5795146 PTFALSQCSCXYPT-UHFFFAOYSA-N 388.876 3.979 10 40 GHCB CCOc1cccc(/C=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)c1 206883097 OZJLBQDTOJJZMU-VBKFSLOCSA-N 384.482 3.632 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)c1 408866819 JFXINJBPCSEOLF-CXUHLZMHSA-N 384.819 3.632 10 40 GHCB O=C1/C(=C\c2cc([N+](=O)[O-])ccc2O)C(C(F)(F)F)=NN1c1ccccc1 408973771 UYMXFTMUQGRYOU-LCYFTJDESA-N 377.278 3.649 10 40 GHCB CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)OC4(CCCC4)OC3=O)o2)cc1 857528 TZDKIENAAMGZKQ-UHFFFAOYSA-N 396.395 3.877 10 40 GHCB CCN(CC)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCc2ccccc2)cc1 847236 SLJQAIUPQUBJDR-NRFANRHFSA-N 393.487 3.904 10 40 GHCB Cn1cc(/C=C2/C(=O)NC(=S)N(c3cccc(Cl)c3)C2=O)c2ccccc21 4817141 CTMOKYHOAXVVHA-SXGWCWSVSA-N 395.871 3.663 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@@H]1[C@H](c2ccccn2)N=C2S[C@@H](C)CN21 222597133 YKFXZAXSVNLPJE-ORYQWCPZSA-N 394.544 3.816 10 40 GHCB CCN1C(=O)N=C(O)/C(=C\c2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)C1=O 5947718 RFZVVMIAKYQPFW-MHWRWJLKSA-N 396.403 3.633 10 40 GHCB COc1cccc(CN2CCC[C@H](c3cc(=O)[nH]c(-c4cccs4)n3)C2)c1O 19567205 XAUGIVLMPWJZDD-AWEZNQCLSA-N 397.500 3.592 10 40 GHCB O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C/c1ccccc1O 1471537 XMDVTBUQVKQDLO-LDADJPATSA-N 399.903 3.838 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)Cn3cnc4sccc4c3=O)c2C)cc1 7226245 FDXHNITYYZBLNN-UHFFFAOYSA-N 393.468 3.757 10 40 GHCB COCCN1C(=O)/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)SC1=S 2834791 NZMSAUPQTSJXMG-GDNBJRDFSA-N 390.442 3.702 10 40 GHCB COc1ccc(OCc2noc(CN3CCCc4cc(OC)ccc43)n2)cc1 12645258 XXZBCXJMXBERKP-UHFFFAOYSA-N 381.432 3.619 10 40 GHCB COc1cccc(/C=C2\C(=O)N(c3ccc(C(=O)O)cc3)N=C2C(F)(F)F)c1 5880418 JMUDYJWYOKGUFO-GDNBJRDFSA-N 390.317 3.742 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)cc1 1870918 DRIZUSKVXOXVBK-NTCAYCPXSA-N 378.519 3.599 10 40 GHCB C[C@@H]1Cc2cc(/C=C3/SC(=S)N(CCCCCC(=O)O)C3=O)ccc2O1 2342312 FLHPZLAWEWJMOP-PILJQMSFSA-N 391.514 3.856 10 40 GHCB CCOc1ccc(C(=O)Nc2cc(OC)ccc2N2CCOCC2)cc1Cl 7496823 NJNZSSGIWFVHRP-UHFFFAOYSA-N 390.867 3.836 10 40 GHCB CC1=C(C(=O)O[C@H]2CCC[C@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 5002898 AMOMSDKTONIICD-SOVGHPHASA-N 387.549 3.667 10 40 GHCB O=C(O)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1F)N2 4623745 RLKOYHOLVHMMLV-VTJXTGGHSA-N 398.409 3.996 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3cc(C)ccc3C)C2=O)c1C 409242253 WJDPASIBVYAYHM-GZTJUZNOSA-N 381.501 3.573 10 40 GHCB N=C1/C(=C/c2cccn2-c2cc([N+](=O)[O-])ccc2Cl)C(=O)N=C2SC=CN12 32964305 NLBARPDZYKZFOV-RFCLUPQTSA-N 399.819 3.816 10 40 GHCB COC(=O)COc1ccccc1/C=C1/SC(=S)N(c2ccccc2)C1=O 1101300 RBPBGBAXAMWTCV-LFIBNONCSA-N 385.466 3.644 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 1774378 YQMHOHLLGMYZPS-ZROIWOOFSA-N 386.410 3.699 10 40 GHCB CC[C@@H](C)[C@@H](NCc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12)C(=O)O 20111206 IJAAWTXJFCQYFT-BFUOFWGJSA-N 397.427 3.880 10 40 GHCB biogenic CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1 2277165 XCCDPJCSSHMRJE-QGOAFFKASA-N 397.475 3.503 10 40 GHCB CCc1nnc(N/C=C2/C(=O)N(c3ccc(Br)cc3)N=C2C)s1 101039565 XTSWRTKGGTWXGS-XYOKQWHBSA-N 392.282 3.582 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c1 408940241 UQKCDMKDSRWRHZ-AQTBWJFISA-N 378.428 3.759 10 40 GHCB CC1CCN(c2ccc([C@H](C)NC(=O)[C@H]3COc4ccccc4O3)cc2)CC1 218298919 RMODPWGEDDOMMG-HTAPYJJXSA-N 380.488 3.940 10 40 GHCB O=C(O)COc1ccccc1/C=C1\SC(=S)N(c2cccc(F)c2)C1=O 210432294 COSLWEWTJGNJDC-NVNXTCNLSA-N 389.429 3.695 10 40 GHCB Cc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(C)n1-c1ccccc1F 35074562 VLIPYUKJALGCDJ-AQTBWJFISA-N 375.403 3.695 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)Nn2c(C)nc3sccc3c2=O)cc1 57635522 ZHFKSWMBRNYPEY-UHFFFAOYSA-N 378.457 3.558 10 40 GHCB NC(=O)CSc1ncc(-c2ccc(Br)cc2)n1Cc1ccco1 44085410 NONRSQHHRBIZIQ-UHFFFAOYSA-N 392.278 3.531 10 40 GHCB Cc1occc1C(=O)NN1C(=O)/C(=C/c2ccc3ncccc3c2)SC1=S 102735745 GXIJDTHRAYOJNT-YBEGLDIGSA-N 395.465 3.682 10 40 GHCB CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OC(C)C)cc3)C2=O)cc1 408801076 SLSRDDJYUGGFGO-CPNJWEJPSA-N 394.427 3.539 10 40 GHCB COCCCN1C(=O)S/C(=C\c2ccc(-c3cccc(C(=O)O)c3)o2)C1=O 409223053 YQKBVIAFPFGJBS-WJDWOHSUSA-N 387.413 3.718 10 40 GHCB Cc1ccc(COc2ccccc2/C=C2\SC(N3CCOCC3)=NC2=O)cc1 4681249 OJLXGKRLBOFELX-ZHZULCJRSA-N 394.496 3.877 10 40 GHCB Cc1ccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)NC(=S)N3C)c2C)nc1 222748403 USHSVLMXKDTNDK-UXHICEINSA-N 377.517 3.795 10 40 GHCB COc1cc([N+](=O)[O-])ccc1N/C=C1/C(=O)N(c2ccc(C)c(C)c2)N=C1C 96793232 SVYUZGYWSVPZNO-GZTJUZNOSA-N 380.404 3.939 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C/c3ccccc3F)SC2=S)ccc1O 5374140 IITGTYKZOBZCNA-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB Cc1ccc2c(c1)NC(=O)C[C@@H]1CCN(Cc3ccc(O)c(O)c3)C[C@@H]1CCO2 1534646737 RXALYGGOASSOBP-ROUUACIJSA-N 396.487 3.656 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)SC1=S 973301 VCALAHVGQVBMSG-NTUHNPAUSA-N 379.846 3.886 10 40 GHCB COc1cc(/C=C2\SC(N3CCCC[C@@H]3C)=NC2=O)cc(OC)c1OC 59484572 ZVWJLAPBFIATOJ-IEMQHYRPSA-N 376.478 3.557 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)N(C)c3ccccc3)sc2n1 10645097 MKDUEDVNWONKFX-ZDUSSCGKSA-N 383.473 3.704 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)c2cc3ccccc3cc2OC)c1 20528706 ZFVMGYHUGPJGGU-UHFFFAOYSA-N 392.455 3.946 10 40 GHCB COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C[C@H]2C)C(C)C)cc1F 58311166 WWNYQSGOOZSAJT-OAHLLOKOSA-N 399.466 3.813 10 40 GHCB Cc1c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)oc2ccc(F)cc12 10907302 VIHIQMUNBJHETO-UHFFFAOYSA-N 382.435 3.989 10 40 GHCB CCN1C(=O)C(=Cc2ccc3c(c2)C(C)=CC(C)(C)N3C)C(=O)N(CC)C1=S 113812503 LSHADQWVCROWDH-UHFFFAOYSA-N 397.544 3.697 10 40 GHCB COc1cc(N2CCOCC2)ccc1/C=C1\SC(=O)N(c2ccccc2)C1=O 409239535 NSYWIQJJJGPAOY-UYRXBGFRSA-N 396.468 3.773 10 40 GHCB CC(=O)Oc1ccc(/C=C2/C(=N)N3N=C(C4CCCCC4)SC3=NC2=O)cc1 30930096 SICXNELDMMDGEJ-XGMUFTHNSA-N 396.472 3.811 10 40 GHCB COc1ccc2ccc(O)c(CN3CCCc4ccc(S(C)(=O)=O)cc43)c2c1 83970359 OZNLLWCLUJKRHS-UHFFFAOYSA-N 397.496 3.910 10 40 GHCB CC[C@H](Oc1ccc(C)c(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 20480977 GZDCYPYPXWDQKG-QFIPXVFZSA-N 382.504 3.614 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc4c(c3)C[C@@H](C)O4)C2=O)cc1Cl 408710739 IAEMMOLWTBKECA-GFQQVXNGSA-N 396.830 3.638 10 40 GHCB CC1=CC(C)(C)N(C(C)C)c2ccc(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc21 223481890 QIZYSPVWWVILJX-UHFFFAOYSA-N 381.476 3.531 10 40 GHCB COc1cc(/C=C2\C(=N)N3N=C(C4CCCCC4)SC3=NC2=O)ccc1O 4551111 CUTKGWUSPVMPFH-ILUQACKLSA-N 384.461 3.600 10 40 GHCB O=C1NC(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1cccs1 409239928 ONBMCBFKIARFOR-XYOKQWHBSA-N 382.388 3.598 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)cc1 5568177 BAPAVFIAXYOZLS-QPBLZFLPSA-N 395.410 3.714 10 40 GHCB COc1ccc(N2CCN(C(=O)CCCOc3ccc(Cl)cc3)CC2)cc1 7505010 KEQMBZSVLQUCIV-UHFFFAOYSA-N 388.895 3.856 10 40 GHCB COc1ccccc1/C=C1\SC(N2CCN(c3ccc(F)cc3)CC2)=NC1=O 9189268 PEMOFXNRDKQEFJ-RGEXLXHISA-N 397.475 3.627 10 40 GHCB CCN1C(=O)/C(=C/c2cc(Cl)c(OCC(=O)O)c(Cl)c2)SC1=S 409376418 XYUZEULYGXWKEY-YHYXMXQVSA-N 392.285 3.678 10 40 GHCB COc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3)N=C2C)ccc1O 15938703 DCINAMQOZUEUCE-DHDCSXOGSA-N 387.233 3.969 10 40 GHCB Cc1cc(C)cc(CSCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 216928742 SBTZKEZFBNYOPC-UHFFFAOYSA-N 397.588 3.605 10 40 GHCB CSc1cccc(-n2c(C)cc(C(=O)CSc3nc(N)cc(N)n3)c2C)c1 12523071 GRARVARYTHMMDQ-UHFFFAOYSA-N 399.545 3.745 10 40 GHCB CN(C)c1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1Br 58865751 XHWCXZFEFGCLOM-UHFFFAOYSA-N 394.265 3.659 10 40 GHCB CN(C)c1ccc([C@@H](CNC(=O)Cc2cccc3ccccc23)N(C)C)cc1 5097798 QVKPANHKYGHYNJ-HSZRJFAPSA-N 375.516 3.867 10 40 GHCB CCOC(=O)c1c(C)oc2cc(Br)c3oc(=O)c(C(C)=O)cc3c12 11865261 JFHIATSWUGCICN-UHFFFAOYSA-N 393.189 3.989 10 40 GHCB COC(=O)c1ccc(C)c(-n2c(C)cc(/C=C3\SC(=S)NC3=O)c2C)c1 408996177 LGMOPDMEEKNRRL-SXGWCWSVSA-N 386.498 3.678 10 40 GHCB O=[N+]([O-])c1cccc2nc3ccccc3c(NCCCn3ccnc3[N+](=O)[O-])c12 5647390 PFUFOXKNRLGMSL-UHFFFAOYSA-N 392.375 3.903 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)sc2c1CC[C@@H](C)C2 5717922 KNTLMNCJNFJXAY-UPJWGTAASA-N 393.505 3.879 10 40 GHCB Cc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCCC2)cc1 13007803 XLRVLIUJGFVNST-HSZRJFAPSA-N 377.532 3.944 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(Cc3ccccc3)C(C)=C2C(=O)OC)ccc1O 59435673 AHFDDLOIRBXMBD-PDGQHHTCSA-N 393.439 3.664 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\SC(NC(=O)c2ccccc2)=NC1=O 409126035 GQSQJYNKJBAGSC-RGEXLXHISA-N 391.496 3.996 10 40 GHCB CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(F)cc3)c2C)C(C(=O)OC)=C1C 3641198 IIBMFLLDFAWQNB-UNOMPAQXSA-N 382.435 3.926 10 40 GHCB CCn1cc(/C=C2\C(=O)NC(=O)N([C@@H](C)c3ccccc3)C2=O)c2ccccc21 5478040 SDOHFGKMYDTTDO-SJPXOZHESA-N 387.439 3.884 10 40 GHCB CCc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 409345588 JLZREMRMHLMHED-ATVHPVEESA-N 398.509 3.804 10 40 GHCB CCOc1ccccc1N/C(C)=C1\C(=O)N(c2ccccc2)N=C1CC(=O)OC 112123331 PQICHWCUKMIYDY-QNGOZBTKSA-N 393.443 3.737 10 40 GHCB CCn1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)C(F)(F)F)cn1 35678228 PKPYQGFFUQAILB-MDWZMJQESA-N 384.308 3.887 10 40 GHCB CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccn2)c1C 222774092 XCUGYBADPQHZHG-UXHICEINSA-N 377.517 3.877 10 40 GHCB O=C(O)/C(=C\c1ccc(N2CCOCC2)cc1)Sc1nc2ccccc2o1 7365565 UHMZVBOLMURHOV-QGOAFFKASA-N 382.441 3.882 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3ccccc3F)C2=O)cc1 408963768 PDNXKLDTKVPSNB-GHRIWEEISA-N 389.386 3.591 10 40 GHCB Cc1ccc(NC(=O)COc2ccc(/C=C3/SC(=S)NC3=O)cc2)cc1C 211965733 HKCWRGMYPGEWCZ-LICLKQGHSA-N 398.509 3.810 10 40 GHCB CCc1ccc(/C=C2\SC(=S)N(NC(=O)Cc3ccccc3)C2=O)cc1 5552022 SFKSDMCYTYPUHG-ATVHPVEESA-N 382.510 3.724 10 40 GHCB CCCCOC(=O)CN1C(=O)/C(=C/c2ccccc2OCC)SC1=S 1810707 ODMUVNFADYSXHQ-PTNGSMBKSA-N 379.503 3.630 10 40 GHCB Cc1cc(OCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C(C)C 12638243 WUDLZHMFVYAHTC-UHFFFAOYSA-N 396.531 3.992 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1 408914544 YJQGZSJTJVWHIR-VBEHJTROSA-N 382.391 3.669 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)c1 408868541 OUZLTGOLYWNUNI-CXUHLZMHSA-N 384.819 3.632 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)Nc1ccccc1O 4536613 JPKJEDAPALOKGZ-RVDMUPIBSA-N 388.470 3.605 10 40 GHCB COC(=O)c1cc(NC(=S)NCCCN(C)c2ccccc2)ccc1Cl 225748259 HJGBODPUNQNBCG-UHFFFAOYSA-N 391.924 3.940 10 40 GHCB Cc1cc(/C=c2\sc3nc4ccccc4n3c2=O)ccc1N1CCCCC1 145385590 ITNAWYIZMHFJGL-ZHZULCJRSA-N 375.497 3.756 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1ccccc1O 1232283 BQASERKPKJGDHW-FOWTUZBSSA-N 384.482 3.622 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccc(C)cc3)C(C)=C2C(=O)OC)ccc1O 408893884 OBJRAYMMPRKLCA-PDGQHHTCSA-N 393.439 3.977 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1ccc(C(=O)N(C)C)cc1 5575875 DDBCDTKBGRIJTH-PDGQHHTCSA-N 382.851 3.760 10 40 GHCB CC(=O)N/C=C1\C(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)N=C1C 408535662 ZLLPLJDTJZGKIW-BKUYFWCQSA-N 377.488 3.897 10 40 GHCB COc1ccc(NC(=O)c2c(Nc3ccccc3)nn3c(O)cc(C)nc23)cc1 100247808 DRFNYMCVOIGSTR-UHFFFAOYSA-N 389.415 3.748 10 40 GHCB O=C1N/C(=C\c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccccc1F 686535 TZWGBWKXSAARSE-PDGQHHTCSA-N 383.398 3.658 10 40 GHCB CCCN(CCC)C(=O)CCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 54360749 TWOKPSUXVFEDDY-SSZFMOIBSA-N 392.546 3.632 10 40 GHCB Cc1cc(C(=O)CSc2nncn2C)c(C)n1-c1ccc(OC(F)F)cc1 3283111 FPVGWSKAKMLWDR-UHFFFAOYSA-N 392.431 3.799 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)sc2c1CCCCC2 2486397 OKQSNZTXVSFHIS-QWHCGFSZSA-N 391.489 3.799 10 40 GHCB CN(Cc1cc(Br)ccc1O)C(=O)Oc1cccc([N+](=O)[O-])c1 3851237 ZVZJXYQBEPWLHE-UHFFFAOYSA-N 381.182 3.694 10 40 GHCB biogenic CN(C)c1ccc(CNC(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 40023976 RMJJFJSMOCXFCH-UHFFFAOYSA-N 379.460 3.963 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)N3CCC(c4nc(C)no4)CC3)c2C)cc1 84080256 TUMPBRCRFVVWEC-UHFFFAOYSA-N 394.475 3.814 10 40 GHCB COC(=O)c1ccc(F)c(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)c1 63182950 BKQAQDBJLPNCDR-UHFFFAOYSA-N 392.433 3.537 10 40 GHCB CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)cc1 408804276 WYJKGWVOXWDELK-QGOAFFKASA-N 394.427 3.539 10 40 GHCB COc1ccc(CN2C(=O)/C(=C/c3ccc(OC)c(O)c3)SC2=S)cc1 16216678 ZGEYGJUZTQJFEI-YVLHZVERSA-N 387.482 3.811 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(c3ccc(C(=O)O)c(O)c3)C2=O)c1 5373615 LEQWKCQVZKOQHG-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB COc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3N=C(C)SC3=NC2=O)c1C 5477930 JHADVHIWNKIZMQ-HWCWCTJWSA-N 393.472 3.742 10 40 GHCB CN(CCCNC(=S)Nc1cccc(N2CCCC2=O)c1)c1ccccc1 225748976 KSOHTWKXHIPZFZ-UHFFFAOYSA-N 382.533 3.626 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCCC3)ccc21 13007784 JJFZODNMRPUAJM-JOCHJYFZSA-N 399.485 3.914 10 40 GHCB COc1cc2c(cc1O)[C@H](CSC)Cc1cc3c(cc1N(C)CC2)OCO3 2028194 SHZPKHCRSMQQSP-HNNXBMFYSA-N 387.501 3.811 10 40 GHCB CC1=C(C(=O)O[C@@H]2CC[C@H](C)[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 4043520 PGIBQQKMAPFGKC-UQFOYQTNSA-N 385.508 3.748 10 40 GHCB COc1ccc(-c2ccc(/C=C3/SC(=S)N([C@H](C)C(=O)O)C3=O)o2)cc1 13576381 ORTUCGOLAGIHNM-KXUVPBGPSA-N 389.454 3.630 10 40 GHCB Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](O)c1ccc(F)c(F)c1 69351074 JRUMFHTUFNPMNN-QGZVFWFLSA-N 376.428 3.897 10 40 GHCB O=c1c(-c2nc3ccccc3s2)coc2c(CN3CCOCC3)c(O)ccc12 19904544 PAYYMNNDABOJJL-UHFFFAOYSA-N 394.452 3.608 10 40 GHCB CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(N(C)C)o1 409039711 RXRNYNNDDCNPHP-RMKNXTFCSA-N 385.292 3.847 10 40 GHCB O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1 1192635 QZANPHGZCVRPOS-QGOAFFKASA-N 395.846 3.607 10 40 GHCB CCCOc1ccc(/C=C2/SC(=S)N(CCOC)C2=O)cc1OCC 2811788 DZOMRSLSQFMPRA-FOWTUZBSSA-N 381.519 3.722 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/Nc3ccccc3C(C)C)C(=O)NC2=S)cc1 100992481 QVAYALCRLBPTDF-SFQUDFHCSA-N 379.485 3.862 10 40 GHCB CC(=O)Nc1ccc(NC2=NC(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)S2)cc1 5520278 MXYSJUUJXPJBJY-YBEGLDIGSA-N 382.401 3.636 10 40 GHCB Cc1cc(/C=C2\SC(=O)NC2=O)c(C)n1-c1cc(C(=O)O)ccc1Cl 408818106 XWRKWUYONKSRKM-AUWJEWJLSA-N 376.821 3.770 10 40 GHCB O=C(NC1(Nc2ccccc2)C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1 226297795 NVWSMTJYTOQUGJ-UHFFFAOYSA-N 390.826 3.957 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccccc1F 6345869 VRQOIAPWZZTMMT-XSFVSMFZSA-N 379.435 3.909 10 40 GHCB Cc1cc(C)cc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 12062722 XJHSPSZSQIYXOE-JOCHJYFZSA-N 396.531 3.956 10 40 GHCB COC(=O)c1ccc([C@@H](c2c(O)ccc3ccccc23)N2CCOCC2)cc1 25561819 YMCQRYCRSDWBJA-QFIPXVFZSA-N 377.440 3.754 10 40 GHCB COc1cccc(NC(=O)COC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 5643832 VYXUXESQFOOWAJ-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)N1CCCCCC1 27530591 DVPRIVYBOGIOKN-DTQAZKPQSA-N 392.521 3.820 10 40 GHCB O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C/c1ccc(O)cc1 13534459 QGDATRCKKBGLBA-LDADJPATSA-N 399.903 3.838 10 40 GHCB Cc1cc(NC(=S)NCCCN(C)c2ccccc2)ccc1N1CCCC1=O 225748901 WIMUJKVSMVTNBE-UHFFFAOYSA-N 396.560 3.935 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)C(=O)NC2=S)cc1 5907125 RNAGMMKYUYYYFQ-WJDWOHSUSA-N 386.860 3.570 10 40 GHCB Cc1ccccc1N1C[C@@](O)(c2ccc(OC(F)F)cc2)[N+]2=C1SCCC2 2966079 PRWYSFWWHSEJLL-HXUWFJFHSA-N 391.463 3.767 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3cccc(Cl)c3)N3CCCC3)ccc21 8963333 XXUWZXZSPUJVGT-OAQYLSRUSA-N 383.923 3.899 10 40 GHCB COc1ccc(NC(=O)COC(=O)c2cccc(-n3c(C)ccc3C)c2)cc1 408645504 KXCKKDHFBXXBNF-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)cc1Cl 409389157 ANCHMWRKBSNESF-XBUHWIKASA-N 399.834 3.579 10 40 GHCB COc1ccc(-n2c(C)ccc2[C@@H]2[C@H](c3ccccn3)NC(=S)N2C)cc1 222764410 POOOHSAKXBDATK-VQTJNVASSA-N 378.501 3.792 10 40 GHCB CCN1C(=O)/C(=C\C=C2/Sc3cc(C)c(C)cc3N2CCO)SC1=S 4797765 FKANFWHPUVJIDT-ISJKIFLQSA-N 392.571 3.813 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(CC(=O)N2CCCCC2)C1=O 27530469 QIQBVZHADIMXBB-KDOCSACZSA-N 386.542 3.847 10 40 GHCB Cc1cc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)ccc1N1CCCC1 409081880 LHMMOYBIEBMSNZ-JIHKLPAASA-N 388.558 3.975 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(F)c(-c3cccs3)c2)SC1=S 55038009 IPMJOEYTEYAKPE-NTUHNPAUSA-N 379.459 3.840 10 40 GHCB COc1cccc(CNc2ccc3c(c2)nc(CN2CCCCC2)n3C)c1O 4625754 DVOFUESPDGSYMW-UHFFFAOYSA-N 380.492 3.886 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C\c3ccco3)SC2=S)cc1OC 5551828 VIEAWYNYPSGKPA-LFIBNONCSA-N 375.471 3.741 10 40 GHCB O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc([N+](=O)[O-])s1 5504812 QANQOVQLZMIZQX-UHFFFAOYSA-N 378.365 3.684 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=S)N(C(=O)c3ccc(F)cc3)C2=O)cc1 408719005 FHMMCKSWDVVYSX-LFIBNONCSA-N 386.473 3.933 10 40 GHCB O=C1CCCc2cc(C(=O)Nc3c(-c4ccccn4)nc4ccccn34)ccc2N1 84613294 ICXVLOSRSOVNQR-UHFFFAOYSA-N 397.438 3.923 10 40 GHCB COc1ccc([C@@H]2CC(c3cc(Br)ccc3O)=NN2)c(OC)c1 1447890 OECQBOVEWWUFTE-AWEZNQCLSA-N 377.238 3.611 10 40 GHCB biogenic O=C1c2ccccc2C2=CS(=O)(=O)Nc3c(Oc4ccccc4)cc(O)c1c32 12376801 FYIIBTRVVKQPPT-UHFFFAOYSA-N 391.404 3.873 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(N3CCOCC3)nc2)cc1 22994921 JSGBXGNNZNFUKX-UHFFFAOYSA-N 376.460 3.578 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C/c2cc(C)n(C(C)C)c2C)C(=O)NC1=S 409225077 JLJJGIDYRUOGIV-GZTJUZNOSA-N 381.501 3.826 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)cc1 4541434 IPEJQJZTBCPMRD-UHFFFAOYSA-N 379.441 3.521 10 40 GHCB COc1ccc([C@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)cc1 16953446 WEDIZHLJZFDESA-LJQANCHMSA-N 375.901 3.519 10 40 GHCB O=C1Nc2ccccc2S/C1=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 409099156 QRNLOQFGYFNOEK-LDADJPATSA-N 383.429 3.517 10 40 GHCB Cc1cccc(N2NC(=O)/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1 6924257 DYJWJPKSPDBIID-PDGQHHTCSA-N 389.367 3.625 10 40 GHCB Cc1cc(-n2cccc2/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1Cl 33720888 GJWZCODLYVNURK-AQTBWJFISA-N 377.831 3.901 10 40 GHCB O=C1N[C@H](c2ccccc2O)Nc2sc3c(c21)CCN(Cc1ccccc1)C3 4525914 NWSSCIMIMOARNE-FQEVSTJZSA-N 391.496 3.866 10 40 GHCB O=C(O)c1ccccc1/C=C1/SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O 113830666 VAWGYIYMSFBMKM-NTEUORMPSA-N 386.410 3.699 10 40 GHCB O=C1N=C(O)/C(=C\c2cccn2-c2ccc(O)cc2)C(=O)N1c1ccc(F)cc1 33928556 ZKIVMTMFDDZJNS-LDADJPATSA-N 391.358 3.829 10 40 GHCB CCN(CC)c1ccc(/C=C2\CCc3cnc4n[n+]5c(C)cc(C)nc5n4c32)cc1 5173934 TXIZRLVWBOZBAC-XMHGGMMESA-N 399.522 3.813 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C/c3ccc(O)c(O)c3)SC2=S)cc1 5371245 MOKQHRDINZGAGS-BOPFTXTBSA-N 387.482 3.550 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)N1CCCC1 2301586 NWTCZMZAZWCORC-SDNWHVSQSA-N 380.922 3.554 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)COc1ccccc1[N+](=O)[O-] 10962260 JSPZFOIPYABQBR-UHFFFAOYSA-N 383.448 3.623 10 40 GHCB CC(C)(C)c1ccccc1OCC(=O)NCc1ccc(N2CCOCC2)cc1 54284921 XJTSUEREPQXCBZ-UHFFFAOYSA-N 382.504 3.516 10 40 GHCB Cc1cc(C(=O)CSc2nnc[nH]2)c(C)n1-c1cccc(Br)c1 6365856 FNGAVYVTRWOZOE-UHFFFAOYSA-N 391.294 3.950 10 40 GHCB CCc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 408901799 CMPHODDCINEIBL-LFIBNONCSA-N 399.244 3.678 10 40 GHCB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 858902 PMZXZSJNLABMLB-UHFFFAOYSA-N 383.356 3.999 10 40 GHCB Cc1cc(C(=O)NCCc2cn3ccccc3n2)c(C)n1-c1ccccc1F 29981831 MJPQRADLEPASKS-UHFFFAOYSA-N 376.435 3.853 10 40 GHCB N=C1/C(=C/c2ccc(O)cc2)C(=O)N=C2SC(Cc3ccc(Cl)cc3)=NN12 5142055 HATYGAZSCFWNIN-ATNGQLTKSA-N 396.859 3.907 10 40 GHCB Cc1ccc(NC(=O)CN2C(=O)N/C(=C/c3cc(C)n(C(C)C)c3C)C2=O)cc1 409014796 KCINVSDTVKMJNB-YBFXNURJSA-N 394.475 3.526 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cccc4c3CCCC4)CC2)cc1 224547921 NOJMVLLXQMVSJJ-GOSISDBHSA-N 394.515 3.690 10 40 GHCB COc1cc(C)c(/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1C(C)C 16267879 TWDGTZQVKSJPAI-WQRHYEAKSA-N 396.418 3.933 10 40 GHCB CC1CCC2(CC1)NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 23653122 CJSFGZVUVRMQDE-UHFFFAOYSA-N 398.551 3.567 10 40 GHCB O=C1N=C(NC2CCCC2)S/C1=C\c1cccc(NC(=O)C(F)(F)F)c1 22135231 OJHXIGSKQSGKKL-LCYFTJDESA-N 383.395 3.690 10 40 GHCB O=C(CN(Cc1ccc(F)cc1)C1CC1)NCc1ccc(N2CCCC2)cc1 71810482 BKWPYCWFVYNNRU-UHFFFAOYSA-N 381.495 3.707 10 40 GHCB CC(C)SC1=NSC2=NC(=O)/C(=C\c3ccc(Br)o3)C(=N)N21 32957615 RVLIPWCUKYMYMF-PPVHLYJCSA-N 399.295 3.760 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3ccc(C)c(C)c3)N=C2C)c([N+](=O)[O-])c1 100044307 UWLFBZWGUYYAER-GZTJUZNOSA-N 380.404 3.939 10 40 GHCB CN1C(=O)C(=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)C(=O)N(C)C1=S 5668644 FFWBVOIQQCVALY-UHFFFAOYSA-N 395.267 3.852 10 40 GHCB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\Nc1ccc2c(c1)oc(=O)n2C 16160813 ARQGHSURVBWXAD-GDNBJRDFSA-N 382.807 3.503 10 40 GHCB Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](O)c1ccc(F)c(F)c1 63733906 JRUMFHTUFNPMNN-KRWDZBQOSA-N 376.428 3.897 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)c1 9190099 LUGAJHDZWISBCG-MFOYZWKCSA-N 385.466 3.825 10 40 GHCB CN1C(=O)C(=Cc2ccc(SCc3ccc(Cl)cc3)o2)C(=O)N(C)C1=O 20324480 HJWBCXDSMINQMF-UHFFFAOYSA-N 390.848 3.659 10 40 GHCB CCOc1cccc(N2C(=O)/C(=C/c3ccccc3Cl)C(=O)NC2=S)c1 408740244 JOIDVXXVNJVPRJ-XNTDXEJSSA-N 386.860 3.570 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(-c3ccc(O)c([N+](=O)[O-])c3)o2)SC1=S 98086321 VMMJQLGTHNLJIZ-RIYZIHGNSA-N 376.415 3.782 10 40 GHCB CC(C)N1c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2[C@H](C)CC1(C)C 260573564 YZMCKMNCUCPCHG-CQSZACIVSA-N 399.560 3.786 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1cccnc1 661897 ZWRUCUGVVRYPIM-RGVLZGJSSA-N 390.418 3.721 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3c(F)cccc3F)N3CCCC3)ccc21 8963238 BBIMNCFVDBVUBG-FQEVSTJZSA-N 385.458 3.524 10 40 GHCB O=C(O)c1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 6926209 ZRTQMAYZOOIYEU-VIZOYTHASA-N 385.422 3.519 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 1281969 XPMUWHVBFWYFSV-GPLLRDDGSA-N 399.493 3.940 10 40 GHCB CCc1ccc(NC2=NC(=O)/C(=C\c3cc4c(cc3[N+](=O)[O-])OCO4)S2)cc1 15223380 BJKQRVVLQQAABP-CAOOACKPSA-N 397.412 3.968 10 40 GHCB Nc1cccc(C(=O)NC2=NN(c3c(Cl)cc(Cl)cc3Cl)C(=O)C2)c1 100009101 FFSCMMOUQKDVKY-UHFFFAOYSA-N 397.649 3.709 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(O)=NC2=S)cc1 1301555 DFQFHCADUQTFJB-GZTJUZNOSA-N 391.452 3.859 10 40 GHCB Cc1cc(C(=O)COC(=O)c2ccccc2NCCO)c(C)n1-c1ccccc1 6329764 SNLZJHIWVAREHK-UHFFFAOYSA-N 392.455 3.538 10 40 GHCB CCN(CCCNC(=S)Nc1cccc(C(=O)OC)c1)c1ccc(C)cc1 225734303 BJNRFWNAZOWZQW-UHFFFAOYSA-N 385.533 3.985 10 40 GHCB COc1ccc(N2C[C@](O)(c3ccc(Cl)cc3)[N+]3=C2SCCC3)cc1 2965935 ZBXMHEHVAWOJHT-IBGZPJMESA-N 375.901 3.519 10 40 GHCB Oc1cc2c(cc1[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1)OCO2 20745066 RSRXHKPLBDWUTH-SFHVURJKSA-N 382.243 3.849 10 40 GHCB C[C@@H]1CCCC[C@@]12NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 23653291 UQEQEIIUUFHENS-WZONZLPQSA-N 398.551 3.567 10 40 GHCB COc1ccccc1C(=O)NC[C@H](c1ccc2c(c1)CCN2C)N1CCCCC1 13007748 NBCWDSVAHGXZNW-JOCHJYFZSA-N 393.531 3.645 10 40 GHCB Cc1ccc(C)c(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 4147446 PXRVOAPBFKRNLO-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)N=C2O)c1 16693158 KQODWKRQEJYFAL-YBEGLDIGSA-N 381.344 3.500 10 40 GHCB O=C(CSCc1ccccc1Cl)NCc1ccc(N2CCOCC2)cc1 13647776 KKTBPLCXRRDPTL-UHFFFAOYSA-N 390.936 3.726 10 40 GHCB COc1ccc(N2CCN(C(=O)CSc3nc4ccccc4s3)CC2)cc1 3547238 SLTKCSAMUFNHBR-UHFFFAOYSA-N 399.541 3.746 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3cccn3CCOc3cc(C)cc(C)c3)C(=N)N2O1 41078249 YEGGYOHIXFAKCM-RPDORSEYSA-N 390.443 3.634 10 40 GHCB COc1cc(/C=C2/SC(=S)N(Cc3ccco3)C2=O)cc(OC)c1OC 1241736 JCUHLNOOAKCLKT-OQLLNIDSSA-N 391.470 3.707 10 40 GHCB CCOc1ccc(-c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)o2)cc1 9310655 LHENNNSDSWTPTL-OQLLNIDSSA-N 389.454 3.631 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccccc1 408850786 RDZZRGNNJPAARV-PKNBQFBNSA-N 377.252 3.825 10 40 GHCB CC(C)c1ccc(/C=C2/C(=N)N3N=C(N4CCCCC4)SC3=NC2=O)cc1 41084825 LFAQJZZFWRKXGC-PSPCYXPKSA-N 381.505 3.873 10 40 GHCB CCCCCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(N(C)C)cc1 5003620 ZSBYJQCDJMCDBL-SFHVURJKSA-N 375.538 3.669 10 40 GHCB CN1CCc2c(sc3c2C(=O)N[C@@H](c2cc(Cl)cc(Cl)c2O)N3)C1 20101334 GMPHDVGWIINCED-CQSZACIVSA-N 384.288 3.603 10 40 GHCB O=C1S/C(=C/c2ccc(N3CCOCC3)cc2)C(=O)N1Cc1ccccc1F 4674939 MIUHQMHQFPCGFF-CPNJWEJPSA-N 398.459 3.899 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/c3ccc(N4CCCC4)cc3)C2=O)c1C 408860026 XGGMVYKTDDPHFH-RGEXLXHISA-N 389.455 3.570 10 40 GHCB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=C1/SC(=S)N(c2ccccc2)C1=O 408902121 KJPBVTLVGOGHIJ-WLSWZUKCSA-N 393.493 3.974 10 40 GHCB COc1ccc([C@H]2CC(c3cc(Br)ccc3O)=NN2)c(OC)c1 1447889 OECQBOVEWWUFTE-CQSZACIVSA-N 377.238 3.611 10 40 GHCB biogenic Cc1ccc(O)c([C@@H]2CC(c3ccccc3Cl)=NN2C(=O)/C=C\C(=O)O)c1 80316246 GCDGNYGEFLSAQN-JJEJIETFSA-N 384.819 3.673 10 40 GHCB Cc1ccc(NC(=O)CCCC[C@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)cc1 1588625 JPIVNDIQZWPZMT-HRAATJIYSA-N 386.492 3.617 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccn2-c2ccc(F)cc2)C1=O 100992343 CPSDRLDGLVEPOO-AQTBWJFISA-N 389.386 3.591 10 40 GHCB COc1ccc([C@@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)cc1 12296966 PVHLEDPJIDIXJJ-INIZCTEOSA-N 378.428 3.871 10 40 GHCB biogenic Cc1ccnc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)NC(=S)N3C)c2C)c1 222747849 AXQREOQMRQABRU-UXHICEINSA-N 377.517 3.795 10 40 GHCB CCN(CC)CCC[C@H](C)NC(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O 5665504 QELLECZGFFHTFO-INIZCTEOSA-N 392.499 3.702 10 40 GHCB CCOc1ccc(N2C[C@@](O)(c3ccc(C)cc3C)[N+]3=C2SCCC3)cc1 2965992 WZHJAWGKKDXHFQ-JOCHJYFZSA-N 383.537 3.873 10 40 GHCB Cc1occc1C(=O)NN1C(=O)/C(=C/c2cccc3cccnc23)SC1=S 13722749 DYOKHABZWOWJQC-GDNBJRDFSA-N 395.465 3.682 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=O)N=C2O)c(C)n1-c1ccc(Cl)c(Cl)c1 8744452 KTMHOLJKSJDHOK-UHFFFAOYSA-N 378.215 3.991 10 40 GHCB CN1C(=O)/C(=C/c2cn(CC(=O)N3CCCC3)c3ccccc23)c2ccccc21 4516975 XVJDOOBZDJXAFW-XSFVSMFZSA-N 385.467 3.781 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@H]1[C@H](c2ccccn2)N=C2S[C@@H](C)CN21 222597183 YKFXZAXSVNLPJE-NDXORKPFSA-N 394.544 3.816 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2ccccc2)SC1=S)Nc1ccc(O)cc1 1907837 IFGGXHKQKCQQMC-VBKFSLOCSA-N 384.482 3.622 10 40 GHCB CCN1C(=O)N/C(=C/c2cc(C)n(-c3ccc(N(CC)CC)cc3)c2C)C1=O 14010259 KYDAFKXENXYVDQ-XSFVSMFZSA-N 380.492 3.853 10 40 GHCB O=C1NN(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2cccc(F)c2)c1 34890420 FRUIQFAODWYXKN-STZFKDTASA-N 388.398 3.866 10 40 GHCB CSc1ccc2c(c1)[C@H](N1CCN(CCO)CC1)Cc1ccccc1S2 22859274 STMRSBFWRHDXLV-LJQANCHMSA-N 386.586 3.767 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cccc(OC)c1OC 409001326 PCHHFJLHGZGEGR-AQTBWJFISA-N 393.439 3.889 10 40 GHCB CC1=NN2C(=N)/C(=C/c3cc(C)n(Cc4ccccc4)c3C)C(=O)N=C2S1 33560643 AHNHRJXODLAYIN-LVKBRKGQSA-N 377.473 3.792 10 40 GHCB CN1CCc2nc([C@@H]3CCCCN3Cc3ccc4c(c3)CCCN4C)ncc2C1 19590334 XFKRQXPQANVZJQ-QHCPKHFHSA-N 391.563 3.574 10 40 GHCB Cc1oc2c(CN3CCC[C@@H]3C(=O)O)c(O)ccc2c(=O)c1-c1ccc(F)cc1 26731203 ZBEYEZOELOMFRG-QGZVFWFLSA-N 397.402 3.662 10 40 GHCB biogenic COc1ccc(N2CCN(CC(=O)c3c[nH]c4ccc(OC)cc34)C[C@H]2C)cc1 35369235 YCSNFBNKAMBTGJ-MRXNPFEDSA-N 393.487 3.579 10 40 GHCB COCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc(C)n1-c1ccccc1 223033257 GQZWWWHCJIREGW-LEWJYISDSA-N 392.528 3.800 10 40 GHCB Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccc(O)cc1 222741338 RJUKDQUEUSVZMB-UXHICEINSA-N 378.501 3.797 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=S)N(c3cccc(Cl)c3Cl)C2=O)c(C)[nH]1 13551134 BNKNDAKWXLFJCD-YRNVUSSQSA-N 394.283 3.770 10 40 GHCB CN(C)c1ccc(N2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1 7209132 PSAVMRIBWYOBRP-LFIBNONCSA-N 384.482 3.857 10 40 GHCB COC(=O)Cn1cc(/C=C2\SC(=S)N(CC(C)C)C2=O)c2ccccc21 409122707 BBXXKFJPUYEKOX-PXNMLYILSA-N 388.514 3.672 10 40 GHCB COC(=O)C[C@@H](c1c(O)c(O)c(O)c2c(=O)cc(-c3ccccc3)oc12)C(C)C 96221823 FXNUPXSZXYWPKE-CYBMUJFWSA-N 398.411 3.880 10 40 GHCB biogenic Cc1onc(C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1CN(C)C 19714800 TULUQJMRHFLUIK-MRXNPFEDSA-N 384.524 3.772 10 40 GHCB CC(=O)N[C@H](CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1cccs1 9975982 WPQDJJVMWCTOQM-HXUWFJFHSA-N 399.560 3.964 10 40 GHCB CC1=NN(c2ccccc2C)C(=O)/C1=C/Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 100931031 XEKYZFSLXGDMKK-MHWRWJLKSA-N 381.348 3.530 10 40 GHCB CCN(CC)c1ccc(/C=C2/SC(=O)N(CC(=O)OC(C)C)C2=O)cc1 1006052 NCWYDSBHJBOROP-LFIBNONCSA-N 376.478 3.521 10 40 GHCB COc1ccc(-c2cc3ccc(O)c(CN4CCCC4)c3oc2=O)c(OC)c1 4084911 LDYSAUNMMYGANF-UHFFFAOYSA-N 381.428 3.779 10 40 GHCB biogenic CN(C)c1ccc([C@H](c2nnnn2C(C)(C)C)N2CCc3ccccc3C2)cc1 20120988 AAFZDYDDZPHGMB-OAQYLSRUSA-N 390.535 3.642 10 40 GHCB COc1cc(/C=C2\SC(NC(C)=O)=NC2=O)ccc1OCc1ccc(C)cc1 409024645 LXBZUVJQUULQQN-ODLFYWEKSA-N 396.468 3.689 10 40 GHCB Cc1ccc(NC(=O)COc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2)cc1 409347375 POBXDECLKKEUDS-BOPFTXTBSA-N 398.509 3.844 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3ccccc3F)C(C)=C2C(=O)OC)c1O 408587865 VFAJOBLGVXDYRO-QINSGFPZSA-N 397.402 3.807 10 40 GHCB COC(=O)c1ccc(C)c(NC(=S)NCCCN2CCCc3ccccc32)c1 225745779 YESWDGKPSSDYIT-UHFFFAOYSA-N 397.544 3.911 10 40 GHCB O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1 59475178 SHSUEGBYZSGXMW-CPNJWEJPSA-N 381.863 3.792 10 40 GHCB COc1ccc(/C=C2/SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)cc1OC 35042551 JOOLBNYSBJFLRV-WOJGMQOQSA-N 397.456 3.745 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccc(OC)cc1 4696429 DCFLPVFWHDOWJA-MOSHPQCFSA-N 377.440 3.876 10 40 GHCB CCOC(=O)c1sc(N2N=C(C)/C(=C\c3ccccc3OCC)C2=O)nc1C 9295999 VFKTWLOCKRPSJR-RVDMUPIBSA-N 399.472 3.833 10 40 GHCB COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3ccc(F)cc3)n2)c1 7051084 HDVKZPYSHMUISS-UHFFFAOYSA-N 394.449 3.767 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccccc1O 1311753 JPKJEDAPALOKGZ-PTNGSMBKSA-N 388.470 3.605 10 40 GHCB C[C@H]1Cc2cc(/C=C3/SC(=S)N(CCCCCC(=O)O)C3=O)ccc2O1 2342310 FLHPZLAWEWJMOP-JASJWYONSA-N 391.514 3.856 10 40 GHCB COC(=O)CCCCCN1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)SC1=S 4871427 ZQROBGUYCRPNOA-SDNWHVSQSA-N 394.474 3.529 10 40 GHCB Cc1cc(C(=O)CSc2nnnn2C2CCCC2)c(C)n1-c1ccccn1 8026875 FZCPTTFZJWXERP-UHFFFAOYSA-N 382.493 3.566 10 40 GHCB CCCOc1ccc(CN2CCCN(Cc3ccc(OC)cc3)CC2)c(O)c1 95453786 PAQBVPVMMOVXCC-UHFFFAOYSA-N 384.520 3.898 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccccc3Cl)C2=O)c1 408942646 ZVJDQPVDRORMAY-QINSGFPZSA-N 384.819 3.795 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OC(=O)c4ccco4)c(Cl)c3)C(=N)N2O1 41078386 BDJSVBFQSBLXSV-FHJHWHQUSA-N 397.774 3.603 10 40 GHCB CCOc1ccc(C(=O)NCCN(CC)c2ccc(OC)cc2)cc1OCC 225066884 YLGSCIHUNHRNPV-UHFFFAOYSA-N 386.492 3.749 10 40 GHCB CC(C)n1[nH]c(=O)c2c(-c3cccc(O)c3)c3oc4c(O)c(O)ccc4c3nc21 85876973 QQFCFBFWEUEDKA-UHFFFAOYSA-N 391.383 3.989 10 40 GHCB biogenic CCOc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 140016512 MKWDHOKHJOGEAK-MRXNPFEDSA-N 385.533 3.970 10 40 GHCB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C(C)C)cc3)C2=O)cc1[N+](=O)[O-] 5754036 VCOKSRVCAIJYKL-LICLKQGHSA-N 393.399 3.693 10 40 GHCB Cc1cccc(C(=O)Oc2ccccc2/C=C2\C(=O)NN(c3ccccc3)C2=O)c1 6450613 TUNNEASSWDYTHL-HMMYKYKNSA-N 398.418 3.676 10 40 GHCB COc1cc([C@@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)ccc1O 12296827 UTKWCMYNMXQZJE-AWEZNQCLSA-N 394.427 3.577 10 40 GHCB biogenic Cc1cc(C(=O)OCC(=O)N(C)Cc2ccccc2)c(C)n1-c1ccccc1 3460669 YRLUUSCXJYOIKM-UHFFFAOYSA-N 376.456 3.910 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3cccn3CCCOc3ccc(C)cc3)C(=N)N2O1 41078264 NEDMECLQZQWIDW-QLDKJHNESA-N 390.443 3.716 10 40 GHCB Cc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)NC(=S)N3C)c2C)nc1 222748465 USHSVLMXKDTNDK-VQTJNVASSA-N 377.517 3.795 10 40 GHCB CCOc1cc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)cc(Cl)c1OCC 41078360 RIWWELFIDSGQPZ-KZUXQMQWSA-N 375.812 3.588 10 40 GHCB [N-]=[N+]=N[C@@H]1C[C@@H](C(=O)O)N(C(=O)OCC2c3ccccc3-c3ccccc32)C1 98091007 HOPXMBBEYJTPNX-XIKOKIGWSA-N 378.388 3.773 10 40 GHCB Cc1ccc(O)c(NC(=O)c2ccc(/C=C3/SC(=S)N(C)C3=O)cc2)c1 5374799 UTGCXRPKRQOEBU-MHWRWJLKSA-N 384.482 3.784 10 40 GHCB CCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)C1=O 4663553 MVBMOGYBXFZDHM-GZTJUZNOSA-N 384.457 3.937 10 40 GHCB CCCOc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3OCC)C2=O)cc1 408900791 VBQXNRGLQCFVTH-JXAWBTAJSA-N 394.427 3.541 10 40 GHCB COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1F 223655601 LVNVCGPYIVJXHH-UHFFFAOYSA-N 385.416 3.866 10 40 GHCB COc1cc2c(cc1OC)CN(Cc1c(O)ccc3c(C)c(C)c(=O)oc13)CC2 85876796 HWIRARWBCYMOHO-UHFFFAOYSA-N 395.455 3.691 10 40 GHCB biogenic CC[C@@H](C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 390770386 IUZBIAPAMJMEKV-SZNDQCEHSA-N 377.444 3.810 10 40 GHCB CC(=O)N(c1nc(/C=C2\SC(=S)NC2=O)cs1)c1c(C)cccc1C 12872256 BMWMSEPOPFOQCW-QPEQYQDCSA-N 389.527 3.933 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4cccc(F)c4)ns3)CC2)cc1 49409978 ZBHBERFDOANBSU-UHFFFAOYSA-N 397.475 3.920 10 40 GHCB COc1cccc([C@H]2Nc3ccccc3C(=O)N2c2ccc3c(c2)OCO3)c1O 7885033 DIFIAROMYGVNSN-NRFANRHFSA-N 390.395 3.901 10 40 GHCB CC[C@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 113969937 RLDSKYLOTNLMCO-QFIPXVFZSA-N 382.504 3.614 10 40 GHCB CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(CC(=O)O)C1=O 409348328 SDNVABIYPVZINP-SXGWCWSVSA-N 387.482 3.913 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3cc(F)ccc3F)sc2n1 21924057 UFOMUMGSELAUSS-UHFFFAOYSA-N 391.399 3.569 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(OC)c1OC 897997 ZYZGVDGDKKQERI-ATVHPVEESA-N 397.402 3.720 10 40 GHCB COc1ccc(CNc2ncc(Br)cc2Br)c(O)c1 18123125 XEEUYSZMHZXRTE-UHFFFAOYSA-N 388.059 3.933 10 40 GHCB CN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)C(=O)NC1=S 4616106 LSTFRUKQMGJIRK-YFHOEESVSA-N 381.240 3.510 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc1 408803255 MZGLHSNVSAPJPK-QGOAFFKASA-N 378.428 3.759 10 40 GHCB C[C@H]1CN2C(=N[C@@H](c3ccccn3)[C@@H]2c2ccc(N3CCOCC3)c(F)c2)S1 222596781 QSKQZWHMIVMZQO-GKCIPKSASA-N 398.507 3.647 10 40 GHCB COCCNCc1c(O)c(Cl)cc2c(C)c(Cc3ccccc3)c(=O)oc12 20649298 DLETVIGWUYYXEG-UHFFFAOYSA-N 387.863 3.787 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(C)n(Cc4ccco4)c3C)CC2)cc1 12556190 OVCMWKCHVHKLIY-UHFFFAOYSA-N 393.487 3.717 10 40 GHCB CCCN1C(=O)S/C(=C\c2cc(OC)c(N3CCCC3)cc2OC)C1=O 409093796 AAGDWOSSBGZAQO-BOPFTXTBSA-N 376.478 3.750 10 40 GHCB COc1ccc(N2C(=O)NC(=O)/C(=C/c3c(Cl)cccc3Cl)C2=O)cc1 4456492 GQZDYKMVXCYNQZ-LCYFTJDESA-N 391.210 3.668 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3)CC2)S/C1=C/c1c[nH]c2ccccc12 20226939 HOLKJNBUCBJQDT-XSFVSMFZSA-N 388.496 3.960 10 40 GHCB Cn1cccc1C=C1C(=O)N(c2ccccc2)C(=S)N(c2ccccc2)C1=O 409095665 DEFSBXRHNFGDJX-UHFFFAOYSA-N 387.464 3.773 10 40 GHCB COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\c1cccc(F)c1 408584191 MVPNKAGSJMJRKM-BOPFTXTBSA-N 382.347 3.611 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408892161 GRSBTWGCCINPPW-BOPFTXTBSA-N 397.402 3.720 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=S)N(c2ccccc2)C1=O 408809807 JJHBJJWCLOCZDJ-RVDMUPIBSA-N 386.860 3.570 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)c3ccc(F)cc3)N3CCCC3)ccc21 13008220 KGDWGEDREIRPOF-JOCHJYFZSA-N 381.495 3.775 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CSc3n[nH]c(=O)n3C3CC3)c2C)cc1C 8503742 AQOXONYLFMZDOA-UHFFFAOYSA-N 396.516 3.906 10 40 GHCB CC(C)N1C(=O)/C(=C/Nc2ccc(Cl)cc2)C(=O)N(Cc2ccco2)C1=O 5464265 UDALTBKCEYKFMA-MHWRWJLKSA-N 387.823 3.628 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N[C@@H]3CCC[C@@H](C)[C@H]3C)sc2n1 14421999 KDVKQCRAACCTRS-LERXQTSPSA-N 389.521 3.593 10 40 GHCB CN1/C(=C\C2=CC3=S=C(c4ccccc4)C(=O)N3C=N2)Sc2ccccc21 409415785 GXSMZWPZIALSLE-WOJGMQOQSA-N 389.505 3.922 10 40 GHCB O=c1cc(CN2CCCc3cc(OC(F)(F)F)ccc32)nc2sccn12 29923020 OYWGCWPRGSAGTJ-UHFFFAOYSA-N 381.379 3.607 10 40 GHCB CN(c1ccc(CNC(=O)N2CCC3(CC2)OCCO3)cc1)C1CCCCC1 65485669 DFPCQKPVXWAESC-UHFFFAOYSA-N 387.524 3.504 10 40 GHCB COc1ccc(-c2ccc(CCC(=O)O)n2CC(=O)Nc2ccc(F)cc2)cc1 6811740 AVWHFXGUCHPZIW-UHFFFAOYSA-N 396.418 3.959 10 40 GHCB CCc1ccc(N2C(=O)/C(=C/c3ccc(N(CC)CC)o3)C(=O)NC2=S)cc1 408817944 MMBQNPWQJXDOEP-GHRIWEEISA-N 397.500 3.520 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(c3ccc(OC)cc3)C(C)=C2C(=O)OC)cc1 408797773 SXTZKFMXUGXTND-ZHZULCJRSA-N 393.439 3.971 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1cccc(C)c1 14414366 YHKZBLSADRMVMJ-QNGOZBTKSA-N 391.467 3.919 10 40 GHCB CCOC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CCOC 44085285 MAYGMCDGZAWAJM-UHFFFAOYSA-N 399.310 3.614 10 40 GHCB O=C(CCCOc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 10113457 NAFYRNSERIHFNV-UHFFFAOYSA-N 388.895 3.652 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)Nc3ccccc3C)sc2n1 12553885 SMUQTKJNDYIUTI-CYBMUJFWSA-N 383.473 3.988 10 40 GHCB COc1ccc(N2CCN(Cc3nc(-c4ccc(SC)cc4)no3)CC2)cc1 57427653 VVTUMQTXTBJYID-UHFFFAOYSA-N 396.516 3.789 10 40 GHCB CCOC(=O)c1c(C)n(-c2ccccc2)c2ccc(O)c(CN3CCOCC3)c12 38626652 RMSLEELMEORVED-UHFFFAOYSA-N 394.471 3.653 10 40 GHCB COc1ccc2ccc(O)c(CN3CCN(c4ccccc4OC)CC3)c2c1 16076244 ZHGKDQRECKCYGF-UHFFFAOYSA-N 378.472 3.885 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)S1 408600621 DYCGVWSXYLMSBW-VGOFMYFVSA-N 391.792 3.615 10 40 GHCB COc1cccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)c1 35648422 QQGAEKSROSAUHO-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB COc1ccc(OC)c(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c1 13402131 JOTJXNHKWYJEFW-PTNGSMBKSA-N 395.502 3.550 10 40 GHCB COc1ccc2ccc(O)c(CN3Cc4c(OC)ccc(OC)c4[C@H](O)C3)c2c1 29543444 QMLZSWNIQROQSL-HXUWFJFHSA-N 395.455 3.620 10 40 GHCB CC1=C(C(=O)O[C@@H]2CC[C@H](C)[C@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 102060666 PGIBQQKMAPFGKC-GOYGXENFSA-N 385.508 3.748 10 40 GHCB CCCC[C@@H](NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12)C(=O)O 2132696 BFMLXWKWRCWUGE-GOSISDBHSA-N 381.428 3.899 10 40 GHCB biogenic CN1CCCc2cc(CNC(=O)Nc3nc(-c4ccccc4)ns3)ccc21 58516659 XVMAMTMBRLKOLG-UHFFFAOYSA-N 379.489 3.909 10 40 GHCB CC1(C)[C@@H]2CC[C@H]1[C@@H](O[C@@H]1CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@H]13)C2 4568189 NLLZPZMJMSXUEY-CELLPKHUSA-N 382.456 3.576 10 40 GHCB COc1ccc2c(c1)OCC(/C=C1/SC(=S)N(c3cccnc3)C1=O)=C2 96939643 PGCJSCQVBRVAEF-CAOOACKPSA-N 382.466 3.815 10 40 GHCB CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc3ccccc23)cc1 408718498 RQAUTEJNUMEGFX-UHFFFAOYSA-N 375.472 3.941 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OC(=O)c4cccc(C)c4)cc3)C(=N)N2O1 41078399 QIRPPSJQYLTOHK-ZXTIBJMCSA-N 387.395 3.665 10 40 GHCB Cc1ccc2nc(CC(=O)c3cccnc3)c(CC(=O)c3cccnc3)nc2c1 1588946 FQLYSGIABAIACI-UHFFFAOYSA-N 382.423 3.579 10 40 GHCB CC(=O)O[C@@H](C)c1cc2c(s1)C(=O)c1scc([C@@H](C)OC(C)=O)c1C2=O 1652351 JFEMGTTXNHRUOR-SFYZADRCSA-N 392.454 3.833 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(n3c(C)ccc3C)C2=O)cc1[N+](=O)[O-] 409197251 ZTWXFDLIPFYKNU-OQLLNIDSSA-N 389.458 3.559 10 40 GHCB CC(C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 408808769 FYQYNPMPLPDOFF-MHWRWJLKSA-N 384.819 3.794 10 40 GHCB C[C@H](NC(=S)Nc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 225838767 XVMJBSWFMBLWPZ-ZDUSSCGKSA-N 377.460 3.849 10 40 GHCB COc1ccc(N2CCN(C(=O)CSCc3ccccc3Cl)CC2)cc1 2964826 CYMPVDJGFGRDOA-UHFFFAOYSA-N 390.936 3.931 10 40 GHCB COC(=O)c1nn(-c2ccc(C)cc2)c(=O)c(/N=N/c2ccc(C)cc2)c1O 98212050 DFCSJTJPUNRYCK-QURGRASLSA-N 378.388 3.757 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c2ccccc12 408842686 BXOXPCGHYXGUMS-LDADJPATSA-N 390.370 3.654 10 40 GHCB CCCCOc1ccc(/C=C2\SC(=S)N(CC(=O)OCC)C2=O)cc1 12635847 WZDSTZZRDVILCQ-PTNGSMBKSA-N 379.503 3.630 10 40 GHCB CC(=O)Oc1cccc(/C=C2\C(=O)N(c3ccc(Cl)c(C(=O)O)c3)N=C2C)c1 5674217 WGYOVYMXBLAQCC-SXGWCWSVSA-N 398.802 3.770 10 40 GHCB CCN(CC)c1ccc(/C=C2/CCc3cnc4n[n+]5c(C)cc(C)nc5n4c32)cc1 103438869 TXIZRLVWBOZBAC-RGEXLXHISA-N 399.522 3.813 10 40 GHCB C[C@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(N2CCC[C@@H](C)C2)cc1 218299039 SLGMRTWJAMPASR-JLHGSKIFSA-N 380.488 3.940 10 40 GHCB CC(=O)N(c1nc(/C=C2\SC(=S)NC2=O)cs1)c1ccc(F)cc1F 15187979 OLRGDPYIDKTIOX-XGICHPGQSA-N 397.453 3.595 10 40 GHCB COc1ccccc1/C=C1/Sc2scc(-c3ccc(O)c(O)c3)[n+]2C1=O 1636464 FUMNPECDLWYZOH-RQZCQDPDSA-O 384.458 3.909 10 40 GHCB CC(=O)Nc1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C)cc1 5174990 CFQNRRPGKGJRAE-UHFFFAOYSA-N 380.473 3.776 10 40 GHCB C[C@H]1Cc2cc(/C=C3\SC(=S)N(CCCCCC(=O)O)C3=O)ccc2O1 16810413 FLHPZLAWEWJMOP-IEMQHYRPSA-N 391.514 3.856 10 40 GHCB CCOc1ccccc1/C=C1/SC(=S)N(NC(=O)c2ccccc2)C1=O 1416562 XFWMYQACXBTPJI-FOWTUZBSSA-N 384.482 3.632 10 40 GHCB Cc1cc(/C=C2/SC(=O)N(CC(=O)O)C2=O)c(C)n1-c1ccccc1Cl 409144781 GQEAQSYWPBRCDJ-OVCLIPMQSA-N 390.848 3.868 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C\c3cccc(F)c3)SC2=S)cc1O 35648697 NDXQYYKPTVIBSI-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2cccc(Cl)c2)C1=O 408867282 KHDCDKJFIOQYBW-RIYZIHGNSA-N 375.211 3.968 10 40 GHCB COC(=O)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 1281917 QTBVGPCNJBUYRR-BOPFTXTBSA-N 399.493 3.640 10 40 GHCB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C\Nc1ccc(Br)cn1 15219954 NYSBNLWCLNJVPJ-ZROIWOOFSA-N 375.201 3.702 10 40 GHCB COc1ccc(N2CCN(CC(=O)c3ccc(Br)s3)CC2)cc1 67206147 IYUCZBILQSUBGD-UHFFFAOYSA-N 395.322 3.524 10 40 GHCB CCCN1C(=O)N/C(=C/c2cc(C)n(-c3ccc(C(=O)OCC)cc3)c2C)C1=O 409246044 DBYYVDFEXWWKKR-CPNJWEJPSA-N 395.459 3.574 10 40 GHCB C[C@@H]1CN2C(=N[C@@H](c3ccccn3)[C@@H]2c2ccc(N3CCOCC3)c(F)c2)S1 222596721 QSKQZWHMIVMZQO-UAOJZALGSA-N 398.507 3.647 10 40 GHCB Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)ccc1F 225608741 AKWMRWUOOQIVNC-OAHLLOKOSA-N 376.497 3.849 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1nccs1 975295 FMPNGEMSWHKMKG-ACCUITESSA-N 389.527 3.763 10 40 GHCB Cc1cc(-c2ccc(/N=N/S(=O)(=O)O)c(C)c2)ccc1/N=N/S(=O)(=O)O 3098189 AFAVIEKHWQNXBF-YTEMWHBBSA-N 398.422 3.743 10 40 GHCB COc1ccc(-c2nn(CN(C)Cc3ccc(N(C)C)cc3)c(=S)[nH]2)cc1 24980451 OADLYWZWPHYGQR-UHFFFAOYSA-N 383.521 3.772 10 40 GHCB Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1C 4747745 SRDVITAISUKQJD-XSFVSMFZSA-N 391.471 3.889 10 40 GHCB O=S(=O)(c1ccc(/N=N/c2ccc(O)c3ccccc23)cc1)N1CCOCC1 5739715 AJBGZTIMGNQWQB-QURGRASLSA-N 397.456 3.982 10 40 GHCB COc1cc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)ccc1O 1244048 QCEMVOFCBJNZBB-FRKPEAEDSA-N 387.438 3.535 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)NC2=S)c1C 409148247 PELSBHBYTMMMTB-GZTJUZNOSA-N 389.480 3.626 10 40 GHCB O=C(O)c1cc(-n2c3c(c4ccccc4c2=O)C(=O)c2ccccc2-3)ccc1O 604406375 UCKBKZBIGSSDJN-UHFFFAOYSA-N 383.359 3.606 10 40 GHCB biogenic COc1ccc2cc(/C=C3\SC(=S)N(Cc4ccco4)C3=O)c(=O)[nH]c2c1 102739397 YZSAEOKVXBMSAR-PXNMLYILSA-N 398.465 3.531 10 40 GHCB CCN1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Cl)cc(OC)c2O)N3)C1 4556399 HOZUUFPYKKEUMS-MRXNPFEDSA-N 393.896 3.923 10 40 GHCB O=C(O)COc1ccc(/C=C2/SC(Nc3cccc(Cl)c3)=NC2=O)cc1 16906616 STQXOJKJWZKLTL-OVCLIPMQSA-N 388.832 3.886 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C/C=C\c3ccccc3)SC2=S)cc1 107678640 FFZVVCVLWLYXHJ-NPFCYVKHSA-N 396.493 3.798 10 40 GHCB CCCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)sc2c1CCCC2 2086583 DLCAKYXPUCYWGE-QWHCGFSZSA-N 391.489 3.799 10 40 GHCB CN(Cc1ccccc1)C(=O)/C(=C\c1ccc(N(C)C)cc1)n1ccccc1=O 199401251 WVVVKXGIRDWLAC-OQKWZONESA-N 387.483 3.571 10 40 GHCB COc1cccc(-c2csc(NS(=O)(=O)c3cc(C)ccc3OC)n2)c1 11615525 GMYRTMJUFUVBDC-UHFFFAOYSA-N 390.486 3.937 10 40 GHCB CCOc1cc(/C=C2/SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)ccc1O 109598465 WXEIMIYTWMKYBV-RQZCQDPDSA-N 398.440 3.880 10 40 GHCB COc1cc(/C=C2\SC(=S)NC2=O)ccc1OCc1cccc(F)c1 107988616 JAJWRIDWQPTWFA-SXGWCWSVSA-N 375.446 3.902 10 40 GHCB COc1cccc(NC(=O)Cn2c(CCC(=O)O)ccc2-c2ccccc2)c1 5000386 FTYDJCLEAIJFAY-UHFFFAOYSA-N 378.428 3.820 10 40 GHCB CCN1C(=O)/C(=C/c2ccc(OCc3ccncc3)c(OC)c2)SC1=S 409329240 CQKUHXJNKZDSAJ-BOPFTXTBSA-N 386.498 3.890 10 40 GHCB C[C@H](NC(=O)[C@H]1COc2ccccc2O1)c1ccc(N2CCC[C@@H](C)C2)cc1 218299146 SLGMRTWJAMPASR-HYFFOGBASA-N 380.488 3.940 10 40 GHCB CCc1ccc(NC2=NC(=O)/C(=C3/C(=O)N(C(C)=O)c4ccccc43)S2)cc1 5373325 FEFPKOXAXOZXPV-ZCXUNETKSA-N 391.452 3.595 10 40 GHCB CN(C)c1ccc([C@H](CNC(=O)c2ccco2)N2CCc3ccccc3C2)cc1 5098792 SDIOKOJNPJJPAF-QFIPXVFZSA-N 389.499 3.875 10 40 GHCB O=C(NCc1ccc(N2CCOCC2)cc1)N(Cc1ccco1)Cc1ccco1 54786479 BBXUFFHELTZNTG-UHFFFAOYSA-N 395.459 3.621 10 40 GHCB COc1cccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 7988926 GTEZTBPBGLHBCP-QFIPXVFZSA-N 382.504 3.512 10 40 GHCB O=C1S/C(=C\c2ccc(N3CCOCC3)c(F)c2)C(=O)N1c1ccccc1 409137078 WGPIADFQDWDSLH-AQTBWJFISA-N 384.432 3.903 10 40 GHCB O=C1/C(=C/c2ccc(Br)cc2)SC(=S)N1C[C@@H]1CCCO1 9188342 OJZYZRWABNIPSQ-OEMOTLHWSA-N 384.320 3.829 10 40 GHCB CC(=O)Oc1ccc2ccc(O)c(CN3CCN(c4ccc(F)cc4)CC3)c2c1 95464577 YDOOFMMHNMAGFE-UHFFFAOYSA-N 394.446 3.932 10 40 GHCB CC(=O)N[C@@H]1C[C@H](c2ccc(O)c(CN3CCCCC3)c2)O[C@@H]2CCCC[C@@H]12 257249657 JJGHYYZQVQVHBJ-KKSHJYNMSA-N 386.536 3.903 10 40 GHCB O=C1/C(=C/c2cnn(Cc3ccccc3)c2)SC(=S)N1c1cccnc1 27121827 KJCNUPTVPIULGG-MFOYZWKCSA-N 378.482 3.732 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 13562477 DGQBUKNIQCGSFH-AQTBWJFISA-N 378.384 3.862 10 40 GHCB C/C(NC[C@@H]1CCCO1)=C1/C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 112120124 MITOPCRTFFUUAJ-RVPSJEOCSA-N 379.435 3.619 10 40 GHCB CCOC(=O)C1=CN(c2ccc(CC)cc2)c2cc(F)ccc2S1(=O)=O 67340726 RLBABCKTYYFGBK-UHFFFAOYSA-N 375.421 3.718 10 40 GHCB O=C1Nc2ccccc2S[C@H]1[C@H]1SC(=S)N(Cc2ccccc2)C1=O 1567430 UVLNNIKGDNAHSD-LSDHHAIUSA-N 386.523 3.529 10 40 GHCB CN1C(=O)/C(=C\c2ccc(Sc3ccc(Cl)cc3)cc2)C(=O)NC1=S 6578472 SYOBQKKXFWRMMM-GDNBJRDFSA-N 388.901 3.748 10 40 GHCB COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 408815189 PQRWAMOOKZMIQA-XNTDXEJSSA-N 384.819 3.632 10 40 GHCB COc1ccc(NC(=S)NCc2ccc(N3CCOCC3)cc2)cc1Cl 225420086 ZEXUGHHBQQJKKU-UHFFFAOYSA-N 391.924 3.672 10 40 GHCB COc1ccc(C[C@H]2SC(=S)N(Cc3cccnc3)C2=O)cc1Cl 6953621 VYDWIFTWWUBZNH-OAHLLOKOSA-N 378.906 3.715 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 29973572 BSILNSMCLQCUHG-UHFFFAOYSA-N 397.884 3.525 10 40 GHCB CC(C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Cl 408803891 ULEKGAUXMKUSIX-XNTDXEJSSA-N 384.819 3.794 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3ccc(O)cc3)C(C(=O)OC)=C2C)cc1 408893984 POXBFQOEBXAMMO-UYRXBGFRSA-N 379.412 3.668 10 40 GHCB O=C1N=C(NC(=O)c2ccccc2)S/C1=C\c1cccc(Br)c1 409127949 DHQFPMGQXVFMIR-UVTDQMKNSA-N 387.258 3.849 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(OC)cc1 2133935 XCFSJLSVPPGVKQ-HKWRFOASSA-N 377.440 3.611 10 40 GHCB biogenic Cc1ccccc1C(=O)NC[C@H](c1ccc2c(c1)CCN2C)N1CCCCC1 13007669 CZXMEJLJCXUJAQ-HSZRJFAPSA-N 377.532 3.944 10 40 GHCB Cc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 27019090 DKEQADXHHYQEDE-AQTBWJFISA-N 396.537 3.903 10 40 GHCB O=C(CCCn1cncn1)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 48364047 YFIVXNDJJMONHM-QHCPKHFHSA-N 386.455 3.823 10 40 GHCB Cc1ccnc(-n2c(C)cc(/C=C3/NC(=O)N(Cc4ccccc4)C3=O)c2C)c1 4675254 RHQSHYCMRJGXDN-DEDYPNTBSA-N 386.455 3.890 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1C 409247358 NFLYXGXBKSMKOB-GXDHUFHOSA-N 384.819 3.632 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCc3cc(F)cc4c3OCOC4)sc2n1 84114816 LHVABUGJQFWPCV-UHFFFAOYSA-N 388.420 3.858 10 40 GHCB CN1C(=O)C(=Cc2ccccc2Oc2ccc(Cl)c(F)c2)C(=O)N(C)C1=O 5659769 JNYSLUXBRAJIRS-UHFFFAOYSA-N 388.782 3.705 10 40 GHCB CC1CCN(C(=O)CCN2C(=O)/C(=C\c3ccccc3F)SC2=S)CC1 4745293 KXMIINBCQZDCLL-FOWTUZBSSA-N 392.521 3.676 10 40 GHCB COC(=O)c1ccc(N/C(C)=C2\C(=O)N(c3ccc(OC)cc3)N=C2C)cc1 100136012 CQBBINNXBUWCBQ-UYRXBGFRSA-N 379.416 3.590 10 40 GHCB Cc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C)c(Cl)c3)C2=O)s1 686749 HUOYRIMDXKBRKL-MDWZMJQESA-N 376.890 3.850 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccc(F)cc1 9263286 RQZAEBNTEOKUMW-LDADJPATSA-N 383.398 3.658 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C\c1cc2ccccc2nc1N1CCOCC1 12585331 CFXGYMDJVATGFD-PGMHBOJBSA-N 398.466 3.878 10 40 GHCB O=Cc1ccc(/C=C2\SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)cc1 5375087 QQMQWCQKOLZYTL-SXGWCWSVSA-N 383.450 3.532 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(I)cc2)SC1=S 4477988 XSRWVUMFQOOZHV-JXMROGBWSA-N 375.256 3.512 10 40 GHCB COc1ccc([C@H]2CC(c3c(C)cc4oc(=O)c5c(c4c3O)CCC5)=NN2)cc1 12296398 QNGRYTQBOXEJHD-QGZVFWFLSA-N 390.439 3.743 10 40 GHCB biogenic CCC1=NN2C(=N)/C(=C/c3ccc(OC(=O)c4ccco4)cc3)C(=O)N=C2S1 4694962 IJOHLTYEFLRHSB-WMQSWVATSA-N 394.412 3.528 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(c2cccc(F)c2)C1=O 409017277 LYGSAJRUTUOFDM-VVBXCHJUSA-N 398.459 3.834 10 40 GHCB Cc1ccccc1NC(=O)COc1ccc(/C=C2/SC(=S)N(C)C2=O)cc1 409333844 DNYYZSBDMLCFBT-GZTJUZNOSA-N 398.509 3.844 10 40 GHCB COC(=O)COc1ccc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc1 409342524 DRGPYVGMMDFICS-BOPFTXTBSA-N 399.493 3.953 10 40 GHCB Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccc(O)cc1 222741455 RJUKDQUEUSVZMB-PMACEKPBSA-N 378.501 3.797 10 40 GHCB C[C@@H](Sc1nccs1)C(=O)N1CC(=O)Nc2cc(C(F)(F)F)ccc21 52914133 CPPWCYXSNSIXKS-MRVPVSSYSA-N 387.408 3.628 10 40 GHCB COc1cc(/C=C2/C(=O)NC(=O)N=C2O)cc(Cl)c1OCc1ccccc1 58822986 KRNUMOMZMUUFPD-UHFFFAOYSA-N 386.791 3.517 10 40 GHCB O=C(NCc1ccc(N2CCSCC2)cc1)c1cccc(OC(F)F)c1 54035664 CURVFPZDLLKJNG-UHFFFAOYSA-N 378.444 3.771 10 40 GHCB COc1cc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc(OC)c1O 987469 OUYFSZNFCWTUFO-MHWRWJLKSA-N 387.482 3.811 10 40 GHCB CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(N(C)C)cc2)n2ncnc2N1 5377899 VYRPHBCGFZLEBY-FQEVSTJZSA-N 388.475 3.580 10 40 GHCB CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 222981014 XWKBEVPQBHOWGT-JOCHJYFZSA-N 382.504 3.818 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/Nc3ccc(Cl)cc3Cl)C2=O)cc1 95471047 XBDCXQZGKOSZOZ-LCYFTJDESA-N 390.226 3.881 10 40 GHCB CCCCOc1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)cc1OCC 5043040 HRALFWLHOVUICC-NBVRZTHBSA-N 390.505 3.567 10 40 GHCB O=C1/C(=C\c2ccccc2)SC(=S)N1CC(=O)N1CCCc2ccccc21 5370666 GBCPFQLDRBHGAV-QGOAFFKASA-N 394.521 3.867 10 40 GHCB CC[C@@H](C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 32765335 QHZWPBHQFHPATF-HSZRJFAPSA-N 395.547 3.517 10 40 GHCB CCOc1ccc(NC(=O)C[C@@H]2SC(=O)N(c3ccc(F)cc3)C2=O)cc1 12136867 GFPNHNIXCQWEFP-INIZCTEOSA-N 388.420 3.822 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 215017314 YKTJIDSMHJKINJ-GZTJUZNOSA-N 383.429 3.897 10 40 GHCB Cc1cccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccc(F)cc32)c1 48988572 VWXLHGMPAXBXBX-UHFFFAOYSA-N 386.448 3.523 10 40 GHCB CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NCCc1ccc(O)cc1 100423046 BOJTVQOQSFIEOH-UYRXBGFRSA-N 392.484 3.831 10 40 GHCB CC1(C)Cc2cc(CNCc3ccc(N4CCC(O)CC4)c(F)c3)ccc2O1 105422657 CVZQPGTVUTYTEV-UHFFFAOYSA-N 384.495 3.790 10 40 GHCB CC(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 7990508 YKTVOLMTDSRYDA-JOCHJYFZSA-N 395.503 3.532 10 40 GHCB O=C(O)c1cccc(N2N=C(c3ccccc3)/C(=C/c3ccccc3O)C2=O)c1 5773968 ZCMOOXDWKBBVNF-RGEXLXHISA-N 384.391 3.925 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccc(O)c1 408851273 XCQTXMIQBDFIDU-DHZHZOJOSA-N 393.251 3.530 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(O)c(OC)c1 408770077 SKSQKCZAIFHDBW-BOPFTXTBSA-N 379.412 3.586 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc(O)c(OC)c3)S2)c(OC)c1 35043446 QGOSEDOXBHCAPC-RQZCQDPDSA-N 386.429 3.500 10 40 GHCB c1cc(N2CCCC2)ccc1CN1CCCN(c2ccc3c(c2)OCCO3)CC1 57740012 CRWRYTFNKGMMOM-UHFFFAOYSA-N 393.531 3.770 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)Nc1ccccc1Cl 112121457 XDXQEEGLIKGPAV-UYRXBGFRSA-N 383.835 3.992 10 40 GHCB CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1 408990755 YLQKPAKVOZJJIU-YBEGLDIGSA-N 384.819 3.714 10 40 GHCB Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\Nc3ccccc3Cl)C2=O)c(C)c1 408532929 NCGJSPJKLWLBIX-GXDHUFHOSA-N 383.835 3.844 10 40 GHCB CCCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 5713248 QXTCUBFINFYHFR-NBVRZTHBSA-N 378.428 3.840 10 40 GHCB CCCc1cc2c(=O)c(-c3ccc4c(c3)OCO4)coc2c(CN(C)C)c1O 941923 KJHRDNNKNHKYDW-UHFFFAOYSA-N 381.428 3.908 10 40 GHCB biogenic CCOC(=O)c1ccc(-n2c(C)cc(/C=C3/SC(=S)NC3=O)c2C)cc1 13785961 MZCRRZKRFBYGSA-MHWRWJLKSA-N 386.498 3.760 10 40 GHCB CN(C)c1ccc(CN(CCCn2ccnc2)Cc2ccc3c(c2)CCO3)cc1 36740213 QUFZXXSYOAMLFV-UHFFFAOYSA-N 390.531 3.977 10 40 GHCB CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2\SC(=S)NC2=O)cs1 7155228 GHHAYTOMNTZSAQ-AUWJEWJLSA-N 389.527 3.933 10 40 GHCB COc1ccc(Cc2cc(O)n3ncc(C(=O)Nc4ccc(C)cc4)c3n2)cc1 19210713 IOGPXKRZOSYEST-UHFFFAOYSA-N 388.427 3.595 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S 5371411 BZLYZMREXKUJIT-DYTQJMLRSA-N 395.502 3.548 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)c2C)c1 32449230 PUYRHKLZLUUHIF-UHFFFAOYSA-N 376.416 3.525 10 40 GHCB Cc1ccccc1NC(=O)c1cc2ccccc2c(CN2CCOCC2)c1O 32751068 ZVTHPUXBIBGTKJ-UHFFFAOYSA-N 376.456 3.938 10 40 GHCB COc1ccccc1[C@@H]1CC(c2c(C)cc3oc(=O)c(C)c(C)c3c2O)=NN1 12321720 TXYLTMWFXLNDPD-HNNXBMFYSA-N 378.428 3.871 10 40 GHCB O=C(CSCc1cccc(Cl)c1)NCc1ccc(N2CCOCC2)cc1 10113293 BDTRMOOPRKRUCZ-UHFFFAOYSA-N 390.936 3.726 10 40 GHCB CCOc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1Br 4501765 BZWCWPBHPKKZKQ-UHFFFAOYSA-N 395.249 3.992 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(c3ccc(Cl)cc3)C2=O)ccc1N1CCOCC1 409245715 YAXYRNMSPOHESR-QGOAFFKASA-N 397.862 3.582 10 40 GHCB O=C(NC1(Nc2ccccc2)C(=O)c2ccccc2C1=O)c1cccc(Cl)c1 226297857 HQWJBDJKRPPMLK-UHFFFAOYSA-N 390.826 3.957 10 40 GHCB COc1ccc(CN2CCC[C@H](c3cc(=O)[nH]c(-c4cccs4)n3)C2)c(O)c1 19551830 QVLFRRSQGWWRLB-AWEZNQCLSA-N 397.500 3.592 10 40 GHCB COc1ccc(N2CCCN(C[C@H](O)c3ccc(C(F)(F)F)cc3)CC2)cc1 51473623 HIMZRBGZZPIVCU-FQEVSTJZSA-N 394.437 3.960 10 40 GHCB CCCn1cc(/C=C2\C(=O)NC(=S)N(c3ccccc3)C2=O)c2ccccc21 13511719 YRQRKGYFTDOUBV-QGOAFFKASA-N 389.480 3.883 10 40 GHCB COc1cc(N2CCCCC2)ccc1/C=C1/NC(=O)N(Cc2ccccc2)C1=O 409251825 QIVYAWAOIXUASR-XSFVSMFZSA-N 391.471 3.778 10 40 GHCB S=C(NCc1ccc(N2CCCCC2)cc1)Nc1ccc2c(c1)OCCO2 225416928 ZSMKGUVPQPUEEV-UHFFFAOYSA-N 383.517 3.935 10 40 GHCB O=C1N=C(O)/C(=C\c2cc(Br)ccc2O)C(=O)N1c1ccccc1 83327281 GBKQFELQILHTFL-UKTHLTGXSA-N 387.189 3.661 10 40 GHCB COC(=O)C1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)CC1 57788802 PBVZSLCRLUNFEK-UHFFFAOYSA-N 394.515 3.651 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 8777018 UGHUHNRODOAMSQ-UHFFFAOYSA-N 396.491 3.536 10 40 GHCB Cc1ccc(CN2C(=O)/C(=C/c3ccc(OCC(=O)O)cc3)SC2=S)cc1 16292339 WBGHARRTSCZLOA-YVLHZVERSA-N 399.493 3.860 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1C(=O)O 409071711 PFHSFXYZJIFXJL-PTNGSMBKSA-N 397.814 3.915 10 40 GHCB CCOC(=O)c1ccc(N2C(=O)/C(=C\c3ccccc3)C(C(=O)OC)=C2C)cc1 409018340 UODICGPAZXNJMG-RGEXLXHISA-N 391.423 3.741 10 40 GHCB COc1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCCCC2)cc1 225611828 AFMPKMDQSOYRLM-UHFFFAOYSA-N 394.924 3.817 10 40 GHCB CCOc1cc(/C=C2\SC(=S)NC2=O)ccc1OC(=O)c1ccccc1 4838777 RRSQNBSAITWQGB-WJDWOHSUSA-N 385.466 3.793 10 40 GHCB Cc1cc(/C=C2/C(=O)N(C3CCCCC3)C(=O)N=C2O)c(C)n1C[C@@H]1CCCO1 59109234 YPYRTFIMKLXAEV-LPGQDOADSA-N 399.491 3.919 10 40 GHCB CC1=NN(c2nnn[nH]2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2Cl)o1 102653656 NJBKCFLXUVWCAM-KPKJPENVSA-N 389.202 3.573 10 40 GHCB CCC1(CC)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3F)c2C)C1=O 23656643 VCYSYUFMNBHUMD-UHFFFAOYSA-N 385.439 3.527 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(OC(C)C)cc2)C1=O 408874616 CODVRRVYIRCPOV-AQTBWJFISA-N 378.428 3.703 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1Cl 408786243 MXDQJDKNHCKFRN-XNTDXEJSSA-N 384.819 3.714 10 40 GHCB CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1 641347 ARXUYRBPDVWNPL-FQEVSTJZSA-N 394.544 3.801 10 40 GHCB Cc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)s1 409249998 VQZYGQWYBJRIEV-MDWZMJQESA-N 396.415 3.907 10 40 GHCB O=C(O)CCc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1 8104350 KEMGZFOTQJYFCA-UHFFFAOYSA-N 388.470 3.628 10 40 GHCB CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)c1 408867389 KQKJQRSKJAWOOG-WOJGMQOQSA-N 398.846 3.968 10 40 GHCB COC(=O)c1ccc(Cn2cc(/C=C3/SC(=S)NC3=O)c3ccccc32)o1 409390007 DDNLZRDHFPICRI-LZYBPNLTSA-N 398.465 3.558 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N(c2ccc(C(=O)O)c(O)c2)C1=O 32707945 PMZQLQGQIFIKPD-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB COc1ccc(NC(=O)CSc2ncc(-c3ccc(OC)cc3)n2C)cc1 7423545 ARMBFPJZIBZZAV-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB CCN1CCN([C@@H](c2ccccn2)c2cc(Cl)c3cccnc3c2O)CC1 22860761 VVUDRIJJENVYNV-HXUWFJFHSA-N 382.895 3.716 10 40 GHCB COc1ccc(N2CCN(CC(=O)c3c[nH]c4ccc(C)cc34)C[C@@H]2C)cc1 2224493 ZEIMRPMNCPVADE-KRWDZBQOSA-N 377.488 3.878 10 40 GHCB COc1cc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc(OC)c1OC 13714156 JCUHLNOOAKCLKT-DHDCSXOGSA-N 391.470 3.707 10 40 GHCB O=C1c2ccccc2C(=O)c2c1c(C(=O)NCc1ccccc1)c1ccccn21 13732528 FUGGXQQESYGZJI-UHFFFAOYSA-N 380.403 3.645 10 40 GHCB C[C@H](NC(=O)NCC1(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 68479595 ZHJLHNCMCKUJFN-SFHVURJKSA-N 379.504 3.615 10 40 GHCB CCOC(=O)c1c(-c2ccccc2)oc2ccc(O)c(CN3CCN(C)CC3)c12 19789447 JXOJPBJBHDCLFP-UHFFFAOYSA-N 394.471 3.730 10 40 GHCB biogenic Cc1cc2oc(=O)cc(C)c2c(O)c1C1=NN[C@@H](c2ccc(N(C)C)cc2)C1 12296425 LIURVZZZOFUGCO-MRXNPFEDSA-N 377.444 3.620 10 40 GHCB biogenic Cc1cc(C)cc(OS(=O)(=O)c2cccc3c2C(=O)c2ccccc2C3=O)c1 5234106 PTEIVJJKLQSFCN-UHFFFAOYSA-N 392.432 3.847 10 40 GHCB Cc1csc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 6510321 SLECUPIIKBUAOA-UHFFFAOYSA-N 394.477 3.958 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)c(OCC)c1 409076746 CCPFBWHUAKNPLO-DISPHTKASA-N 393.530 3.864 10 40 GHCB CCN(CC)c1ccc(/C=c2/sc3nnc(-c4ccc(C)cc4)n3c2=O)cc1 1199176 PNCQPGNSQYOCGR-XMHGGMMESA-N 390.512 3.520 10 40 GHCB C[C@@H]1CCCC[C@]12NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 23653296 UQEQEIIUUFHENS-JPYJTQIMSA-N 398.551 3.567 10 40 GHCB COc1ccccc1Oc1ccc(N2C(=O)c3ccc(C(=O)O)cc3C2=O)cc1 6249132 FZLJAKPAOYQENM-UHFFFAOYSA-N 389.363 3.986 10 40 GHCB CCCCc1ccc(-n2c(C)cc(C=C3C(=O)N(C)C(=O)N(C)C3=O)c2C)cc1 408997777 SUWWKJNVKFKFNE-UHFFFAOYSA-N 393.487 3.871 10 40 GHCB CCN1C(=O)/C(=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)SC1=S 409370300 OJNLQTRRUZDBNW-ATVHPVEESA-N 398.509 3.925 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)CCc3ccccc3)N3CCCCC3)ccc21 13007734 NDUQMWFUUHVYRR-XMMPIXPASA-N 391.559 3.955 10 40 GHCB COc1ccc(-c2ccc(CCC(=O)O)n2CC(=O)Nc2ccccc2)cc1 14153053 LUUQIMJARHCRLQ-UHFFFAOYSA-N 378.428 3.820 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1Cl 409011729 IFKRWGYULXMEGE-MRACZJACSA-N 385.894 3.803 10 40 GHCB CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(O)c(O)c2)c2c(C)n[nH]c2N1 72332687 HTTCYNACRGLMIY-LJQANCHMSA-N 376.416 3.599 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OC)cc2OC)SC1=S 5371365 XTWYRRIJMBWDTD-MLJKTZRHSA-N 395.502 3.548 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 408895064 SXYUXRQTPJLQPM-PDGQHHTCSA-N 378.384 3.780 10 40 GHCB C[C@@H]1CN2C(=N[C@H](c3ccccn3)[C@@H]2c2ccc(N3CCOCC3)c(F)c2)S1 222596852 QSKQZWHMIVMZQO-XMCHAPAWSA-N 398.507 3.647 10 40 GHCB Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCC(C)(C)N2CCOCC2)c1 24928449 SWRVERIUTQOUJE-UHFFFAOYSA-N 389.927 3.588 10 40 GHCB COc1cccc(N2C(=O)/C(=C\c3cn(C)c4ccccc34)C(O)=NC2=S)c1 2277815 AISIGWPPWNAELV-YVLHZVERSA-N 391.452 3.859 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(Cc3ccccc3)C2=O)c(C)n1C1CCCC1 17299985 NYIVNNBOJCGRQK-DEDYPNTBSA-N 391.471 3.882 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(F)c2)C1=O 408913161 SVOUARLHFGFVKL-HNEYUBDGSA-N 382.391 3.669 10 40 GHCB CCN(CC)c1ccc(CN2CC[C@H]3[C@@H]2CC(=O)N3Cc2c(C)noc2C)cc1 2056226476 SBIXDZPXMKGNST-VXKWHMMOSA-N 396.535 3.513 10 40 GHCB CN(C)c1ccc(CNC(=O)c2nccnc2-c2nc3ccccc3s2)cc1 15832785 PUMZHPAZINTYOZ-UHFFFAOYSA-N 389.484 3.749 10 40 GHCB Cc1cc(C(=O)CSc2ncc(-c3ccccc3)n2C)c(C)n1-c1nnc[nH]1 8344313 BLACAMYLAAEHFT-UHFFFAOYSA-N 392.488 3.588 10 40 GHCB O=C1/C(=C\c2ccc3ccccc3c2)SC(=S)N1CCCN1CCOCC1 96930802 HNSYUEQDXWPHBL-XDJHFCHBSA-N 398.553 3.763 10 40 GHCB Cc1cc(OCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1Cl 12555737 XRZUWLVNVMTZLE-UHFFFAOYSA-N 388.895 3.522 10 40 GHCB CC1=NN(c2nnn[nH]2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2Cl)o1 102570567 CPTKRDAXBDAYQM-YRNVUSSQSA-N 389.202 3.573 10 40 GHCB COc1ccc(N2CCN(CC(=O)Nc3c(C)ccc4ccccc34)CC2)cc1 57579754 DBFRUGCJXBYWIR-UHFFFAOYSA-N 389.499 3.918 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3)CC2)S/C1=C\c1c[nH]c2ccccc12 6719215 HOLKJNBUCBJQDT-ZHZULCJRSA-N 388.496 3.960 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3cc(C)cc(C)c3)C2=O)c1C 409014032 OOWHOCUCVRQBTK-WOJGMQOQSA-N 381.501 3.573 10 40 GHCB COC(=O)COc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1 409341310 BCVNSCZIZGNGAN-GZTJUZNOSA-N 399.493 3.953 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C\c2ccc3c(c2)n(C)c(=O)n3C)SC1=S 409347418 PXNGCABAEVIJBB-GZTJUZNOSA-N 395.509 3.591 10 40 GHCB CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1OC(C)(C)C 108986057 IIYYAQXPHIFPJV-LGMDPLHJSA-N 380.444 3.724 10 40 GHCB O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1cc(Cl)c(O)c(Cl)c1 408911626 AEAOOSLBSCNWSH-NYYWCZLTSA-N 395.173 3.505 10 40 GHCB O=S(=O)(Nc1ccc(Cl)c(C(F)(F)F)c1)c1cccc2nonc12 5677791 FBYIADKVBGZDGW-UHFFFAOYSA-N 377.731 3.696 10 40 GHCB CN1C(=O)/C(=C\c2ccc(OCc3ccc4c(c3)OCO4)cc2)SC1=S 15012131 GJXYWIYKPNOXJB-RQZCQDPDSA-N 385.466 3.825 10 40 GHCB COc1ccccc1NC(=O)COC(=O)c1ccc(-n2c(C)ccc2C)cc1 5643862 GOJWBIZBTDJUGU-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccn3)C2=O)cc1 17373749 WWKPVMLLNAWGCL-NTCAYCPXSA-N 383.498 3.620 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C/c3ccccc3Br)C2=O)c1 4471732 PNDRXYBXQGFGIG-GDNBJRDFSA-N 399.244 3.732 10 40 GHCB CC(C)(C)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 54285081 WNUSFQGLKBEUFN-UHFFFAOYSA-N 382.504 3.516 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cc([N+](=O)[O-])ccc3Cl)C2=O)c1 59426647 JXYWFCPOWIBUGW-OQLLNIDSSA-N 399.790 3.531 10 40 GHCB COc1ccc2c(c1)c(=O)oc1c(C)c(OCC(=O)N3CCC[C@@H](C)C3)ccc12 4540360 PPLAJPOKTUCMSU-CQSZACIVSA-N 395.455 3.901 10 40 GHCB COc1cc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)cc(OC)c1O 33314205 XLPYZMNYHCKQDW-GDNBJRDFSA-N 379.503 3.943 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)cc1 12504545 QBMFDYUYKLOXHK-QINSGFPZSA-N 379.503 3.932 10 40 GHCB O=C1/C(=C/c2ccccc2N2CCOCC2)SC(=S)N1c1ccccc1 208678003 FGXURVGZMIMPSJ-JXAWBTAJSA-N 382.510 3.929 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc(O)cc1 2302514 KKMKLEKTAPBYFP-UVTDQMKNSA-N 390.511 3.684 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\c3ccc(OCC(N)=O)cc3)SC2=S)c(C)c1 409203196 WNIAPCZUXYIVAI-LICLKQGHSA-N 398.509 3.573 10 40 GHCB COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1 4342043 KBMJIKKXRPGGPQ-GDNBJRDFSA-N 399.449 3.577 10 40 GHCB Cc1cc(C(=O)[C@@H](C)N2CCC(C(N)=O)CC2)c(C)n1-c1ccc(Cl)cc1 57873189 CVRJLVNECLLUMP-OAHLLOKOSA-N 387.911 3.516 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(F)c3)C2=O)cc1 409022288 MBDACTLCMVNFDC-VBEHJTROSA-N 398.459 3.834 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 1281935 IGVIBAJPLLIKGO-MFVBVHDHSA-N 399.493 3.940 10 40 GHCB CCCC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(\C)NCCc1c[nH]cn1 13549418 CUVBLZQQQFFQDE-QGOAFFKASA-N 394.504 3.628 10 40 GHCB CCOc1ccccc1C(=O)NC[C@@H](c1ccc2c(c1)CCN2C)N1CCCC1 8963227 HEYLJOHIYCXWLO-QFIPXVFZSA-N 393.531 3.645 10 40 GHCB O=C1NC(=S)N=C(O)/C1=C\c1cc(Cl)ccc1OCc1ccccc1F 58823018 SKOCHXKGZSUFPT-UHFFFAOYSA-N 390.823 3.813 10 40 GHCB CCOc1ccc(/C=C2/C(=O)N(C(=O)c3ccccc3)N=C2C)cc1OCC 408940828 VGPFALMNKNLVBA-QGOAFFKASA-N 378.428 3.926 10 40 GHCB COc1ccc(OC)c(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)c1 196028230 UWSBAGSVUGOFOQ-UHFFFAOYSA-N 397.452 3.736 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCc2ccc(N3CCCC3)cc2)c1 225424787 SYOBKUWZWNKQGJ-UHFFFAOYSA-N 383.517 3.950 10 40 GHCB CCOC(=O)NCCC(=O)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 48678477 PEWDFMWXNORKML-JOCHJYFZSA-N 392.455 3.887 10 40 GHCB O=C1/C(=C\c2ccc(-c3ccccc3F)o2)SC(=S)N1N1CCOCC1 5032685 TZBOMEYBGINIRV-LFIBNONCSA-N 390.461 3.534 10 40 GHCB Cc1cc(C(=O)Nc2ccc(-c3noc(=O)[nH]3)cc2)c(C)n1-c1ccccc1F 65553086 ZRRYISAENZRATB-UHFFFAOYSA-N 392.390 3.829 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(C)c3C)C2=O)o1 204986893 WHBRLHOEMIDRNX-FOWTUZBSSA-N 397.500 3.574 10 40 GHCB COc1ccc(CCN/C(C)=C2\C(=O)N(c3ccc(OC)cc3)N=C2C)cc1 103916356 PGCFQFVJFALRCZ-QNGOZBTKSA-N 379.460 3.533 10 40 GHCB Cc1cc(C(=O)CSc2nnnn2Cc2ccco2)c(C)n1-c1ccccc1 11306895 SBPSFRRDFVIRMG-UHFFFAOYSA-N 393.472 3.697 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CN3CCN(c4ccccc4)CC3)C2=O)o1 20065768 FVEKAMLLNWHURM-QGOAFFKASA-N 399.541 3.569 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1 59426655 XKBAIFWKCYCLHO-XSFVSMFZSA-N 391.471 3.816 10 40 GHCB Cc1ccc(S(=O)(=O)NN2C(=O)S/C(=C/c3ccccc3)C2=S)cc1 5171675 OIWPCPFHCJFEGU-RVDMUPIBSA-N 390.511 3.726 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1Br)OCO2 20244056 YXUYKPDJXGIDHZ-VGOFMYFVSA-N 385.217 3.984 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O 408959585 BLMDIJIUFVDQHN-XMHGGMMESA-N 389.455 3.570 10 40 GHCB Cc1ccc(CN2C(=O)/C(=C/c3ccccc3OCC(=O)O)SC2=S)cc1 409055519 ZCEVPGAAKWAAGG-YVLHZVERSA-N 399.493 3.860 10 40 GHCB CCc1ccc(O[C@H](CC)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 222878214 LQIBRPYAZCBLBW-JOCHJYFZSA-N 382.504 3.764 10 40 GHCB CC1=CC(C)(C)N(C(C)C)c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc21 223491887 RFGCJLWCLZQRTM-UHFFFAOYSA-N 397.544 3.696 10 40 GHCB CCN(Cc1cncn1C)c1ccc(OCCOc2ccccc2OC)cc1 14000299 MTLXHSZHMCBOCG-UHFFFAOYSA-N 381.476 3.913 10 40 GHCB COc1ccc(N2CCN(C(=O)CCN3CCC[C@@H]3c3cccs3)CC2)cc1 32776737 KGORLXXBJLBCGE-HXUWFJFHSA-N 399.560 3.633 10 40 GHCB Cc1ccccc1OCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 6747936 DBOUJQPVDFSXEE-NRFANRHFSA-N 382.504 3.648 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(C(F)(F)F)c1 12564207 FPUXIVFXWFOALK-UHFFFAOYSA-N 378.394 3.814 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(Cl)s1 408967140 QATMUFNVKQJIPK-YRNVUSSQSA-N 383.281 3.886 10 40 GHCB C[C@H]1CN(C2=NC(=O)/C(=C/c3cccc(Br)c3)S2)C[C@@H](C)O1 1184382 LLFMTYDCNKDIDJ-FGLUKDLVSA-N 381.295 3.529 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\NC(=O)N(Cc2ccc(F)cc2)C1=O 16282052 ZMAXJXMAVBXTPW-MOSHPQCFSA-N 379.435 3.827 10 40 GHCB COc1cccc(CN2CCC[C@H](c3nnsc3-c3cc(C)no3)C2)c1O 19120788 WUVPMGKUPJHDIY-ZDUSSCGKSA-N 386.477 3.595 10 40 GHCB COc1ccc([C@]2(O)CN(c3cc(C)ccc3C)C3=[N+]2CCCS3)c(F)c1 2965853 NWCJKZDJELDKPF-OAQYLSRUSA-N 387.500 3.622 10 40 GHCB Cc1ccsc1/C=C1\SC(N2CCN(c3ccccc3F)CC2)=NC1=O 9189259 QPCGAPPBXMAHEC-ATVHPVEESA-N 387.505 3.988 10 40 GHCB O=C(OCc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 3220241 MOOSGGCYTIBLFY-UHFFFAOYSA-N 389.454 3.612 10 40 GHCB CCOc1ccc(/C=C2\SC(NC(=O)c3ccccc3)=NC2=O)c(OCC)c1 409137747 XMOFTTCWJOFCTH-PDGQHHTCSA-N 396.468 3.884 10 40 GHCB CCC[C@@H](NCc1c(C)cc2oc(=O)cc(-c3ccccc3)c2c1O)C(=O)O 4540336 MIAYPQQSTPAUKY-QGZVFWFLSA-N 381.428 3.817 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(C)cc3Cl)CC2)c([N+](=O)[O-])c1 33621682 YVWVDKLVTNKHRT-UHFFFAOYSA-N 389.839 3.528 10 40 GHCB Cc1ccc(COc2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)cc1 1476369 QIVMWZQWLBIQQQ-YVLHZVERSA-N 399.493 3.860 10 40 GHCB Cc1cc(/C=C2/C(=O)N=C(O)N(c3cccc(Cl)c3Cl)C2=O)c(C)n1C 13810248 GMJSEXYFGNBLAV-WQLSENKSSA-N 392.242 3.820 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)NC2=S)c1C 409134749 TXIVVYDRCKCVPY-LDADJPATSA-N 394.496 3.922 10 40 GHCB CC1=NN2C(=N)/C(=C/c3cc(C)n(-c4ccccc4F)c3C)C(=O)N=C2S1 34808504 FCMZKFOPNDJIHF-PBGDOYKQSA-N 381.436 3.872 10 40 GHCB CCN(CC)CCCN1C(=O)/C(=C/c2cccc(OC)c2OC)SC1=S 2335237 KXUVLLKVRYSEGF-SSZFMOIBSA-N 394.562 3.637 10 40 GHCB CCOc1ccccc1N1C[C@](O)(c2ccc(Cl)cc2)[N+]2=C1SCCC2 27525057 QNRSUCKWUAMJBI-FQEVSTJZSA-N 389.928 3.909 10 40 GHCB CC[C@@H](Oc1cc(C)ccc1C)C(=O)NCc1ccc(N2CCOCC2)cc1 20460366 YYIDAQNZPQUQPW-OAQYLSRUSA-N 382.504 3.614 10 40 GHCB C[C@H](NC(=O)c1cc(-c2cccc(F)c2)no1)c1ccc(N2CCOCC2)cc1 19718149 OEHBWWCBEREEFJ-HNNXBMFYSA-N 395.434 3.808 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)NCc3ccc(F)cc3)n2C)cc1 7423583 RAYZDCNFZGFCCG-UHFFFAOYSA-N 385.464 3.643 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)cc3C)C2=O)c1 408959874 HGQRESJLMBULBX-XSFVSMFZSA-N 389.455 3.570 10 40 GHCB O=c1c2ccc(Cl)cc2nc2n1CC/C2=C/c1ccc(N2CCOCC2)cc1 96759075 QLLURSNOTBEGAO-SSZFMOIBSA-N 393.874 3.831 10 40 GHCB CCN1CCN(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)CC1 22580414 GGNHHANYKZMQAA-UHFFFAOYSA-N 393.453 3.933 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1nccs1 1746235 GJMPMDPGHXRWLZ-LUAWRHEFSA-N 395.556 3.825 10 40 GHCB CC1=NN(C(=O)c2ccncc2)C(=O)[C@H]1/N=N\c1ccc(-c2ccc(N)cc2)cc1 104204177 PVPHEEWBXNVLGB-DDJBQFQUSA-N 398.426 3.842 10 40 GHCB Cc1cc(C(=O)Nc2ccc(OCCC(N)=O)cc2)c(C)n1-c1cccc(F)c1 58280335 HPJFPMOFJYVUNK-UHFFFAOYSA-N 395.434 3.740 10 40 GHCB CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccc(O)c(Br)c1 408936592 GVIOOPDQRAQSOL-NTEUORMPSA-N 385.217 3.597 10 40 GHCB CCOC(=O)C1=C(C)Nc2nc3ccccc3n2[C@H]1c1ccc(N(C)C)cc1 4741593 LUVXYSQSPZEDJH-FQEVSTJZSA-N 376.460 3.954 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(C)C2=O)c(C)n1-c1ccc(-c2ccccc2)cc1 409000354 YQZSVJBJCKTALO-KGENOOAVSA-N 399.450 3.853 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 408996364 DFEUGJKDHZGUQU-ZHZULCJRSA-N 392.455 3.638 10 40 GHCB O=C1OC2(CCCC2)OC(=O)C1=Cc1cc(Br)cc(Cl)c1O 58865910 IEHYVFAMAAQOOV-UHFFFAOYSA-N 387.613 3.562 10 40 GHCB COc1ccc([C@H]2CC(c3cc(Br)ccc3O)=NN2C(C)=O)cc1 97104970 PWARDDMHUPFRJP-QGZVFWFLSA-N 389.249 3.861 10 40 GHCB O=C1[C@H](Cc2ccc3c(c2)OCO3)SC(=S)N1CCCc1ccccc1 409160369 HFZQPTDCPNOISM-SFHVURJKSA-N 385.510 3.820 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 408961488 MPPGASYRLHNXPU-GFJWLWTISA-N 382.803 3.571 10 40 GHCB CC[C@H](Oc1ccc(C)cc1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 222950983 QTHVREXGHUSHEY-NRFANRHFSA-N 382.504 3.818 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S 5372279 NMCSLMCZSUMVJB-XFNCEPBJSA-N 379.503 3.930 10 40 GHCB COc1ccc(N2CCN(C[C@@H](O)COc3ccc(C(C)C)c(C)c3)CC2)cc1 1473490 AFKBSDYACHVHEH-OAQYLSRUSA-N 398.547 3.689 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccccc3F)s2)SC1=S 24751521 WVVWZXRTOQJJFD-NTUHNPAUSA-N 379.459 3.840 10 40 GHCB COc1cc(Cl)cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)c1O 34138242 NGHWYJPHWGOZDV-RIYZIHGNSA-N 386.791 3.869 10 40 GHCB C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCCc2cc(OC(F)F)ccc21 89553113 QSLDDXPMLMXCPQ-LBPRGKRZSA-N 390.386 3.797 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(CC(=O)Nc3ccc(C)cc3)C2=O)cc1 4839231 BHUABTMOOHVZEO-GZTJUZNOSA-N 398.509 3.844 10 40 GHCB CCNC(=O)COc1cccc(NC(=O)c2sccc2-n2c(C)ccc2C)c1 48249019 VYKKZBVJJXJHIB-UHFFFAOYSA-N 397.500 3.923 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/Nc3cc(Cl)ccc3C)C2=O)c(C)c1 17198552 QMAOYJISILWJKJ-GDNBJRDFSA-N 383.835 3.844 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(OC)c1 409233451 SGPFFZRISQYZAG-DEDYPNTBSA-N 393.487 3.943 10 40 GHCB Cc1cc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)c(C)n1-c1cccnc1 409093276 YNCXHQUWPXDLRZ-PGLQMZEQSA-N 399.541 3.869 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408998923 JJXUNYWMRUTCJD-PTNGSMBKSA-N 397.402 3.720 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)Nc1ccc(C)cc1C 112119873 UNBGJOGDTMLAPW-PGMHBOJBSA-N 377.444 3.955 10 40 GHCB CCOc1cc(/C=C2/C(=O)N(C(=O)c3ccccc3)N=C2C)cc(Cl)c1O 408937331 IVAQAFSJZKBGCH-OQLLNIDSSA-N 384.819 3.886 10 40 GHCB CCCC[C@H](NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12)C(=O)O 2132695 BFMLXWKWRCWUGE-SFHVURJKSA-N 381.428 3.899 10 40 GHCB biogenic Cc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3ccc(O)cc3)C2=O)cc1 13603312 VJHBEVIMNGUWCZ-YBEGLDIGSA-N 384.482 3.541 10 40 GHCB COc1ccc(-n2c(O)c(/N=N/c3cccc4ccccc34)c(=O)[nH]c2=O)cc1 4657343 HCOBGICBUPMEEQ-WCWDXBQESA-N 388.383 3.809 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)NC2=S)c(C)c1 409137676 XWBHJKQPGIPZIS-MHWRWJLKSA-N 375.453 3.616 10 40 GHCB Cc1cc(C(=O)N2CCCN(C)CC2)c(C)n1-c1ccc(Br)cc1 97024607 ZNFRNXGICOBWSO-UHFFFAOYSA-N 390.325 3.634 10 40 GHCB O=C1N=C(NC(=O)c2ccccc2)S/C1=C\c1ccc(N2CCCC2)cc1 409122984 DBMSYESAGJWMJS-JXAWBTAJSA-N 377.469 3.687 10 40 GHCB Nc1nc(N)c(/N=N/c2ccccc2)cc1/N=N\c1ccc(S(N)(=O)=O)cc1 104090853 BBTGLPAPGOMLPD-KUXGFVDGSA-N 396.436 3.724 10 40 GHCB COC(=O)c1ccc([C@H](c2c(O)ccc3ccccc23)N2CCOCC2)cc1 25561815 YMCQRYCRSDWBJA-JOCHJYFZSA-N 377.440 3.754 10 40 GHCB CCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)O)C2=O)cc1OCC 3299733 DTAZJCJWXBHMBP-RVDMUPIBSA-N 395.502 3.550 10 40 GHCB Cc1cc(C(=O)COC(=O)Cc2ccsc2)c(C)n1-c1ccc2c(c1)OCO2 6360281 HAXAIAJEMRVYCL-UHFFFAOYSA-N 397.452 3.853 10 40 GHCB Cc1cc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c(C)n1-c1ccccc1 6590587 LOWQTASQRISBQC-UHFFFAOYSA-N 393.399 3.798 10 40 GHCB CCN1CCN(Cc2c(O)ccc3c(=O)c(-c4ccccc4Cl)coc23)CC1 19791566 TZDKJEVRXAMMGI-UHFFFAOYSA-N 398.890 3.957 10 40 GHCB biogenic CCOc1ccccc1/C=C1\C(=O)NC(=S)N(c2cccc(C)c2C)C1=O 409124322 BAEAZGJSVLYXDC-FOWTUZBSSA-N 380.469 3.533 10 40 GHCB O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)N1CCCCC1 5370858 QFLMSERGSXIXSU-RMTJHLMQSA-N 386.542 3.847 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)Nc3cccc(OC)c3)n2C)cc1 881702 OCTRLPXVIPMDSD-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB CN1C(=O)C(=Cc2ccc(Sc3ccc(Cl)cc3)o2)C(=O)N(C)C1=O 1093725 CGVBZLZDFJIJJV-UHFFFAOYSA-N 376.821 3.518 10 40 GHCB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2)C1=O 4457096 JEWXWNNYVNMTQJ-INQVIGDZSA-N 388.489 3.665 10 40 GHCB CCCN1C(=O)/C(=C/c2ccc(N(C)C)cc2)C(=O)N(c2ccccc2)C1=S 409022435 NULDLRWYUVIRIV-CYVLTUHYSA-N 393.512 3.706 10 40 GHCB CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(OC)c(C)c2C)cc1 224820766 XNJXABUTRCBICL-UHFFFAOYSA-N 376.522 3.637 10 40 GHCB COc1ccc(N2CCN(C(=O)c3csc(-c4ccccc4)n3)CC2)cc1 12556299 CVMRUJHZBPISIA-UHFFFAOYSA-N 379.485 3.781 10 40 GHCB COc1ccc(C[C@@H]2SC(=S)N(Cc3cccnc3)C2=O)cc1Cl 6953625 VYDWIFTWWUBZNH-HNNXBMFYSA-N 378.906 3.715 10 40 GHCB COc1ccc(C[C@H]2SC(=S)N(Cc3ccco3)C2=O)c(OC)c1C 8276443 BRLCOYNNOKHXDP-OAHLLOKOSA-N 377.487 3.577 10 40 GHCB O=C1/C(=C/c2c[nH]c3ccccc23)SC(=S)N1C1=C[C@@H]2OCO[C@H]2C=C1 26771499 XCWKBNLMOGZJKV-JWRDJFKJSA-N 382.466 3.564 10 40 GHCB Cc1ccc(C(=O)[C@@H]2Sc3nnc(C)n3N[C@H]2c2ccc(N(C)C)cc2)cc1 3258353 HUMULPMOVXZNNX-AZUAARDMSA-N 393.516 3.603 10 40 GHCB Cn1c(-c2ccccc2)cnc1SCCCN1C(=O)c2ccccc2C1=O 36775380 GGYHNKRIEILAFK-UHFFFAOYSA-N 377.469 3.866 10 40 GHCB O=C1CCCN1c1cccc(NC(=S)NCc2ccc(N3CCCC3)cc2)c1 225425629 IGVMDBSFLHIYAZ-UHFFFAOYSA-N 394.544 3.900 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1cccc(OC)c1O 409072628 QVDWSQWYWFNOAK-KAMYIIQDSA-N 399.830 3.931 10 40 GHCB COc1ccc(OC)c(-c2cc3ccc(O)c(CN4CCCC4)c3oc2=O)c1 4085524 SWCNRZPDEOAADZ-UHFFFAOYSA-N 381.428 3.779 10 40 GHCB biogenic CN(C)c1ccc(CNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCCC3)cc1 10433389 SQOWUFBGNVHSST-UHFFFAOYSA-N 392.478 3.886 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)CN3C(=O)CC4(CCCC4)C3=O)c2C)cc1 32719461 FRRWZSNYKOVWCN-UHFFFAOYSA-N 394.471 3.605 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c1 408936510 KRBRSOCGYXVQLK-BOPFTXTBSA-N 384.819 3.795 10 40 GHCB Cc1cc(N2C(=O)NC(=O)/C(=C\c3ccccc3C)C2=O)ccc1Br 408758221 HQOJSDFPKANHHH-XNTDXEJSSA-N 399.244 3.732 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccccc3OCC(N)=O)SC2=S)c(C)c1 409326840 FEYIDYNCAOZVAH-YVLHZVERSA-N 398.509 3.573 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1 35040227 HWOXHZJCKBDENM-SFQUDFHCSA-N 399.493 3.837 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C/c2ccc(C=O)cc2)SC1=S 5375094 NIRHGQVXYFTDRZ-PXNMLYILSA-N 383.450 3.912 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)c(C)n1-c1ccc(C(C)C)cc1 59139310 MIWHMLFHTISJEO-UHFFFAOYSA-N 395.528 3.816 10 40 GHCB CCC(=O)N[C@H](C)[C@@H](c1cccs1)N1CCN(c2ccc(OC)cc2)CC1 23181510 VVQIVVCYGKKCRM-IERDGZPVSA-N 387.549 3.535 10 40 GHCB CCOc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccccc2)C1=O 20987176 XFWMYQACXBTPJI-VBKFSLOCSA-N 384.482 3.632 10 40 GHCB Cc1ccnc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)NC(=S)N3C)c2C)c1 222747970 AXQREOQMRQABRU-PMACEKPBSA-N 377.517 3.795 10 40 GHCB CC1=CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc21 208441564 NZRVVTRDDCTTIP-OVCLIPMQSA-N 388.514 3.604 10 40 GHCB Cc1c(-c2ccc(Cl)cc2)c(=O)oc2c(CN3CCN(C)CC3)c(O)ccc12 20605068 NSOCEIMJVDDWHZ-UHFFFAOYSA-N 398.890 3.875 10 40 GHCB biogenic O=C(c1ccco1)N1N=C(c2cccs2)C[C@H]1c1cc([N+](=O)[O-])ccc1O 36055738 BYZUFJDZLGEQJG-AWEZNQCLSA-N 383.385 3.946 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCc1nc2ccccc2n1C 9516580 JJLHXCCBQYXWRD-UHFFFAOYSA-N 391.519 3.905 10 40 GHCB COc1ccc(N2CCC(N(CCc3cccc(C)c3)CC(=O)O)CC2)cc1 257288895 PWDDGJGOWVNYDJ-UHFFFAOYSA-N 382.504 3.602 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)O)[C@@H](C)CC)C2=O)cc1 5373649 CHJJPBZLESNBNE-WKVAABHYSA-N 379.503 3.786 10 40 GHCB CCN1C(=O)/C(=C\c2cc(C)n(-c3ccccc3F)c2C)C(C(=O)OC)=C1C 3641201 NKISJYCIVQJXNT-ATVHPVEESA-N 382.435 3.926 10 40 GHCB Cc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1N1CCCC1 19716203 OERZHNPJPIXAOV-IBGZPJMESA-N 393.531 3.923 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)C(C(=O)OC)=C1C 59435697 IQAWERFBIXMHBZ-ZHZULCJRSA-N 377.440 3.958 10 40 GHCB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C\c1ccc(-c2ccccc2Cl)o1 13661273 ZOSROTOQIPMLSC-GDNBJRDFSA-N 396.786 3.855 10 40 GHCB CCOC(=O)C1=C(C)N=C(SCC(C)C)N[C@@H]1c1ccc(N(C)C)cc1 408989033 JKMSIYLIVOGUSR-GOSISDBHSA-N 375.538 3.979 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)n(C)c(=O)n4C)SC2=S)cc1 409349158 VEUZBWPXZNLFGC-BOPFTXTBSA-N 395.509 3.591 10 40 GHCB O=C(NCc1ccc(N2CCCC2)cc1)c1cccnc1OCC(F)(F)F 28335762 FOAIQRBHYXKWDR-UHFFFAOYSA-N 379.382 3.553 10 40 GHCB CCN(CC)c1ccc(CNC(=O)/C=C/c2ccc(OC)c(OC)c2OC)cc1 225439294 PXZQWSKWBQLHJA-RVDMUPIBSA-N 398.503 3.888 10 40 GHCB CC1=NN(c2nnn[nH]2)C(=O)/C1=C/c1ccc(-c2cc(Cl)ccc2Cl)o1 102653652 NCMUPEKWOMUHJR-YRNVUSSQSA-N 389.202 3.573 10 40 GHCB COc1ccc(C2=NN(C(C)=O)[C@@H](c3ccc(Br)cc3)C2)c(O)c1 5163506 LLEZIRBHICTNNA-QGZVFWFLSA-N 389.249 3.861 10 40 GHCB CCOc1cccc(N2C(=O)N=C(O)/C(=C\c3cc(C)c(O)c(C)c3)C2=O)c1 38172793 XAAIWKSAJAWJFY-LICLKQGHSA-N 380.400 3.914 10 40 GHCB Cc1ccc(NC(=O)COc2cccc(/C=C3\SC(=S)NC3=O)c2)cc1 15056009 ZMVXSWYJRQGIOK-YBEGLDIGSA-N 384.482 3.501 10 40 GHCB Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCN(c2ccccc2)CC1 7129506 NWQUVSGJAUFERI-UHFFFAOYSA-N 392.528 3.528 10 40 GHCB COc1ccc(O)c(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c1 113830588 RMBAAZAUTBVFQX-OQLLNIDSSA-N 388.426 3.715 10 40 GHCB O=C1N[C@@H](c2ccccc2O)Nc2sc3c(c21)CCN(Cc1ccccc1)C3 4525915 NWSSCIMIMOARNE-HXUWFJFHSA-N 391.496 3.866 10 40 GHCB CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccccc2OC(C)C)C1=O 409230512 DZLQVDZYVQSKMN-DTQAZKPQSA-N 394.427 3.539 10 40 GHCB O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C/c1cccc(C(F)(F)F)c1 5717345 GKJSHZMWJBHXSC-FMIVXFBMSA-N 394.349 3.676 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3ccc(C)cc3C)N=C2C)c([N+](=O)[O-])c1 100507702 XYDHWHCYQKRAMV-LFIBNONCSA-N 380.404 3.939 10 40 GHCB CN(C)c1ccc([C@@H]2SCCN2C(=O)c2cc3ccccc3oc2=O)cc1 863326 KTXUPCOVVXPAAI-FQEVSTJZSA-N 380.469 3.747 10 40 GHCB Cc1ccc(NC(=S)NCc2ccc(N3CCOCC3)cc2)cc1Cl 53535807 UILWDRNLSIUQLT-UHFFFAOYSA-N 375.925 3.972 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN3CCN(c4ccccn4)CC3)c2C)cc1 12631930 IMZQIAZVSCMFKQ-UHFFFAOYSA-N 388.515 3.802 10 40 GHCB CCN(CC)CCCN1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S 2361923 CIVSZWOKTLRNRC-LGMDPLHJSA-N 394.562 3.637 10 40 GHCB COc1cc(Cl)cc([C@H]2N=C(O)c3c(sc4c3CCN(C)C4)N2)c1O 6727373 IXKWSERIIGTBEM-HNNXBMFYSA-N 379.869 3.533 10 40 GHCB Cc1cccc(/C=C2\SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 5373477 HTWWZDSNWWCQHG-BQGMYUGNSA-N 383.494 3.892 10 40 GHCB Cc1cccc([C@H]2C[C@@]3(CC(C)(C)NC(=S)N3)Oc3c2ccc(O)c3O)c1 881938 QXQIHBVWHIABHR-VFNWGFHPSA-N 384.501 3.663 10 40 GHCB COC(=O)c1cc(Cl)c(NC(=O)N(C)Cc2ccccc2O)cc1OC 47526034 JHCCEDLGIPWEBX-UHFFFAOYSA-N 378.812 3.505 10 40 GHCB O=C1N/C(=C\c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccc(F)cc1 3652538 RQZAEBNTEOKUMW-PDGQHHTCSA-N 383.398 3.658 10 40 GHCB O=C(O)COc1cccc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)c1 4700609 RCEMAGHDWMKMRP-DHDCSXOGSA-N 389.429 3.695 10 40 GHCB CN1C(=O)/C(=C/c2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)C(O)=NC1=S 5879175 KKLUIMQZXZMLGL-YRNVUSSQSA-N 391.792 3.605 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCSc1ccc(F)cc1 68536105 BGGDBVLIHCYXMA-UHFFFAOYSA-N 388.508 3.803 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1c(O)ccc2ccccc12 408883846 WXUOHIYDXMVUFW-GZTJUZNOSA-N 392.798 3.865 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCN(CC)c2ccc(C)cc2)c1 225793831 ODJJKENJEMCUON-UHFFFAOYSA-N 385.533 3.985 10 40 GHCB O=C1/C(=C/c2coc3ccc(O)cc3c2=O)SC(=S)N1c1ccccc1 2226048 ADTOQDFJFAQTAP-PXNMLYILSA-N 381.434 3.904 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CSc3nc(N)cc(N)n3)c2C)cc1C 3524590 MIKLKIRTUJVMQI-UHFFFAOYSA-N 381.505 3.640 10 40 GHCB Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCC(c2ccccc2)=N1 7130613 MBRCFYUPYSHXGW-UHFFFAOYSA-N 376.485 3.816 10 40 GHCB Cc1ccc(/N=N/c2c(O)nc3ccccc3c2O)c(S(=O)(=O)N(C)C)c1 22913206 OUECECSFOVBXOS-QZQOTICOSA-N 386.433 3.620 10 40 GHCB in-vitro CCn1nc(C)c2c(C(=O)NCc3ccc(N4CCCC4)cc3)cc(C)nc21 36616101 VDRVIQPFCKWQGY-UHFFFAOYSA-N 377.492 3.598 10 40 GHCB CCOc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 65222484 MKWDHOKHJOGEAK-INIZCTEOSA-N 385.533 3.970 10 40 GHCB CCOC(=O)c1ccc(C)c(NC(=S)NCCN(C)c2ccc(C)cc2)c1 225796280 XJMAJLYKSWRCGK-UHFFFAOYSA-N 385.533 3.903 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C\c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)S1 408601556 KMMCTODZQSCDPU-VGOFMYFVSA-N 391.792 3.615 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)NC2=S)c(C)c1 409144532 OHWWERMXLPNWOE-GZTJUZNOSA-N 389.480 3.626 10 40 GHCB O=C1/C(=C/c2cc3ccccc3[nH]c2=O)SC(=S)N1CCc1ccccc1 12376278 YCGKOROJVUSWAF-AQTBWJFISA-N 392.505 3.972 10 40 GHCB COc1ccc(NC(=O)CN2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 1907701 ONKNXLHCXZWINW-WJDWOHSUSA-N 384.482 3.535 10 40 GHCB COc1ccc(/C=C2\SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)cc1OC 4193758 JOOLBNYSBJFLRV-WQRHYEAKSA-N 397.456 3.745 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)c(C)n1C 409230152 BZYGTHMUXNDYBU-WOJGMQOQSA-N 381.501 3.597 10 40 GHCB COc1cccc(/C=C2/SC(=S)N(c3ccc(C(=O)O)c(O)c3)C2=O)c1 35648418 LEQWKCQVZKOQHG-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB CCCN1C(=O)/C(=C\c2cc(Cl)c(OCC)c(Cl)c2)C(=O)N(C)C1=O 575443023 MQKBCTPSAFAUCX-XFFZJAGNSA-N 385.247 3.606 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/c3ccc(N4CCCCC4)cc3)C2=O)c1 5897616 HNGBQGUAICMVRK-HKWRFOASSA-N 389.455 3.652 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(N2CCOCC2)cc1 100147968 IRXWVRVRJLCMJB-ZHZULCJRSA-N 381.863 3.983 10 40 GHCB CC(/C=C1\SC(=S)N(NC(=O)c2ccccc2O)C1=O)=C\c1ccccc1 5024702 JWKNOIAQZANLBH-YMGXUNRSSA-N 396.493 3.885 10 40 GHCB O=C1/C(=C\c2ccc(O)c(Br)c2)SC(=S)N1c1cccnc1 96401238 HCMAXKKPEPGYGL-NTUHNPAUSA-N 393.287 3.956 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(CC)cc2)C1=O 408803414 OPTFJBYDGIPOTB-SFQUDFHCSA-N 398.846 3.968 10 40 GHCB COc1ccc(N(C)CCNC(=O)c2cc(Br)ccc2Cl)cc1 225075692 QVZRIVNWMIAPKV-UHFFFAOYSA-N 397.700 3.977 10 40 GHCB CCCCc1ccc(-n2c(C)cc(/C=C3/C(=O)NC(=O)N(C)C3=O)c2C)cc1 408991414 NYJCJTUHVWLJSB-UYRXBGFRSA-N 379.460 3.528 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cccc(OC)c1OC 13801410 AKTCLVNRCPNYAZ-JXAWBTAJSA-N 393.439 3.971 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)c(C)c1 4661146 PPVQGNWUHLMJQU-NRKWFKHNSA-N 377.473 3.960 10 40 GHCB CN1C(=O)/C(=C/c2ccccc2OCC(=O)Nc2ccccc2)SC1=S 409332650 QSIZMEOYZGPMRB-WJDWOHSUSA-N 384.482 3.535 10 40 GHCB C[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCCC4=O)c3)cc2)C1 225636716 AUAIJVVKVCNCKN-SFHVURJKSA-N 391.515 3.980 10 40 GHCB O=C1NC(=S)S/C1=C1/C=C(c2ccc3c(c2)OCO3)Oc2ccccc21 18127817 VNKLZFKSPSDHFR-ATVHPVEESA-N 381.434 3.708 10 40 GHCB O=C(NN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)c1ccc(F)cc1 1250158 UXQXSRCMWUMUIQ-CXUHLZMHSA-N 397.456 3.853 10 40 GHCB Cc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCC2)cccc1[N+](=O)[O-] 5097947 BZIXZIKFFVSNFY-NRFANRHFSA-N 396.491 3.536 10 40 GHCB Cc1ccccc1NS(=O)(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O 9514084 LCPGQNVOJBFGJI-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB COc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCCC2)cc1 13007667 UHZULVIZUSFVKB-QHCPKHFHSA-N 393.531 3.645 10 40 GHCB CN(C)c1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)CCCC(=O)O)cc1 4869418 CGFOHMURZJRDKX-HXUWFJFHSA-N 379.460 3.685 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1sccc1C 408895960 WQXKQAAXJHZTPK-AQTBWJFISA-N 397.496 3.980 10 40 GHCB Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccc(O)cc1 222741394 RJUKDQUEUSVZMB-VQTJNVASSA-N 378.501 3.797 10 40 GHCB Cc1cc2oc(=O)c(C)c(C)c2c(O)c1C1=NN[C@@H](c2ccc(N(C)C)cc2)C1 13683567 KJLMXSPHPDUEJQ-QGZVFWFLSA-N 391.471 3.929 10 40 GHCB COc1ccc(CCN2C(=O)c3ccccc3N[C@@H]2c2cccc(O)c2O)cc1 7884419 HIGJQTZHBVAZAK-QFIPXVFZSA-N 390.439 3.916 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccccn1 13281322 RWPFHTRNUIWMEW-QBFSEMIESA-N 389.527 3.763 10 40 GHCB Cc1ccccc1/C=C1\SC(=S)N([C@@H](Cc2ccccc2)C(=O)O)C1=O 5373429 IPFTYYJDJFWZSW-BQGMYUGNSA-N 383.494 3.892 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCCNC(=O)c1ccsc1 12564661 CXXIMQLJDSUEFK-UHFFFAOYSA-N 399.560 3.907 10 40 GHCB COc1ccc(/C=C2\SC(N3CCN(c4ccccc4F)CC3)=NC2=O)cc1 13748540 BBNYSPPNXZCGPS-RGEXLXHISA-N 397.475 3.627 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C\c3ccccc3F)SC2=S)ccc1O 35648689 IITGTYKZOBZCNA-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB Cc1ccc(C)n1N1C(=O)/C(=C/c2cc3ccccc3oc2=O)SC1=S 1102752 BDFLHWYIUOXBCO-YBEGLDIGSA-N 382.466 3.749 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/Nc1ccccc1Cl 16662460 RMRZBSUUEZCSMY-FMIVXFBMSA-N 376.199 3.572 10 40 GHCB O=C1S/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)N1Cc1ccc(F)cc1 106691512 FKOGJMZOKQHJOS-UYRXBGFRSA-N 398.459 3.899 10 40 GHCB Cc1cc(O)c(CN2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)cc1C 14238584 CPKBKHWLEUIICL-UHFFFAOYSA-N 382.548 3.870 10 40 GHCB O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1C(=O)c1ccc(F)cc1 408719751 QMPPAZJGECOMNT-NTEUORMPSA-N 388.401 3.776 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)N2CCc3ccccc3C2)cc1 5643850 KJMNJGJZIKOYMK-UHFFFAOYSA-N 388.467 3.836 10 40 GHCB Cc1ccc(NC(=O)c2cnn3c(O)cc(CSc4ccccn4)nc23)cc1 19210707 SFYMTWWRWIDLKS-UHFFFAOYSA-N 391.456 3.683 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)c(C)n1C(C)C 642268 PFRLERCKNRZMFC-YVLHZVERSA-N 385.464 3.656 10 40 GHCB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NC1=NN(c2ccccc2)C(=O)C1 1171288 HVLZJTHVKXQUHZ-LLVKDONJSA-N 392.242 3.627 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1907737 YPGDHNMSGUBRQU-DHZHZOJOSA-N 386.292 3.515 10 40 GHCB CCOC(=O)c1sc(N2N=C(C)/C(=C\c3ccc(C)s3)C2=O)nc1C 8306612 HEWBHTGWKSVZBK-MDWZMJQESA-N 375.475 3.804 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3cccn3CCOc3ccc(C)cc3C)C(=N)N2O1 41078254 ARWFRQOMXACOEJ-RVNILFKFSA-N 390.443 3.634 10 40 GHCB Cc1cc(O)c(CN2CCC(C(=O)c3ccc4c(c3)OCCO4)CC2)cc1C 58537495 ABJOGLXAGMFMJV-UHFFFAOYSA-N 381.472 3.875 10 40 GHCB CC[n+]1c(C=C2C=C(C)N(CCN3CCNCC3)C(C)=C2)sc2ccccc21 22035786 FPPVQJFRTYJDKZ-UHFFFAOYSA-N 395.596 3.621 10 40 GHCB CCCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)sc2c1CCCC2 2086585 DLCAKYXPUCYWGE-STQMWFEESA-N 391.489 3.799 10 40 GHCB Cc1cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c(C)n1-c1ccc(Cl)cc1 2449810 LVZATGIVXLVSBI-ZMWDXYKNSA-N 383.864 3.997 10 40 GHCB O=C(NCc1cc([N+](=O)[O-])ccc1O)c1cc(Br)ccc1Cl 36622629 FAYWWNCPTIDCBX-UHFFFAOYSA-N 385.601 3.646 10 40 GHCB COc1ccc(NC(=O)COC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 5643844 DOQNZQXMYQQDPF-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3ccc(C=O)cc3)SC2=S)c(OC)c1 5375082 NTXNZFIIVLPRJT-MFOYZWKCSA-N 385.466 3.922 10 40 GHCB CCc1ccc(N2C[C@](O)(c3ccc(OC)cc3F)[N+]3=C2SCCC3)cc1 2965920 LDZVQOLOTHMHKP-NRFANRHFSA-N 387.500 3.567 10 40 GHCB COc1ccc(N2CCCN(C[C@@H](O)COc3c(C)ccc(C)c3C)CC2)cc1 84147784 TVVMLLPSGZRSOX-JOCHJYFZSA-N 398.547 3.572 10 40 GHCB CCc1ccc(-n2c(C)cc(/C=C/c3nc(O)c([N+](=O)[O-])c(=O)[nH]3)c2C)cc1 9273468 UZKNFOWWQGBGKL-JXMROGBWSA-N 380.404 3.524 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(N3CCCCCC3)o2)C1=O 4739691 JLCFNJIEZHVBIQ-SAPNQHFASA-N 393.443 3.635 10 40 GHCB N=C1Nc2nc3ccccc3n2[C@H](c2cc(Cl)cc(Br)c2O)N1 575442885 DEECMNORASODAB-CYBMUJFWSA-N 392.644 3.655 10 40 GHCB Cc1cccc(NC(=O)COc2cccc(/C=C3\SC(=S)NC3=O)c2)c1 15056039 BKQMHKVNMJDFOY-YBEGLDIGSA-N 384.482 3.501 10 40 GHCB O=C1c2ccccc2-c2onc3c(Br)cc(N4CCOCC4)c1c23 1432219 LXDNUGQQGANZOC-UHFFFAOYSA-N 385.217 3.638 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1 35648239 KBMJIKKXRPGGPQ-XNTDXEJSSA-N 399.449 3.577 10 40 GHCB C[C@@H]1CN2C(=N[C@H](c3ccccn3)[C@H]2c2ccc(N3CCOCC3)c(F)c2)S1 260777803 QSKQZWHMIVMZQO-JSNMRZPZSA-N 398.507 3.647 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1 408772880 IRYZAASMXRJDRQ-XSFVSMFZSA-N 391.471 3.816 10 40 GHCB Cc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(Cl)c3C)C2=O)s1 409068787 VRDZOKPLRCOKLU-XYOKQWHBSA-N 376.890 3.850 10 40 GHCB O=C1/C(=C/c2ccccn2)SC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 7099747 JPIFOUSYGFBEFR-PXNMLYILSA-N 399.541 3.530 10 40 GHCB CCN1C(=O)/C(=C\C=C2/Sc3ccc(Cl)cc3N2CCO)SC1=S 15938461 WAKRILIFYBGFGT-LSMSNJBFSA-N 398.962 3.850 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCCN2CCCc3ccccc32)c1 225746361 BVIDIKKFSOQLER-UHFFFAOYSA-N 397.544 3.993 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3cccc(F)c3)N3CCCCC3)ccc21 13007731 VIGNEPMGRLNPNP-QFIPXVFZSA-N 381.495 3.775 10 40 GHCB C/C(=C1\C(=O)N(c2nc3ccccc3s2)N=C1C(F)(F)F)N1CCCC1 1199778 LTCCDHVESPODMN-JLHYYAGUSA-N 380.395 3.931 10 40 GHCB Cc1cccc(C(=O)N2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)c1 408720015 VPKUDCADOLBTEF-XNTDXEJSSA-N 384.438 3.945 10 40 GHCB O=C1NC(=S)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(Cl)s1 409247005 FSWYJCLHQCMHTM-VQHVLOKHSA-N 383.281 3.886 10 40 GHCB CCOc1cccc(NC(=S)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 225838908 HIDYHUMCXHOGKI-INIZCTEOSA-N 385.533 3.970 10 40 GHCB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\c1cc2c(cc1[N+](=O)[O-])OCO2 59272725 AABDHRXDTMFALL-RZNTYIFUSA-N 385.763 3.783 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S)N1CCCC1 13541199 MCYNEFYITFNDKG-QINSGFPZSA-N 394.949 3.944 10 40 GHCB O=c1cc(-c2cc3ccccc3oc2=O)c2ccc(O)c(CN3CCCC3)c2o1 4353802 QITCTCYYUNZGMV-UHFFFAOYSA-N 389.407 3.868 10 40 GHCB biogenic FC(F)(F)c1nnc2ccc(N3CC=C(c4c[nH]c5ccccc45)CC3)nn12 14244322 ZJWBFQBXFKPDEQ-UHFFFAOYSA-N 384.365 3.918 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=S)N(NC(=O)Nc3ccccc3)C2=O)cc1 3039655 VBWJZXKCZWZEJS-FOWTUZBSSA-N 398.513 3.691 10 40 GHCB Cc1ccc(C(C)(C)O[C@H]2CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@H]23)cc1 4568187 HWBQGRFPUCBOTB-LMNJBCLMSA-N 392.451 3.995 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1O[C@H](C)CC 409335364 ZFVIKZDLNXJQRZ-PDICVPPASA-N 395.502 3.548 10 40 GHCB COc1cc2c(cc1OC)CN(Cc1cc(Cl)cc(C(C)=O)c1O)CC2 97395026 MDKOQODJBOIISL-UHFFFAOYSA-N 375.852 3.824 10 40 GHCB C[C@@H](c1ccccc1O)N(C)C(=O)c1ccc(F)cc1I 89909748 QAGCQGWHTAZGQD-JTQLQIEISA-N 399.203 3.969 10 40 GHCB COc1ccc2cc(/C=C3/SC(=S)N(Cc4ccco4)C3=O)c(=O)[nH]c2c1 13721330 YZSAEOKVXBMSAR-LZYBPNLTSA-N 398.465 3.531 10 40 GHCB CC12CN3CC(c4ccccc4)(CN(C1)C3c1c(O)ccc3ccccc13)C2=O 19323680 FUPKOYYMJAVKPH-UHFFFAOYSA-N 384.479 3.702 10 40 GHCB biogenic COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 408767275 FKRMRAVDVXGHRO-ZHZULCJRSA-N 376.456 3.938 10 40 GHCB CC(C)N1c2ccc(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc2[C@H](C)CC1(C)C 260569878 SVKIOGNDVMLDSY-CQSZACIVSA-N 383.492 3.621 10 40 GHCB O=C1/C(=C/c2ccco2)C(O)=NC(=S)N1c1ccc(Br)cc1 59198512 OHVDHDZPXDLLCT-XYOKQWHBSA-N 377.219 3.714 10 40 GHCB CCOc1cccc(CN2CCc3c(nc(C(C)C)nc3N3CCCC3)C2)c1O 19520010 AQQBOKUJAKKBKD-UHFFFAOYSA-N 396.535 3.863 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C/c3cccnc3)SC2=S)cc1OC 5372331 SRSLMSGZYKPIDO-BOPFTXTBSA-N 386.498 3.543 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 100041139 ORQSHZOYUXLXSX-YBEGLDIGSA-N 395.375 3.838 10 40 GHCB COc1c(C)cnc(CNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)c1C 50254149 MQQHIJORFFOILL-UHFFFAOYSA-N 381.404 3.515 10 40 GHCB CCCN1C(=O)/C(=C\C=C2/Sc3ccccc3N2CCO)SC1=S 4859540 KMUWDJKTOHKZTA-GOBHWCIESA-N 378.544 3.587 10 40 GHCB COc1cc(/C=C2\SC(Nc3cccc(C)c3)=NC2=O)cc2c1OCCO2 7163911 LCZJDMBJQOQYRK-BOPFTXTBSA-N 382.441 3.857 10 40 GHCB CCN(CC)c1ccc(/C=C2\SC(=S)N(C(=O)c3ccncc3)C2=O)cc1 5261414 HBTIBZOKPBGVIF-LGMDPLHJSA-N 397.525 3.969 10 40 GHCB COc1ccc(/C=C2/C(=O)N(C(=O)c3ccc(Cl)cc3)N=C2C)cc1OC 5842783 VDOJIDANOLMWHT-MHWRWJLKSA-N 384.819 3.799 10 40 GHCB COc1ccc(N2CCN(C(=O)COc3cc(C)ccc3C(C)C)CC2)cc1 6125040 IJAKIOPZLDCZNS-UHFFFAOYSA-N 382.504 3.855 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3c(C)[nH]c4ccccc34)C(=O)NC2=S)cc1 723635 OPOYKSDYXQJOIA-GZTJUZNOSA-N 375.453 3.616 10 40 GHCB COc1cccc(/C=C2\SC(N3CCN(c4ccc(F)cc4)CC3)=NC2=O)c1 9189271 XSSIEEJCHIVUIA-RGEXLXHISA-N 397.475 3.627 10 40 GHCB COC(=O)c1ccc(C)c(NC(=S)NCCCN2CCc3ccccc32)c1 225559839 LSOVVGXKNINHKZ-UHFFFAOYSA-N 383.517 3.521 10 40 GHCB CCc1cc(S(=O)(=O)NCc2ccc(N(CC)CC)cc2)ccc1OC 225565049 UEVGLYJJPCFGPM-UHFFFAOYSA-N 376.522 3.582 10 40 GHCB Cc1cccc(C)c1OCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 11915021 CNTCHBFMVOZOSB-JOCHJYFZSA-N 396.531 3.956 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cc1 14372449 KDGUEGUIAJJRBW-UHFFFAOYSA-N 392.484 3.664 10 40 GHCB COc1ccc(N2CCN([C@@H](C(=O)O)c3c[nH]c4ccc(Cl)cc34)CC2)cc1 20722989 JWRAFCAHRGEZFK-HXUWFJFHSA-N 399.878 3.778 10 40 GHCB COc1cc(Br)c(CNCc2ccc(N(C)C)cc2)cc1OC 17318060 LTAQTKYIXJHRPU-UHFFFAOYSA-N 379.298 3.822 10 40 GHCB Cc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 6747932 YBFCQKFAKITKIY-QFIPXVFZSA-N 382.504 3.648 10 40 GHCB CCCC1=NN2C(=N)/C(=C\c3cccc(Br)c3)C(=O)N=C2S1 9553597 AFYMXKZIHRRRJQ-UZTJDCKESA-N 377.267 3.868 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C/c2c(-c3ccccc3)n(C)c3ccccc23)S1 408842532 OMYWJBXGHCALGQ-PDGQHHTCSA-N 375.453 3.952 10 40 GHCB CCOCCCN/C(C)=C1\C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 112121144 DOLNLNIUSYUYOU-SILNSSARSA-N 381.451 3.867 10 40 GHCB O=C1NC(=S)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(O)c(Cl)c1 409242132 MNDZGSGWCCDBSL-JXMROGBWSA-N 393.251 3.530 10 40 GHCB COc1ccc(/C=C2/SC(NC3CCCCC3)=NC2=O)c(OC)c1OC 96121213 PBBXCHQVPJADRX-RVDMUPIBSA-N 376.478 3.605 10 40 GHCB CCc1cc(=O)oc2c(C)c(O)c(CN3CCN(c4ccccc4)CC3)cc12 8743326 WCTXHFPIUHJVLS-UHFFFAOYSA-N 378.472 3.692 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1cc(OC)ccc1OC 408995347 BNENJYIXFABMRB-PDGQHHTCSA-N 397.402 3.720 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OC(C)C)cc3)C2=O)cc1C 5753695 WXTSXPDFHLAVFY-XDHOZWIPSA-N 378.428 3.757 10 40 GHCB Cc1cc(C(=O)COC(=O)C2CC2)c(C)n1-c1ccc(Br)cc1 3308977 RPPHDCPBPWUVII-UHFFFAOYSA-N 376.250 3.993 10 40 GHCB CCCN1C(=O)/C(=C\c2ccccc2OC)C(=O)N(c2ccccc2)C1=S 409022842 UOVRRSNQLILEKG-SAPNQHFASA-N 380.469 3.649 10 40 GHCB CCOc1ccccc1CCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 48355119 WRHIVEJCXKNAKS-SFHVURJKSA-N 382.504 3.732 10 40 GHCB CCCCOC(=O)CCN1C(=O)/C(=C/c2ccccc2OC)SC1=S 5370715 XRTPOSSAHQDDRE-QINSGFPZSA-N 379.503 3.630 10 40 GHCB CC1CCN(CC(=O)Nc2cc3c(cc2Cl)C(=O)c2ccccc2C3=O)CC1 13041054 WMUDLVQEZZCOOP-UHFFFAOYSA-N 396.874 3.786 10 40 GHCB COc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O 409070856 PDGSHUYGBCTGDM-PKNBQFBNSA-N 391.210 3.668 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cccc4c3CCCC4)CC2)cc1 224547969 NOJMVLLXQMVSJJ-SFHVURJKSA-N 394.515 3.690 10 40 GHCB Cc1c(C(=O)NCc2ccccc2O)cnn1-c1cccc(C(F)(F)F)c1 95393284 GRRBALMNYBDBGF-UHFFFAOYSA-N 375.350 3.835 10 40 GHCB CN(C)c1ccc(/C=C2\C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc1 1084631 DKSVZDXHTUQSSD-NTEUORMPSA-N 376.243 3.521 10 40 GHCB COc1ccc(-c2ccc(/C=C3/C(=N)N4C=CSC4=NC3=O)o2)c([N+](=O)[O-])c1 5025825 HFIYPABFBHCLBZ-STBHAXGISA-N 396.384 3.640 10 40 GHCB COc1cc(CN(C)Cc2ccccc2N2CCOCC2)ccc1N1CCCC1 19715815 DEIFDAGTEAWPPY-UHFFFAOYSA-N 395.547 3.764 10 40 GHCB CC(C)C[C@@H](C(=O)O)N1C(=O)/C(=C/c2cn(C)c3ccccc23)SC1=S 5371540 QSOPYXJVMUYCLE-HVVQPJKBSA-N 388.514 3.879 10 40 GHCB COc1cccc(OCCOc2ccccc2/C=C2\SC(=S)NC2=O)c1 13943170 CRMFXTYCNCTQPO-BOPFTXTBSA-N 387.482 3.642 10 40 GHCB CC(C)C(=O)O[C@@H](C)C(=O)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O 7814562 KPOHDXZSDHEAOV-NSHDSACASA-N 399.830 3.642 10 40 GHCB COC(=O)c1ccc(COc2ccccc2/C=C2/SC(=S)NC2=O)cc1 3321824 WQGWKTPUXTYOLE-MHWRWJLKSA-N 385.466 3.541 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S)N1CCCC1 13809801 NWTCZMZAZWCORC-KAMYIIQDSA-N 380.922 3.554 10 40 GHCB CC[C@@H](C)c1ccccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 20807200 DRMNDTDVQFZCHW-CTNGQTDRSA-N 398.547 3.771 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)sc2n1 14422003 KDVKQCRAACCTRS-ZLKJLUDKSA-N 389.521 3.593 10 40 GHCB CCc1ccc(O[C@@H](CC)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 113969642 UYWDLTFTWUJIDH-QFIPXVFZSA-N 382.504 3.559 10 40 GHCB O=C(NCc1ccc(N2CCCCC2)cc1)c1cccc(N2CCCC2=O)c1 116034434 SAIJHMNELISVMU-UHFFFAOYSA-N 377.488 3.734 10 40 GHCB Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\Nc3cccc(Cl)c3)C2=O)c(C)c1 408530475 IYNUMCLHHUXRIR-MHWRWJLKSA-N 383.835 3.844 10 40 GHCB CCOc1cc(/C=C2/SC(=S)N(CC(C)C)C2=O)cc([N+](=O)[O-])c1O 36617132 GHSWPHKVIRLWLU-NTUHNPAUSA-N 382.463 3.556 10 40 GHCB COc1ccccc1NC(=O)NC[C@H](c1ccc2c(c1)CCN2C)N1CCCC1 35597213 BEAOTLZUURQTIW-OAQYLSRUSA-N 394.519 3.646 10 40 GHCB Cc1cc2nc(CC(=O)c3ccncc3)c(CC(=O)c3ccncc3)nc2cc1C 1588949 BTNFAPBTPOZTJR-UHFFFAOYSA-N 396.450 3.887 10 40 GHCB COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1cccc(OC)c1OC 408996381 HYEYKOJFZSZCTR-LGMDPLHJSA-N 385.460 3.709 10 40 GHCB Cc1ccc(-n2cccc2/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1Cl 409008875 OBVRJPLBESZWBG-RIYZIHGNSA-N 392.889 3.725 10 40 GHCB COc1ccc(C[C@H]2SC(=S)N(CC(C)C)C2=O)cc1Br 6326151 VFACHRTXXHFRNF-CYBMUJFWSA-N 388.352 3.885 10 40 GHCB COc1cc(/C=C2/C(=O)NC(=O)N=C2O)ccc1OCc1c(C)cc(C)cc1C 59305951 UMODXUILVRYJJQ-UHFFFAOYSA-N 394.427 3.789 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCCC4)C3=O)c2C)cc1F 13055790 XNAVYWJBHFVFHM-UHFFFAOYSA-N 397.450 3.589 10 40 GHCB C[C@H](Oc1cccc2ccccc12)C(=O)NCc1ccc(N2CCOCC2)cc1 219041057 DIHHBOBGCIONNP-SFHVURJKSA-N 390.483 3.760 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C\c1cccc(OCc2ccccc2)c1 2429584 VDNIQYNUEGYEET-RGEXLXHISA-N 380.469 3.568 10 40 GHCB CN1C(=O)C(=Cc2ccc(Sc3ccccc3Cl)o2)C(=O)N(C)C1=O 5028547 IIANFMPVQFTZKR-UHFFFAOYSA-N 376.821 3.518 10 40 GHCB Cc1cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c(C)n1-c1ccccn1 102757253 JYSDEMDENYFPRJ-UHFFFAOYSA-N 394.450 3.717 10 40 GHCB CCOc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 8613798 LRMHHAUCHYBTSK-QFIPXVFZSA-N 382.504 3.973 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c(OC)c1 13343081 QWSYMNKGHUOVIO-GDNBJRDFSA-N 395.502 3.550 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@H](CC(C)C)C3=O)c2C)cc1C 6832169 ISEAZPPCXKRKIH-FQEVSTJZSA-N 395.503 3.860 10 40 GHCB Cc1cc(C(=O)CN2C(=O)COc3ccccc32)c(C)n1-c1ccc(F)cc1 7463058 OIRZRJGYIJSSJK-UHFFFAOYSA-N 378.403 3.842 10 40 GHCB CCOc1ccccc1NC(=S)N[C@H](C)c1ccc(N2CCOCC2)cc1 225838034 DIIUCCGJBAJHHE-MRXNPFEDSA-N 385.533 3.970 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2S[C@H](C)CN21 260786584 YKFXZAXSVNLPJE-MAODMQOUSA-N 394.544 3.816 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)c(Cl)c3)C2=O)c1 1201245 LJGRKKXVARZYBF-MDWZMJQESA-N 375.211 3.968 10 40 GHCB CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/Nc1c(C)nn(C)c1C 408756127 HRULRIJRLNHNLZ-OQLLNIDSSA-N 388.269 3.518 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccc4c(c3)CCCC4)CC2)cc1 223937167 AQIWXWLGGNGXBW-GOSISDBHSA-N 394.515 3.690 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)cc1F 223703679 CEYQYMZLRHPKRE-OAHLLOKOSA-N 392.496 3.549 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(NC(=O)Cc3ccccc3)C2=O)cc1 5552027 BAVBGPUKFWRTKW-ATVHPVEESA-N 398.509 3.560 10 40 GHCB CCC1=NN2C(=N)/C(=C\c3ccc(-c4ccccc4[N+](=O)[O-])o3)C(=O)N=C2S1 4613900 NOVVDZSCCORDSI-FCVDSQLGSA-N 395.400 3.884 10 40 GHCB CN(Cc1ccccc1O)C(=O)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1149871893 KSNXIONNNQFAAT-UHFFFAOYSA-N 391.349 3.953 10 40 GHCB CC[C@H]1CCCCN1C(=O)CN1C(=O)/C(=C\c2cccs2)SC1=S 4745375 CYNITCHGIRLGFU-LQELWAHVSA-N 380.560 3.740 10 40 GHCB Cc1cc(C(=O)OCC(=O)NCc2ccc(F)cc2)c(C)n1-c1ccccc1 4835387 QQUDEBCYGWURHZ-UHFFFAOYSA-N 380.419 3.706 10 40 GHCB Oc1ccccc1CN1CCN(Cc2ccccc2O)C1c1ccccc1O 19320645 ANICLVHQMDRTIC-UHFFFAOYSA-N 376.456 3.820 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3ccccc3C)C2=O)cc1 408966094 MUFNQWXZOYDKMC-XMHGGMMESA-N 385.423 3.761 10 40 GHCB Cc1cccc(N2C=C(C(=O)N3CCCCC3)S(=O)(=O)c3ccccc32)c1 44169772 JRQWSPLPCYHCHP-UHFFFAOYSA-N 382.485 3.774 10 40 GHCB CC/C(=C(\CC)c1ccc(O)c(CN(CCO)CCO)c1)c1ccc(O)cc1 1594244 RFVWDSLZDOERFY-DQRAZIAOSA-N 385.504 3.615 10 40 GHCB O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1Cc2cc(Cl)ccc2O1 54035271 SRISLDMSLNAXJM-IBGZPJMESA-N 388.920 3.513 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cc(C)cc(C)c3C)CC2)cc1 20453564 ZJZSUFZBIDKXBP-IBGZPJMESA-N 382.504 3.737 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2ccc(O)c(Cl)c2)C1=O 408888390 ZMEHVSFEQDKBRG-WUXMJOGZSA-N 391.210 3.674 10 40 GHCB Cc1cc(/C=C2/SC(=O)N(C)C2=O)c(C)n1-c1ccc(N2CCOCC2)cc1 408769399 SXLHHEUCIJICCR-CPNJWEJPSA-N 397.500 3.597 10 40 GHCB COc1ccc(N2CCC(N(CC(=O)O)Cc3cccc(F)c3F)CC2)cc1 257325507 WTFAUQJQYPHTKX-UHFFFAOYSA-N 390.430 3.529 10 40 GHCB O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1cc(Cl)ccc1Cl 55679274 CYBYULDVPTWHEF-UHFFFAOYSA-N 387.288 3.631 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)NC3CCCC3)c2C)cc1 16047170 SCBLTGNLUCXFHK-INIZCTEOSA-N 384.476 3.707 10 40 GHCB COc1cc(/C=C2/SC(Nc3ccccc3C)=NC2=O)ccc1OCC(=O)O 16915413 NWIZDYOPPOQIOO-LICLKQGHSA-N 398.440 3.549 10 40 GHCB Cn1c2ccccc2c2ccc(CC(=O)N(CC(=O)O)Cc3ccccc3)cc21 257272407 NCHBORRJOIRLKM-UHFFFAOYSA-N 386.451 3.987 10 40 GHCB COc1ccc2c3c(n(Cc4ccco4)c(=O)c2c1OC)-c1ccccc1C3=O 604405952 UTBMOLBBTWGYAV-UHFFFAOYSA-N 387.391 3.871 10 40 GHCB biogenic COc1ccc2c3c(n(Cc4ccccn4)c(=O)c2c1OC)-c1ccccc1C3=O 604404181 KQSAHNBOCNVTRJ-UHFFFAOYSA-N 398.418 3.673 10 40 GHCB biogenic O=C(O)C[C@@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 12032241 ZXRRAMSVKQBQDA-BMANGOCTSA-N 385.466 3.809 10 40 GHCB COc1ccccc1NC(=O)[C@H](/N=N/c1ccc(Cl)cc1[N+](=O)[O-])C(C)=O 100049890 QPHCXDDGQQLPIM-FVGNFYTDSA-N 390.783 3.937 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3ccc(C(C)=O)cc3)N=C2C)cc(OC)c1OC 4477121 AGOVIKYMDUCUNB-VCHYOVAHSA-N 394.427 3.721 10 40 GHCB CC(C)Oc1cccc(NC(=S)NCc2ccc(N3CCOCC3)cc2)c1 225421646 CGVHEYAOZLCRGM-UHFFFAOYSA-N 385.533 3.797 10 40 GHCB COc1cc(C)c(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(C)C 225661777 VSXHTWAKXAENII-UHFFFAOYSA-N 382.504 3.894 10 40 GHCB COc1ccc(O)c(C=C2C(=O)N(c3ccccc3)N(c3ccccc3)C2=O)c1 1101169 NKMSCUOGHCMMJM-UHFFFAOYSA-N 386.407 3.779 10 40 GHCB CC1=NN(C(=O)c2ccncc2)C(=O)[C@H]1/N=N/c1ccc(-c2ccc(N)cc2)cc1 104204179 PVPHEEWBXNVLGB-QTJUSOIVSA-N 398.426 3.842 10 40 GHCB CCOC(=O)c1ccc(N/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc1 618255313 WDGZGXIOVXVDGQ-GDNBJRDFSA-N 388.470 3.770 10 40 GHCB CCCCOC(=O)CN1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S 5236328 XZHQLRZTOCVZFH-PTNGSMBKSA-N 379.503 3.630 10 40 GHCB O=C1/C(=C\c2ccccc2F)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1 5583205 WDCSAUFOXXTYEZ-NTEUORMPSA-N 388.401 3.776 10 40 GHCB CCn1ccc(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)C(F)(F)F)n1 2787518 CBEWOKOBQKAQTR-JLHYYAGUSA-N 384.308 3.887 10 40 GHCB Cc1ccsc1/C=C1/SC(N2CCN(Cc3ccccc3)CC2)=NC1=O 96346681 OPLXTGJHBPVMKV-QGOAFFKASA-N 383.542 3.845 10 40 GHCB COc1ccccc1/C=C1\SC(N2CCN(c3ccccc3F)CC2)=NC1=O 5372545 SPOCADJJVSHOCI-RGEXLXHISA-N 397.475 3.627 10 40 GHCB COc1ccc(-c2nc(/N=N\c3n[nH]c(-c4ccc(OC)cc4)n3)n[nH]2)cc1 39549774 DMAPXBCLYGPSGA-QPLCGJKRSA-N 376.380 3.689 10 40 GHCB COc1cc(OC)c(/C=C2\C=C(c3ccc(OC)c(OC)c3)OC2=O)c(OC)c1 256055447 HFJRSOYLCRMODC-RIYZIHGNSA-N 398.411 3.711 10 40 GHCB CN(C)c1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CCCC(=O)O)cc1 4869417 CGFOHMURZJRDKX-FQEVSTJZSA-N 379.460 3.685 10 40 GHCB Cc1ccc(N(C)CCNC(=S)Nc2ccc(C)c(N3CCCC3=O)c2)cc1 225796709 VMQDMFBJRNKJGQ-UHFFFAOYSA-N 396.560 3.853 10 40 GHCB O=C(CSCc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 13676329 PYLRLBCJRPSPBW-UHFFFAOYSA-N 390.936 3.726 10 40 GHCB O=C1Nc2ccccc2/C1=C/c1nc2ccccc2c(=O)n1Cc1ccccc1 13777718 HDIOEXSAQMWABC-RGEXLXHISA-N 379.419 3.938 10 40 GHCB CCN1C(=O)N/C(=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O 665357 TVDPCUCTYBXINS-YBEGLDIGSA-N 388.265 3.769 10 40 GHCB Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2nnc3n2CCCCC3)c1 24923503 NFPYJXRJEJFRSR-UHFFFAOYSA-N 397.910 3.995 10 40 GHCB Cc1ccc(C(C)C)cc1OCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 12637387 URNTVYFSYVMROO-UHFFFAOYSA-N 396.531 3.992 10 40 GHCB COc1ccc([C@@H](c2ccc3c(OC)cccc3c2O)N2CCOCC2)cc1 13656368 WYADEYJOPGIMNZ-QFIPXVFZSA-N 379.456 3.984 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1CCCC1 4976579 NWKBKECMAQEQBT-KAMYIIQDSA-N 380.560 3.788 10 40 GHCB COc1ccccc1C1(NCc2ccc(O)c(CN3CCOCC3)c2)CCCC1 12344397 DIWJYBIFYCTILJ-UHFFFAOYSA-N 396.531 3.792 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)cc1 5371682 HWOXHZJCKBDENM-ATVHPVEESA-N 399.493 3.837 10 40 GHCB COCC(=O)Nc1cccc(NC(=O)Cc2ccc(-n3c(C)ccc3C)cc2)c1 40158002 LYWHGZOVKFLYAM-UHFFFAOYSA-N 391.471 3.860 10 40 GHCB Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 54285557 HPOSXICXJCXURM-MRXNPFEDSA-N 388.895 3.569 10 40 GHCB CCOc1cc(/C=C2/C(=O)NC(=S)N=C2O)ccc1OCc1ccc(C)cc1 27532426 MLTHHZMVFFNGMG-UHFFFAOYSA-N 396.468 3.727 10 40 GHCB Cc1ccc(S[C@H](C)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 216930791 NKVFIQZQLOGFQT-GOSISDBHSA-N 383.561 3.544 10 40 GHCB O=C1/C(=C/c2ccc3c(c2)OCO3)Sc2scc(-c3ccc(O)c(O)c3)[n+]21 1636165 HCSZLOLPWYTKLS-FMQZQXMHSA-O 398.441 3.630 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\SC(=S)N(C[C@H]2CCCO2)C1=O 4675423 NRZJQXUDQHOYLE-ZCWPUFOUSA-N 388.558 3.975 10 40 GHCB COc1ccccc1NC(=O)Cn1c(CCC(=O)O)ccc1-c1ccccc1 4784046 DZARDFWHLQDPBP-UHFFFAOYSA-N 378.428 3.820 10 40 GHCB COc1ccc(Nc2cc(N(C)C)c(N)c3c2C(=O)c2ccccc2C3=O)cc1 5451766 QURVRDRWIVTKCQ-UHFFFAOYSA-N 387.439 3.862 10 40 GHCB CCN(CC)c1ccc(/C=C2\NC(=S)N(c3ccc(OC)cc3)C2=O)cc1 9189360 HQBVKAVWPTZFPJ-RGEXLXHISA-N 381.501 3.804 10 40 GHCB Cc1ccc(C(=O)O)cc1N1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 35041473 WKZYLLKMSVHMOK-FRKPEAEDSA-N 399.449 3.828 10 40 GHCB Cc1ccc(-c2ccc(C=C3C(=O)OC4(CCCC4)OC3=O)o2)c([N+](=O)[O-])c1 58865868 MRFVFPBJVBVXAY-UHFFFAOYSA-N 383.356 3.917 10 40 GHCB Cc1ccc(C)c(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)NC2=S)c1 409244164 YVBVNWDWNFWGCQ-GZTJUZNOSA-N 389.480 3.626 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)sc2c1CC[C@@H](C)C2 5717926 KNTLMNCJNFJXAY-JHJVBQTASA-N 393.505 3.879 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408793886 HBJYZZAIMWWSCF-PDGQHHTCSA-N 393.439 3.889 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=S)N(c2cc(C)ccc2C)C1=O 409238476 DNASDQCZXJLJSG-FOWTUZBSSA-N 380.469 3.533 10 40 GHCB Cc1ccccc1NC1=NC(=O)/C(=C/c2ccc(O[C@@H](C)C(=O)O)cc2)S1 210836510 ZRPGDHPMTJZZDI-MFVBVHDHSA-N 382.441 3.929 10 40 GHCB COc1ccnc(Cn2c3c(c4ccccc4c2=O)C(=O)c2ccccc2-3)c1OC 604404291 BJGYSONEXIHDSZ-UHFFFAOYSA-N 398.418 3.673 10 40 GHCB biogenic COc1ccc(/C=C2\C(=O)N(c3cc(C)cc(C)c3)C(=O)N=C2O)cc1[N+](=O)[O-] 16269115 DNQVMWGTQJDOAU-DHDCSXOGSA-N 395.371 3.727 10 40 GHCB O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C/c1c(Cl)cccc1Cl 2283507 FITOOGLFTJMLHO-XYOKQWHBSA-N 395.242 3.964 10 40 GHCB Cc1cc2oc(=O)c(C)c(C)c2c(O)c1C1=NN[C@H](c2ccc3c(c2)OCO3)C1 13683789 TZYRCAXEVDGTMZ-AWEZNQCLSA-N 392.411 3.591 10 40 GHCB COCCN1C(=O)S/C(=C/c2ccc(-c3cc(C(=O)O)ccc3C)o2)C1=O 409148469 YXOTZDNCYMQLPK-MHWRWJLKSA-N 387.413 3.636 10 40 GHCB Cc1cc(N2CCOCC2)ccc1CNCC1(c2cccc(F)c2)CCOCC1 19715712 FBQXHBNGFNUZSW-UHFFFAOYSA-N 398.522 3.809 10 40 GHCB CCCCN1C(=O)/C(=C\c2cc([N+](=O)[O-])ccc2Cl)C(C(=O)OC)=C1C 408583973 KYVZJBCLVIRHSA-UVTDQMKNSA-N 378.812 3.721 10 40 GHCB CC1CCN(CC(=O)N2N=C(c3cccs3)C[C@@H]2c2ccccc2O)CC1 7814779 ZVTYGQPQDWOICF-GOSISDBHSA-N 383.517 3.863 10 40 GHCB O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCc1ccc(O)c(O)c1 604405393 RXDCEZSPFMIMEM-UHFFFAOYSA-N 383.403 3.867 10 40 GHCB biogenic CN(C)c1ccc(CN2CCC[C@@]3(CC2)CN(c2ccccc2)C(=O)CO3)cc1 1615128467 KEXRYHUYZLWIOS-XMMPIXPASA-N 393.531 3.541 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1ccccc1 634403 ZMUXXDIRZPCJKX-HKWRFOASSA-N 377.440 3.611 10 40 GHCB CCc1ccccc1N1C(=O)/C(=C\c2cccn2C(C)(C)C)C(=O)NC1=S 100344778 FMLLHBOZGJQOGE-SSZFMOIBSA-N 381.501 3.637 10 40 GHCB COc1ccc2ccc(O)c(CN3CCN(C(=O)c4cccs4)CC3)c2c1 27513372 PTMSEEAKWDMUGL-UHFFFAOYSA-N 382.485 3.574 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)sc2c1CCCC2 4291923 JXLFVINTYJJOLS-RYUDHWBXSA-N 379.478 3.633 10 40 GHCB O=C1NC(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/C=C/c1ccco1 409233100 KEBKQVMXRZDKSX-BOAPOFAJSA-N 392.358 3.686 10 40 GHCB CCN1CCc2cc(/C=C3/C(=O)N=C(O)N(c4ccccc4Cl)C3=O)ccc21 17196083 VYFMURNWQJFQTF-QINSGFPZSA-N 395.846 3.593 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O 408903654 VKWHDNCWBDJNAF-VLURKWGBSA-N 382.391 3.669 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3ccccc3Cl)C2=O)c1C 409245362 ROTCDXZDZAJKOA-GXDHUFHOSA-N 387.892 3.610 10 40 GHCB O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1c(F)cccc1Cl 408787858 AIGWVLYBCGJFBT-XYOKQWHBSA-N 379.174 3.799 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C\c1ccccc1O 409023310 XSZPZGUXRJOTJN-GDNBJRDFSA-N 399.830 3.931 10 40 GHCB CN(C)c1ccc(/C=C2/C(=N)N3N=C(Cc4cccs4)SC3=NC2=O)cc1 33334471 YBNWLXOEZBMKJB-CKLXWILVSA-N 395.513 3.676 10 40 GHCB O=C1/C(=C/c2ccc(-c3ccccc3F)o2)SC(=S)N1N1CCOCC1 13073949 TZBOMEYBGINIRV-WJDWOHSUSA-N 390.461 3.534 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)NC1CCCC1 8709798 LPCDITRAYFTNPF-SFHVURJKSA-N 385.533 3.880 10 40 GHCB O=C1/C(=C/c2cccc([N+](=O)[O-])c2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 16399730 KOEBINNAVCEWSW-ZROIWOOFSA-N 387.398 3.909 10 40 GHCB Nc1ccc2c(O)c(/N=N/c3ccc([N+](=O)[O-])cc3)c(S(=O)(=O)O)cc2c1 4523147 PEMFTJYWFHQQFA-VHEBQXMUSA-N 388.361 3.698 10 40 GHCB O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C/c2nc3ccccc3[nH]2)SC1=S 2195949 FTUMZFGDFHFZCL-DNXIFWLFSA-N 395.465 3.590 10 40 GHCB COc1ccc2c(c1)CCCN2Cc1nnc(C(=O)Nc2ccc(F)cc2)s1 22893289 LGIHTYLHSNRJIN-UHFFFAOYSA-N 398.463 3.891 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)c(C)cc1OC 409081145 GLRJLOPEPGTGIJ-XGHPXPSOSA-N 393.530 3.783 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)cc1 205659185 OKBMQOIPHKFGOX-GZTJUZNOSA-N 383.429 3.897 10 40 GHCB O=C1c2ccccc2C(=O)c2c(NC(=O)c3coc4ccccc4c3=O)cccc21 6345037 APRNMPPBLCYPJY-UHFFFAOYSA-N 395.370 3.821 10 40 GHCB biogenic CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccccc1Br 10906778 NFPDFUXZJFRYIH-UHFFFAOYSA-N 389.293 3.558 10 40 GHCB O=C(O)CCN1C(=O)/C(=C\c2ccc(-c3ccccc3F)o2)SC1=S 6474217 XKYOTPNVJLREHV-NTEUORMPSA-N 377.418 3.762 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2c[nH]c3ccccc23)C1=O 409244779 IPTMLUCQUIEHAO-NTEUORMPSA-N 379.803 3.796 10 40 GHCB CCc1cccc(CC)c1NC(=O)CN1CCN(c2ccc(OC)cc2)CC1 57548451 MXTNUWFEWWRMRJ-UHFFFAOYSA-N 381.520 3.581 10 40 GHCB COc1ccc(N/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1Cl 408530121 ISUJAGGHVYROSR-GXDHUFHOSA-N 399.834 3.544 10 40 GHCB Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)n1-c1ccccc1 223635591 BDXPCPFKIRKDQM-LEWJYISDSA-N 392.528 3.536 10 40 GHCB CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 96193253 MVBVMBNFCKGTDR-ZSOIEALJSA-N 385.763 3.753 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)cc1OCC 1164473 QBFFZLBCKAKVKX-VTLGWQBRSA-N 390.505 3.564 10 40 GHCB Cc1cc(/C=C2/SC(=S)NC2=O)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 59247896 AVAHERCZOVEUHU-MKMNVTDBSA-N 392.889 3.935 10 40 GHCB Cc1ccc(C)c(-c2csc(NS(=O)(=O)c3cccc(C(=O)O)c3)n2)c1 12526240 QJXYTWSTHZBGTE-UHFFFAOYSA-N 388.470 3.926 10 40 GHCB CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N2CCCCCC2)cc1 13809912 NMOSKSWYOZEEAR-PYCFMQQDSA-N 391.515 3.926 10 40 GHCB CC(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 7990507 YKTVOLMTDSRYDA-QFIPXVFZSA-N 395.503 3.532 10 40 GHCB COc1ccc(N2N=C(C)/C(=C(\C)NC3CC(C)(C)NC(C)(C)C3)C2=O)cc1 112121853 LSBGTXGFZNUKBC-RGEXLXHISA-N 384.524 3.591 10 40 GHCB COC(=O)Cn1c(-c2ccccc2)cnc1SCC(=O)Nc1ccc(C)cc1 44085942 YLONQUMOOGRIIQ-UHFFFAOYSA-N 395.484 3.762 10 40 GHCB CC(C)n1[nH]c(=O)c2c(-c3cccnc3)c3oc4c(O)c(O)ccc4c3nc21 85875121 ZCSNUFPPPYMLMZ-UHFFFAOYSA-N 376.372 3.678 10 40 GHCB biogenic O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccccc1OCc1cccc(F)c1 35225058 QFZPCQKBZDRAEG-ZHZULCJRSA-N 388.398 3.866 10 40 GHCB Cc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1F 6383836 XSOLRYHQVGTWMG-UHFFFAOYSA-N 376.387 3.712 10 40 GHCB CCCn1c(SCC(=O)c2cc(C)n(-c3ccccc3F)c2C)n[nH]c1=O 9245704 MBYBDVSXKUJBRS-UHFFFAOYSA-N 388.468 3.503 10 40 GHCB C[C@@H](c1ccccc1)N1C(=O)N=C(O)/C(=C/c2coc3ccccc3c2=O)C1=O 32975769 HFCIWXHMGUJBFK-MFVBVHDHSA-N 388.379 3.856 10 40 GHCB COc1cccc(N[C@@H]2COC3(CCN(Cc4ccc(N(C)C)cc4)CC3)C2)c1 96221480 ZUCIFMHEVZZBAS-NRFANRHFSA-N 395.547 3.997 10 40 GHCB CCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3cccs3)C2=O)cc1 1412492 BUFAYZHWWMWQIJ-GXDHUFHOSA-N 390.511 3.693 10 40 GHCB Cc1cc(C(=O)Cn2c(NCCO)nc3ccccc32)c(C)n1-c1ccccc1 3429106 VNRRPINIMFTTOQ-UHFFFAOYSA-N 388.471 3.731 10 40 GHCB Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCCC4)C3=O)c2C)c1 13055787 HIHHDCBSRIJYOC-UHFFFAOYSA-N 393.487 3.758 10 40 GHCB COc1cccc(NC(=O)COC(=O)c2cccc(-n3c(C)ccc3C)c2)c1 7379153 RDXUZLHVQIQIEV-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/Nc1cc(Cl)cc(Cl)c1 6138849 HENJMTNIFXFPOZ-OQLLNIDSSA-N 390.226 3.568 10 40 GHCB Cc1oc2c(CN(C)C)c(O)ccc2c(=O)c1-c1ccc2c(c1)OCCCO2 19118513 SCXRWQXEFHYUBB-UHFFFAOYSA-N 381.428 3.697 10 40 GHCB biogenic COc1ccc(-n2c(C)cc(C(=O)Cn3ncc4ccccc4c3=O)c2C)cc1 8194681 MLSIFYBOPWJSSE-UHFFFAOYSA-N 387.439 3.696 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C/C(=O)N(C)CC(=O)NC(C)(C)C)c2C)cc1 30944792 XGSVETOZFKVVQY-JLHYYAGUSA-N 381.520 3.789 10 40 GHCB CC[C@@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 222975836 KCBYKYCESRORSU-JOCHJYFZSA-N 395.547 3.529 10 40 GHCB Cc1cc(C)cc(Cc2ccc3ccccc3c2C=C2C(=O)NC(=O)NC2=O)c1 408867521 LJDNEIDQKQADDC-UHFFFAOYSA-N 384.435 3.797 10 40 GHCB O=C(NN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 13646211 NBFWSTXCHOBPOQ-ZROIWOOFSA-N 376.409 3.511 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(N3CCCCC3)cc2)C1=O 4674071 LVCLATWSRQAEOD-CYVLTUHYSA-N 389.455 3.652 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C/c2ccc(OC(C)C)cc2)C(=O)NC1=S 409244975 LNVAIOVPDLWJQU-SFQUDFHCSA-N 380.469 3.614 10 40 GHCB O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCc2ccc(F)cc2)cc1 14257500 YFMUTBKOQXAFGM-STZFKDTASA-N 388.398 3.866 10 40 GHCB CCOc1ccccc1NC1=NC(=O)/C(=C\c2ccc(C(=O)OC)cc2)S1 35647189 KKDYGEPBHPTDPM-SFQUDFHCSA-N 382.441 3.954 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCC3)ccc21 8963352 BGECZPXOTFDARA-NRFANRHFSA-N 385.458 3.524 10 40 GHCB CCN(CC)c1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCc2ccccc2)cc1 847237 SLJQAIUPQUBJDR-OAQYLSRUSA-N 393.487 3.904 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)COc2ccc(Cl)c(C)c2)c1 7496986 SQLQXWPRYXJAJW-UHFFFAOYSA-N 390.867 3.511 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccccc1O 13400085 JBGYKEOECVZLPT-AQTBWJFISA-N 379.412 3.668 10 40 GHCB Cc1cc(C(=O)OCc2cc(=O)n3ccsc3n2)c(C)n1-c1ccccc1 3542746 ZXVGAHWXNJNKLJ-UHFFFAOYSA-N 379.441 3.521 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C/c3nc(O)c([N+](=O)[O-])c(=O)[nH]3)c2C)cc1C 17077731 IJPOCXCCROKXCQ-SOFGYWHQSA-N 380.404 3.578 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc([N+](=O)[O-])ccc3Cl)C2=O)cc1C 408851520 CJEBWPUJNCWHQV-OQLLNIDSSA-N 399.790 3.531 10 40 GHCB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(=O)c1ccccc1 223652719 NXXAQWPKHBMKBJ-UHFFFAOYSA-N 396.424 3.935 10 40 GHCB CCOC(=O)[C@@H](C(C)=O)C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 5499760 VYYVSMSLSURWGL-NRFANRHFSA-N 382.504 3.719 10 40 GHCB CCOc1ccccc1Oc1coc2c(CN3CCOCC3)c(O)ccc2c1=O 20439925 ZPEAKAPIXAPYOF-UHFFFAOYSA-N 397.427 3.522 10 40 GHCB O=C1N=C(O)N(c2ccc(Br)cc2)C(=O)/C1=C\C=C\c1ccccc1 8971680 NLVMTXFZKYDHPR-QSJINSDNSA-N 397.228 3.876 10 40 GHCB O=C1NC(=S)N=C(O)/C1=C\c1cc(Cl)ccc1OCc1ccc(F)cc1 58823021 QJETYFLQRDFQIY-UHFFFAOYSA-N 390.823 3.813 10 40 GHCB CCN(CC)c1ccc(CN(C)CC(=O)Nc2ccc(NC(C)=O)cc2)cc1 8780172 SHFRERNJWNAOFA-UHFFFAOYSA-N 382.508 3.562 10 40 GHCB Cc1cccc(C2=NN3C(=N)/C(=C/c4ccc(N(C)C)cc4)C(=O)N=C3S2)c1 33447012 WLSUCYAKNUSPQJ-SABKFZPKSA-N 389.484 3.728 10 40 GHCB CCOc1c(O)ccc(/C=C2/C(=O)N(c3cccc(C)c3)N=C2C)c1[N+](=O)[O-] 996126 SJAAGLUIKSJTCU-LFIBNONCSA-N 381.388 3.814 10 40 GHCB Cc1cc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c(C)n1-c1ccccn1 131658705 JTZMTVGAWBZUKU-UHFFFAOYSA-N 398.466 3.951 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(OC4CCCC4)cc3)CC2)cc1 648317 AHJAWRUNLRKBCU-UHFFFAOYSA-N 380.488 3.979 10 40 GHCB O=C(NCc1ccccc1O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 58246915 FYCFSNMEPVAMRH-UHFFFAOYSA-N 394.431 3.771 10 40 GHCB CC(C)CCNC(=O)CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 11641366 HAPBQUOUOZCFMA-SFHVURJKSA-N 387.549 3.984 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1C(=O)O 408770410 XECPBASOGWCARC-UYRXBGFRSA-N 391.423 3.961 10 40 GHCB CCc1ccc(/C=C2/SC(=S)N(NC(=O)Cc3ccccc3)C2=O)cc1 35041404 SFKSDMCYTYPUHG-SFQUDFHCSA-N 382.510 3.724 10 40 GHCB Cc1cc2c(cc1C=C1C(=O)N(C)C(=O)N(C)C1=O)[C@@H](C)CC(C)(C)N2C(C)C 223598785 WJRGJTFCJCHAGN-HNNXBMFYSA-N 397.519 3.929 10 40 GHCB O=C(O)c1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 113830667 UMZRWAXWEUZORD-NTEUORMPSA-N 386.410 3.699 10 40 GHCB CCN1CCC2(CC1)Oc1c(OC)cccc1[C@@H]1CC(c3ccc(O)cc3)=NN12 10214582 AZTHIOAKVRRTLW-FQEVSTJZSA-N 393.487 3.756 10 40 GHCB CCOC(=O)COc1ccc(/C=C2\SC(c3ccc(C)cc3)=NC2=O)cc1 12413395 OTAQWQRIJDKLEF-PDGQHHTCSA-N 381.453 3.998 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3ccc(C)cc3)C(C)=C2C(=O)OC)c1O 6964931 WZLIQKBLRLLPMW-AQTBWJFISA-N 393.439 3.977 10 40 GHCB O=C(CN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc(F)c1 1311676 OGWMDOAMSCFISX-JYRVWZFOSA-N 378.475 3.727 10 40 GHCB COc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc([N+](=O)[O-])c1O 36011746 UEIOGLYZGLKTDM-NTEUORMPSA-N 388.426 3.715 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1Cl 408803102 LGKPUGLVIXCPAR-DHZHZOJOSA-N 391.210 3.668 10 40 GHCB CC1=NN2C(=N)/C(=C\c3cc(C)n(-c4ccccc4F)c3C)C(=O)N=C2S1 5516072 FCMZKFOPNDJIHF-OVDNTTTISA-N 381.436 3.872 10 40 GHCB Cc1ccc(C(=O)[C@@H]2Sc3nnc(C)n3N[C@@H]2c2ccc(N(C)C)cc2)cc1 3258349 HUMULPMOVXZNNX-UYAOXDASSA-N 393.516 3.603 10 40 GHCB CCc1cc(=O)oc2c3c(ccc12)OCN(c1cc(OC)c(OC)c(OC)c1)C3 5348303 FYQSMDQYGRNRBO-UHFFFAOYSA-N 397.427 3.738 10 40 GHCB COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 89904571 FNINFASGRZVDQQ-CVEARBPZSA-N 397.475 3.522 10 40 GHCB CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccn2)c1C 222774039 XCUGYBADPQHZHG-PMACEKPBSA-N 377.517 3.877 10 40 GHCB COC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)c1 223794968 MUMRHRKDGBGTGP-UHFFFAOYSA-N 395.436 3.505 10 40 GHCB Cc1ccc(O)c(CN2CCC[C@]3(CC2)CN(c2ccc(F)cc2)C(=O)CO3)c1 2037977788 HUOYDJAXEFXSOD-QHCPKHFHSA-N 398.478 3.628 10 40 GHCB COc1ccc(/C=C2\C(=O)N(CCc3ccccc3)C(=O)N(C(C)C)C2=O)cc1 984537 PDMDCKLRVNYINB-HMMYKYKNSA-N 392.455 3.521 10 40 GHCB Cc1cc(C(=O)[C@H](C)N2CCC(C(N)=O)CC2)c(C)n1-c1ccc(Cl)cc1 57873193 CVRJLVNECLLUMP-HNNXBMFYSA-N 387.911 3.516 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)cc1C 409226272 MOVAAYOYFGJPJD-LDADJPATSA-N 394.496 3.958 10 40 GHCB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(N2CCOCC2)cc1 16160917 MGIMTWNFDHEUGW-MOSHPQCFSA-N 381.863 3.983 10 40 GHCB Cc1[nH]c2ccccc2c1/C=C1/C(=O)NN(c2ccc(Br)cc2)C1=O 6184411 KJDNEPQOBAMCFT-YBEGLDIGSA-N 396.244 3.700 10 40 GHCB Cc1cc(C)cc(OS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 5234105 SASNMFCSEHBKHB-UHFFFAOYSA-N 392.432 3.847 10 40 GHCB COc1ccc(N2C(=O)N=C(O)/C(=C/c3cn(C)c4ccccc34)C2=O)cc1 8994663 WXKKRFFTBPALMC-BOPFTXTBSA-N 375.384 3.694 10 40 GHCB CCN(CC)CCCN1C(=O)/C(=C/c2ccc(OC)cc2OC)SC1=S 5025863 HNYULCTYWICLFN-ATVHPVEESA-N 394.562 3.637 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)cc1 6589021 JRDWZQMCUNBVHH-UHFFFAOYSA-N 386.455 3.603 10 40 GHCB Cc1ccnc(-n2c(C)cc(/C=c3\sc4nc5ccccc5n4c3=O)c2C)c1 9425164 WSABGXMPWFEYMU-UNOMPAQXSA-N 386.480 3.568 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O 408807500 DARZJFKNTYYCCM-WYMLVPIESA-N 384.819 3.795 10 40 GHCB COCCN(CC(=O)N1c2ccccc2CC[C@@H]1C)c1ccc(OC)c(OC)c1 78969924 XPGASGNTIACYOW-KRWDZBQOSA-N 398.503 3.525 10 40 GHCB Cc1cc(/C=C2/C(=O)N=C(S)N=C2O)c(C)n1-c1ccc2ncccc2c1 1275455 ZVKXGNXWJMPLLZ-UHFFFAOYSA-N 376.441 3.808 10 40 GHCB COc1ccc(N2CCN(C(=O)Cc3ccc(Cl)c(Cl)c3)CC2)cc1 1399593 CFEFWVHUIIHKDO-UHFFFAOYSA-N 379.287 3.893 10 40 GHCB Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H]3COc4ccccc4O3)c2C)c1 3350869 XWNIYVABCVESLV-LJQANCHMSA-N 376.456 3.972 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)Cc3ccc(F)cc3)N3CCCC3)ccc21 13008226 WLCTYGFQWRLCEP-QHCPKHFHSA-N 395.522 3.704 10 40 GHCB Cc1cccc(N2C[C@@](O)(c3ccc(OC(F)F)cc3)[N+]3=C2SCCC3)c1 2966119 BIGITDJCOHJDSV-HXUWFJFHSA-N 391.463 3.767 10 40 GHCB CC1=NN(C(=O)c2ccncc2)C(=O)[C@@H]1/N=N/c1ccc(-c2ccc(N)cc2)cc1 104204174 PVPHEEWBXNVLGB-RMBMZXQHSA-N 398.426 3.842 10 40 GHCB CCOc1ccccc1/C=C1/SC(N2CCN(c3ccccc3)CC2)=NC1=O 1471531 GOKDLZXVJRWXTO-CAPFRKAQSA-N 393.512 3.878 10 40 GHCB Cc1ccc(C)c(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)c1 5218938 UWJPKLCGZSCWRQ-NRKWFKHNSA-N 377.473 3.960 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccn2-c2ccccc2C)C1=O 15013784 KZJKHYIGLVQHDV-JXAWBTAJSA-N 385.423 3.761 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1C(=O)O 35648271 JEAWEICNYGWTSH-OVCLIPMQSA-N 399.449 3.797 10 40 GHCB CCN(CC)CCC[C@@H](C)Nc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O 5460270 KAFNBNCBBLYFOI-CQSZACIVSA-N 396.487 3.796 10 40 GHCB O=C1/C(=C\NC2CCCC2)C(C(F)(F)F)=NN1c1nc2ccccc2s1 101104573 HPTGBBAUTCMNRI-LUAWRHEFSA-N 380.395 3.977 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C\c1ccccc1OCc1ccccc1 851135 CUAUJYOXSVQCDG-RGEXLXHISA-N 380.469 3.568 10 40 GHCB Cc1ccc(/C=C2/SC(N3CCN(c4ccccc4F)CC3)=NC2=O)cc1 2378824 CFUAYWFRLSUFPC-XMHGGMMESA-N 381.476 3.927 10 40 GHCB C[C@H](NC(=O)c1cc(-c2ccc(F)cc2)no1)c1ccc(N2CCOCC2)cc1 19659400 OMZBZVNBQPXEII-HNNXBMFYSA-N 395.434 3.808 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C\c1cccc(O)c1 409021868 COXHSDOJRIRLSM-YBEGLDIGSA-N 399.830 3.931 10 40 GHCB COc1cc(/C=C2\SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCC(=O)O 210455294 LBQYEJWIMQOGFX-YVLHZVERSA-N 398.440 3.549 10 40 GHCB O=S(=O)(c1ccc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)cc1)N1CCOCC1 5008402 SNPRHALZSQASCH-VCOUNFBDSA-N 396.512 3.534 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)c2cccc3cccc1c23 57761444 FYUOVXXIPUIGPX-UHFFFAOYSA-N 387.483 3.726 10 40 GHCB COc1ccc(/C=C2\SC(N3CCN(c4ccc(F)cc4)CC3)=NC2=O)cc1 13749310 USENHAMESWAINQ-RGEXLXHISA-N 397.475 3.627 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(O)c(OC)c1 408893930 OPAGIXVBGYMIDG-WQRHYEAKSA-N 393.439 3.895 10 40 GHCB COc1c(C)cc(NS(C)(=O)=O)c(-c2c(O)c(O)cc3ccccc23)c1C 169809400 NNZCRHUWIDDGOA-UHFFFAOYSA-N 387.457 3.915 10 40 GHCB O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(N2CCCCC2)cc1 5394786 SHSUEGBYZSGXMW-UYRXBGFRSA-N 381.863 3.792 10 40 GHCB Cc1cnc(-c2nc([C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)no2)cn1 19239024 KCJZAUXPFLTXSV-CYBMUJFWSA-N 385.855 3.574 10 40 GHCB COC(=O)c1ccccc1N/C=C1/SC(=S)N(CCc2ccccc2)C1=O 101490048 WQOADNDUWKEVOP-GHRIWEEISA-N 398.509 3.830 10 40 GHCB O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C\c2nc3ccccc3[nH]2)SC1=S 27533788 FTUMZFGDFHFZCL-HFQYIWAZSA-N 395.465 3.590 10 40 GHCB CC[C@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 58756685 YFMBXUPZVDQXSW-JOCHJYFZSA-N 394.563 3.731 10 40 GHCB CC(C)NC(=O)NC(=O)CSc1ncc(-c2ccccc2)n1Cc1ccco1 11647722 KAVXCELDVQTFAC-UHFFFAOYSA-N 398.488 3.518 10 40 GHCB CCCOc1ccc(N2CC[C@@H](N(Cc3ccc4c(c3)OCO4)C(C)=O)C2)cc1 4561180 LJCGOZDPJAOKCE-HXUWFJFHSA-N 396.487 3.832 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3C)C2=O)c1C 409102450 ZTMDIHKADKSKDS-GZTJUZNOSA-N 381.501 3.573 10 40 GHCB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c1C 4276426 FEBVIWRQVSPEDM-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3ccccc3Cl)sc2n1 10644853 BEYWZAHGRVXBNK-UHFFFAOYSA-N 389.864 3.944 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1cccc(OC)c1O 408894456 QNYVGMOBNZFUBM-ATVHPVEESA-N 379.412 3.586 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1C(=O)O 35648950 GNVKLEHABQMCOV-FRKPEAEDSA-N 399.449 3.828 10 40 GHCB CC(=O)N(c1nc(/C=C2\SC(=S)NC2=O)cs1)c1cccc(C)c1C 7155233 LTRWMBUCRUWZAZ-AUWJEWJLSA-N 389.527 3.933 10 40 GHCB Cc1cc(C)c(N2C(=O)N=C(O)/C(=C/c3ccc(C(=O)O)cc3)C2=O)c(C)c1 20101002 QJRNXICVMMTENW-YBEGLDIGSA-N 378.384 3.817 10 40 GHCB CCCCOc1ccc(NC(=O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 57711654 FPYWCCVDGWZPHF-UHFFFAOYSA-N 397.519 3.635 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CNc3ccccc3OC)C2=O)cc1 35386054 FKYDLWIOEUVHEW-BOPFTXTBSA-N 386.498 3.975 10 40 GHCB CC(C)Oc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O 408810258 PEOFGLFYLWVKNG-LFIBNONCSA-N 384.819 3.794 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3cc(C)c(O)c(C)c3)C(O)=NC2=S)cc1 38172123 RGIUHNSUIBCSRE-MHWRWJLKSA-N 382.441 3.689 10 40 GHCB CC[C@H](C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 390770384 IUZBIAPAMJMEKV-LHSJRXKWSA-N 377.444 3.810 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2ccc(-c3cccc(Cl)c3)o2)SC1=S 974098 RDJKMVNGMRPGAI-QPEQYQDCSA-N 379.846 3.886 10 40 GHCB COc1cccc2c1OC1(CCN(C)CC1)N1N=C(c3cc(C)ccc3O)C[C@H]21 10214498 ABTSMSBRYGFSQH-LJQANCHMSA-N 393.487 3.675 10 40 GHCB COc1ccc([C@@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)cc1 16953444 WEDIZHLJZFDESA-IBGZPJMESA-N 375.901 3.519 10 40 GHCB CC(=O)c1sc(NS(=O)(=O)c2ccc(F)cc2)nc1-c1ccccc1 9550360 GOZNCZWZWMFDJX-UHFFFAOYSA-N 376.434 3.953 10 40 GHCB CCCC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1O 101550018 IXSXFYNEGSEYJL-RVDMUPIBSA-N 395.371 3.585 10 40 GHCB COc1cccc(COC[C@H](O)CN(Cc2ccco2)Cc2ccccc2O)c1 6082952 HZWXLMBCCIPKQM-HXUWFJFHSA-N 397.471 3.574 10 40 GHCB CCc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=CSC4=NC3=O)c2C)cc1 33457399 FKOMMLUYPNLZQC-LVKBRKGQSA-N 377.473 3.906 10 40 GHCB CCN(CC)c1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 255190220 VSGSFMSJZDFDJQ-UHFFFAOYSA-N 383.857 3.895 10 40 GHCB O[C@]1(c2cccs2)CN(c2ccc(Br)cc2)C2=[N+]1CCCS2 13635437 XFVLQWKDKBTJAP-INIZCTEOSA-N 396.355 3.681 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)O)sc2c1CCC2 5408482 FELSALOMWGPMNN-KGLIPLIRSA-N 391.489 3.799 10 40 GHCB Cc1c(Cl)cccc1N1C[C@](O)(c2ccc(F)cc2)[N+]2=C1SCCC2 27525625 RZQDDDNRXWSNNX-IBGZPJMESA-N 377.892 3.958 10 40 GHCB Cc1cc(C(=O)Cn2nc(-c3cccs3)oc2=O)c(C)n1-c1ccccc1F 15399019 QKSZFXNUHBLOEU-UHFFFAOYSA-N 397.431 3.994 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)cc1 107678647 FFZVVCVLWLYXHJ-WIXUPIFPSA-N 396.493 3.798 10 40 GHCB Cc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)o1 58865883 UYQZAUFJJZIFRN-UHFFFAOYSA-N 383.356 3.917 10 40 GHCB COc1ccc(/C=C2\SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)cc1OC 4193759 PNLXGCMOANAONS-MFOYZWKCSA-N 398.440 3.793 10 40 GHCB Cc1cc(C(=O)COC(=O)Cc2cccs2)c(C)n1-c1ccc2c(c1)OCO2 5225880 ZDOAJKIIKBWULH-UHFFFAOYSA-N 397.452 3.853 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(NC(=O)c2cccnc2)C1=O 5376127 HKSSAIYIDJUMME-WFVPKAAFSA-N 381.482 3.574 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1ccc2c(c1)oc(=O)n2C 16160810 RIFLVVAYDYKWCF-GDNBJRDFSA-N 382.807 3.503 10 40 GHCB COc1ccc(N2CCN(C(=O)Cc3ccc(Cl)cc3Cl)CC2)cc1 2640713 WRBOTJWAGUAOQY-UHFFFAOYSA-N 379.287 3.893 10 40 GHCB O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C\c1cccc(O)c1 9187971 SMLWYKZUVYRJLB-PDGQHHTCSA-N 399.903 3.838 10 40 GHCB O=C1N=C(O)/C(=C\c2ccccc2O)C(=O)N1c1ccc(Br)cc1 59198139 VDNSEFMTZSVLPO-UKTHLTGXSA-N 387.189 3.661 10 40 GHCB COc1cc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)cc(OC)c1 6627202 YGNUVHLICPPYNH-GDNBJRDFSA-N 395.502 3.550 10 40 GHCB CN(C)c1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 9232510 KLEKCVFPEXBGOM-LICLKQGHSA-N 384.482 3.887 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)c1ccc(Cl)cc1 40940239 YQIXXLZVYQXQKZ-NTEUORMPSA-N 390.873 3.592 10 40 GHCB O=C1/C(=C/c2cccc3nccnc23)SC(=S)N1c1ccc2c(c1)OCO2 13722546 YIQWANZCIFHQGG-PXNMLYILSA-N 393.449 3.764 10 40 GHCB COc1cc(N2COc3ccc4c(C)c(C)c(=O)oc4c3C2)cc(OC)c1OC 5348908 ANRMUWFOYNADFZ-UHFFFAOYSA-N 397.427 3.792 10 40 GHCB COC(=O)c1cc2ccccc2c(CN2CCN(c3ccccc3)CC2)c1O 25105091 UNGCTHANPFZQOH-UHFFFAOYSA-N 376.456 3.654 10 40 GHCB COc1ccccc1[C@@H](c1ccc2c(OC)cccc2c1O)N1CCOCC1 20625049 DYHRMNRAJQLQAP-QFIPXVFZSA-N 379.456 3.984 10 40 GHCB Cc1cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1Br 7146464 QNIBKDYRNMNUDI-UHFFFAOYSA-N 397.338 3.644 10 40 GHCB COC(=O)C1=CN(c2ccc(C)c(Cl)c2)c2cc(F)ccc2S1(=O)=O 64979212 NRUUWDRNCMTCRC-UHFFFAOYSA-N 381.812 3.727 10 40 GHCB O=C(O)CCN1C(=O)/C(=C/c2ccc3cccc(Cl)c3n2)SC1=S 6660449 GMDDYDIZPNURAT-WQLSENKSSA-N 378.862 3.564 10 40 GHCB O=C(NCc1ccc(N2CCSCC2)cc1)c1cnc(-c2ccccc2)nc1 66919580 AYKPLPUFFNQJOO-UHFFFAOYSA-N 390.512 3.627 10 40 GHCB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1cc(C)n(-c2cc(C)ccc2OC)c1C 409056295 CHOVBSGUHSMGRG-PDGQHHTCSA-N 394.471 3.714 10 40 GHCB COc1cc(Cl)c(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1OC 409093243 ZLXCBQUSUVALHF-URXIRXLPSA-N 399.921 3.737 10 40 GHCB N=C1Nc2nc3ccccc3n2[C@H](c2cc(Br)cc(Cl)c2O)N1 575442910 XTSYOQCKHCUKRI-CYBMUJFWSA-N 392.644 3.655 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1 5794877 FFDCUWZLVLGEAV-DTQAZKPQSA-N 397.862 3.853 10 40 GHCB Cc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)s1 13773606 BMFVJUHCULECMA-JYRVWZFOSA-N 380.347 3.742 10 40 GHCB O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C/C=C/c2ccco2)SC1=S 4356986 XUMNCGLQAXIZJU-IFQDGVJDSA-N 385.466 3.733 10 40 GHCB Cc1ccccc1NC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2)cs1 6681737 FLIKSCRFZGNZTG-UHFFFAOYSA-N 388.470 3.815 10 40 GHCB CCC(CC)C(=O)c1c[nH]c(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 1403949 KZIFGOUOMCAJSW-UHFFFAOYSA-N 383.492 3.605 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(Br)s1 10906749 RBMPHPJDMUUCNL-UHFFFAOYSA-N 395.322 3.619 10 40 GHCB CCc1ccccc1N/C(C)=C1\C(=O)N(c2ccccc2)N=C1CC(=O)OC 112119878 OSAIYADSAFNQJV-QNGOZBTKSA-N 377.444 3.901 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C\c3cnc4ccccc4n3)SC2=S)c1 13719348 SXQXLLCDVMUPMB-CXUHLZMHSA-N 393.449 3.734 10 40 GHCB Cc1cc(/C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(Cl)c(C(=O)O)c1 4688377 DXTUXIZELWWQPC-MKMNVTDBSA-N 376.821 3.770 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(Cc3ccccc3)C2=O)c2ccccc12 409149851 SKYUOTDFZBQKNJ-CPNJWEJPSA-N 386.407 3.510 10 40 GHCB COc1cc(N/C(C)=C2\C(=O)N(c3ccccc3)N=C2C)cc(OC)c1OC 100423028 UMBNZCREXNSTMY-UYRXBGFRSA-N 381.432 3.821 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)c(C)n1C1CCCC1 665192 NYIVNNBOJCGRQK-MOSHPQCFSA-N 391.471 3.882 10 40 GHCB CCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O 408810633 PPHAUOXFASAGLE-FOWTUZBSSA-N 384.819 3.795 10 40 GHCB CCOc1cccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c1 408867155 JCVAXEDEJXEGOY-RVDMUPIBSA-N 384.819 3.714 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)cc1 5235962 VOVSTLAAQXJFJC-YBEGLDIGSA-N 394.481 3.927 10 40 GHCB COc1ccc(N2C(=O)c3ccccc3N(C)[C@H]2c2ccc(O)c(O)c2)cc1 23624191 FRHZKVYYSAFBHY-OAQYLSRUSA-N 376.412 3.902 10 40 GHCB CCc1ccc2c(c1)C(C)(C)[C@@]1(/C=C/c3ccc(N(C)C)cc3)NC(=O)CN21 2114052 YYNKLAXNLRKKGI-XXFRDUSWSA-N 375.516 3.952 10 40 GHCB biogenic CN1C(=O)C(=Cc2ccc(Sc3ccc(Cl)cc3)o2)C(=O)N(C)C1=S 32192945 YBZDXQLBCKNMIS-UHFFFAOYSA-N 392.889 3.683 10 40 GHCB COc1ccc(N2CCN(c3nccn4nc(-c5ccccc5)cc34)CC2)cc1 33266310 OPXQWWPTOWTDHK-UHFFFAOYSA-N 385.471 3.732 10 40 GHCB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1c(Cl)cccc1Cl 6654838 FQQCKLRRVRDVAZ-CJAAZZPWSA-N 396.270 3.845 10 40 GHCB Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)o1 58865889 LZZNEUXZTUFXPH-UHFFFAOYSA-N 383.356 3.917 10 40 GHCB COc1cc(OC)cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 5198010 OAVRTXFIBDOFBA-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB CC1=NN2C(=N)/C(=C\c3cc(C)n(-c4cccc(F)c4)c3C)C(=O)N=C2S1 5140225 IDNJLCMOZQKWQH-WCCNDZKRSA-N 381.436 3.872 10 40 GHCB CCc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3ccc(O)cc3)C2=O)cc1 1186591 XQJANDOWXUXFJA-BOPFTXTBSA-N 398.509 3.795 10 40 GHCB Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 4147456 HGPRFHBCJVCPLI-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB CC1=NN(c2ccc(C)c(Cl)c2)C(=O)/C1=C\Nc1ccc(C(=O)O)c(O)c1 408534590 WDNKFIKJELUGFX-DHDCSXOGSA-N 385.807 3.771 10 40 GHCB CCN1C(=O)/C(=C/C=C2/SCCN2CCc2ccccc2)SC1=S 30721820 VKSRNPAPESYEEW-IZKYPSLPSA-N 376.572 3.883 10 40 GHCB CCN(CC)c1ccc(CNS(=O)(=O)Cc2c(F)cccc2Cl)cc1 225386057 AHDAWMHTNJSQNI-UHFFFAOYSA-N 384.904 3.945 10 40 GHCB O=C(NN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)C1CCCCC1 5552687 CUVBTNHRLTZFRB-YBEGLDIGSA-N 385.514 3.981 10 40 GHCB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 58865535 VQJWPNKDFNIXFB-UHFFFAOYSA-N 383.356 3.999 10 40 GHCB CCN(CC)c1ccc(CNc2ccc(N3CCOCC3)c(C(=O)O)c2)cc1 57122058 KAMRWMOLBWEGHL-UHFFFAOYSA-N 383.492 3.680 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1ccccc1O 408722133 FDJSNCXARXOEBL-YRNVUSSQSA-N 393.251 3.530 10 40 GHCB Cc1cccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 6747945 PJMZSSWPTFLSGS-JOCHJYFZSA-N 382.504 3.648 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)c1C 408818458 YAEXNEJNVQEGQQ-SFQUDFHCSA-N 378.428 3.757 10 40 GHCB COc1ccc(N2CCN(C(=O)CCC3CCCCC3)CC2)c([N+](=O)[O-])c1 4624129 QTSGXMQBFGQMRS-UHFFFAOYSA-N 375.469 3.613 10 40 GHCB COc1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc1Br 1405969 JOTCORZNQPWTPE-UHFFFAOYSA-N 381.222 3.602 10 40 GHCB COc1ccc(C(=O)C2CCN(C(=O)/C=C/c3ccc(N(C)C)cc3)CC2)cc1 26132328 QVWLDWGZDATLCH-AWNIVKPZSA-N 392.499 3.896 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccc(Cl)cc1 2258356 OLTXWQJXYQZUDA-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB CCCCOc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1OCC 15012156 SPYMTPPAAQJBEA-XNTDXEJSSA-N 395.502 3.550 10 40 GHCB COC(=O)COc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1 409329687 GZRWKSKCIQSFSK-GZTJUZNOSA-N 399.493 3.640 10 40 GHCB COc1cc(/C=C2\SC(=S)NC2=O)ccc1OC(=O)c1cccc(F)c1 408895930 OLFCOFDXHASDRH-NVNXTCNLSA-N 389.429 3.542 10 40 GHCB CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 223005052 DXDGDZFKMWKCOR-HSZRJFAPSA-N 395.547 3.529 10 40 GHCB CN(C)c1ccc(/C=C2/SC(N3CCN(c4ccccc4)CC3)=NC2=O)cc1 955366 XEJKGIAGZWRRKJ-CAPFRKAQSA-N 392.528 3.545 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)c2ccc3c(c2)OCCO3)cc1 6865677 DLPYXARFKZJFSE-UHFFFAOYSA-N 391.423 3.905 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C\c2ccc(N(C)C)cc2)S1 35043502 JOQVSGKKJRQJLO-LICLKQGHSA-N 381.457 3.842 10 40 GHCB O=C(NCc1ccc(N2CCOCC2)cc1)/C(=C/c1ccco1)c1ccccc1 10113301 NCEPJGOPQCTOCZ-HAVVHWLPSA-N 388.467 3.973 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1 408817796 WHJMHHJURSHQFG-XMHGGMMESA-N 378.428 3.704 10 40 GHCB COc1ccc([C@@H]2CCCCCN2CC(=O)NCc2ccc(N(C)C)cc2)cc1 9468407 OIJGLIJTJIWHRP-QHCPKHFHSA-N 395.547 3.995 10 40 GHCB Cc1cccc(Cn2cccc2/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)c1 13550102 IEBVSBAHUNWETM-XDHOZWIPSA-N 389.411 3.940 10 40 GHCB COc1ccccc1NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCC1 22418413 FULHDPGLMZEWEN-FQEVSTJZSA-N 382.508 3.720 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1 409231080 BFLMVVLAMMBMLQ-XPNFCJTCSA-N 396.830 3.880 10 40 GHCB CCc1ccc(/C=C2\SC(Nc3cc(C(=O)O)cc(C(=O)O)c3)=NC2=O)cc1 16928270 WTRCGIBINMZVAT-APSNUPSMSA-N 396.424 3.728 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc4ccccc4c3)CC2)c([N+](=O)[O-])c1 6027255 IYUACBHBZHUVMH-UHFFFAOYSA-N 391.427 3.719 10 40 GHCB CC1(C)OC(=O)C(=Cc2ccc(-c3ccc(Cl)c(C(=O)O)c3)o2)C(=O)O1 4505958 KKYNHDQGFRBQTE-UHFFFAOYSA-N 376.748 3.518 10 40 GHCB CCOc1cccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)c1 408966645 NGVQKSQOBIZZHQ-UKTHLTGXSA-N 392.889 3.632 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 1281967 XPMUWHVBFWYFSV-MFVBVHDHSA-N 399.493 3.940 10 40 GHCB CC(/C=C1\SC(=S)N(CC(=O)Nc2ccccn2)C1=O)=C\c1ccccc1 4140164 TVGVNRGGWHBBPF-YUTYINLDSA-N 395.509 3.868 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C/c2ccc3c(c2)OCO3)S1 54164400 VVHZQALURHJMQL-APSNUPSMSA-N 382.397 3.504 10 40 GHCB CN1C(=O)/C(=C\c2cc(Br)c(Br)o2)SC1=S 5719679 QXIPPEDBKWPYFQ-ZZXKWVIFSA-N 383.086 3.636 10 40 GHCB COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 89904569 FNINFASGRZVDQQ-HZPDHXFCSA-N 397.475 3.522 10 40 GHCB COC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=O)NC3=O)c2C)cc1Cl 408820302 VIHCQKHINOYKHE-CHHVJCJISA-N 390.848 3.858 10 40 GHCB CN1CCN(Cc2cc(CNC3(c4ccccc4F)CCCC3)ccc2O)CC1 19590063 RMYLFPZPIDTXQK-UHFFFAOYSA-N 397.538 3.838 10 40 GHCB CC1=NN(c2cccc3ccccc23)C(=O)/C1=C/Nc1ccc(C(=O)O)c(O)c1 101113994 HYZAIDIXTHGUKT-LDADJPATSA-N 387.395 3.962 10 40 GHCB CCN1CCCc2ccc(/C=C3/SC(=S)N(CCCC(=O)O)C3=O)cc21 12274224 ZTDYYAKNWPJESL-FOWTUZBSSA-N 390.530 3.525 10 40 GHCB CCN1c2cc(C)c(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2[C@H](C)CC1(C)C 113792247 NAWSKXJYDYCSOI-CQSZACIVSA-N 399.560 3.706 10 40 GHCB COc1ncnc2c1N=C1CC(C)(C)CC(NCCCCCC(=O)O)=C1S2 8775301 RLCZCROUZVFRDW-UHFFFAOYSA-N 390.509 3.930 10 40 GHCB COC(=O)c1cccc(NC(=S)NCc2ccc(N3CCCC3)cc2)c1C 225424252 WBDDWUKDMDLNDI-UHFFFAOYSA-N 383.517 3.868 10 40 GHCB Cc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3C)c2C)nc1 222748338 USHSVLMXKDTNDK-WOJBJXKFSA-N 377.517 3.795 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3ccc(F)cc3)C2=O)cc1 408967392 VLELUCCGNMSWPY-CPNJWEJPSA-N 389.386 3.591 10 40 GHCB CCN(CC)c1ccc(/C=c2/sc3nnc(-c4ccccc4C)n3c2=O)cc1 13108907 OHBSLURBCZIRKJ-XMHGGMMESA-N 390.512 3.520 10 40 GHCB COCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc(C)n1-c1ccccc1 223033192 GQZWWWHCJIREGW-RTWAWAEBSA-N 392.528 3.800 10 40 GHCB COc1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc(OC)c1OC 13672631 NLFIZXXMNQMICR-UHFFFAOYSA-N 384.476 3.633 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)Nc3ccc4oc(=O)[nH]c4c3)c2C)c1 30252939 UGENITIBADDQBK-UHFFFAOYSA-N 377.400 3.790 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)ccc1O 5345826 RIMNAIQAFKNDIH-APSNUPSMSA-N 396.449 3.978 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OC(C)C)cc3)C2=O)c(C)c1 408813836 YQNKMHDICWHPQI-LDADJPATSA-N 378.428 3.757 10 40 GHCB Cc1oc(-c2ccccc2)nc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 10906722 MLJLHHPTQDDLHT-UHFFFAOYSA-N 391.471 3.759 10 40 GHCB CN(CC(=O)N1CCC(c2ccccc2)=N1)Cc1ccc(N2CCCCC2)cc1 15571610 SHCYNLWFRBXWFH-UHFFFAOYSA-N 390.531 3.745 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)cc1C 408806384 MVUJCRGJKNUCAU-LDADJPATSA-N 378.428 3.757 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NN(c3cccc(Cl)c3)C2=O)c(OC)c1 4046433 BTFFHRPQBYDBKY-WOJGMQOQSA-N 399.878 3.656 10 40 GHCB Cc1cc(C(=O)N2CC[C@H](OCc3ccccn3)C2)c(C)n1-c1ccccc1 79110763 BQBJDMMQFMEZLB-NRFANRHFSA-N 375.472 3.920 10 40 GHCB CCOC(=O)c1cc(Br)cc(Br)c1/N=N\N(C)O 104188077 KPZAXRATKGQUAI-YPKPFQOOSA-N 381.024 3.708 10 40 GHCB CCc1ccc(/C=C2\SC(=S)N(CCC(=O)Nc3cccnc3)C2=O)cc1 16770024 IZBZZMZLSUFGPU-ATVHPVEESA-N 397.525 3.874 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)C[C@@H](C)O3)C1=O 408710845 PJNCAQODUHJLQF-GFQQVXNGSA-N 396.830 3.638 10 40 GHCB Cc1nc(-c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)cs1 19104330 TUKKEIYMNAVXDS-UHFFFAOYSA-N 388.499 3.924 10 40 GHCB O=C(CSc1nccs1)NC1(c2ccc3c(c2)OCCO3)CCCC1 52914208 ZFLNDPOGMCLWFK-UHFFFAOYSA-N 376.503 3.592 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C/c1ccc(-c2nc3ccccc3s2)o1 818828 SSGHXTSRAWMUBC-LFIBNONCSA-N 397.481 3.859 10 40 GHCB O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C\c2nc3ccccc3[nH]2)SC1=S 27533791 FTUMZFGDFHFZCL-DKGMDFAASA-N 395.465 3.590 10 40 GHCB O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1c(O)ccc2ccccc12 408898094 ULTRKDNWCJAZTL-RVDMUPIBSA-N 392.798 3.865 10 40 GHCB Cc1oc2c(CN3CCOCC3)c(O)ccc2c(=O)c1-c1ccc(Cl)cc1 20358265 QMOAHJJCHBVZHQ-UHFFFAOYSA-N 385.847 3.960 10 40 GHCB biogenic CCN(CC)c1ccc(/C=C2\CCn3c2nc2cc(C(=O)O)ccc2c3=O)cc1 12534460 KLEVOVNUDBVICA-DTQAZKPQSA-N 389.455 3.885 10 40 GHCB COc1ccc([C@@]2(O)CN(c3cccc(C)c3C)C3=[N+]2CCCS3)c(F)c1 4086764 ZECBRKOKGPNOTB-NRFANRHFSA-N 387.500 3.622 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)NC2=S)cc1C 677828 MTMTXAJVUYBVKH-LICLKQGHSA-N 375.453 3.616 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C/c1ccc2noc(-c3ccccc3)c2c1 5013236 PETNAGMKHUFYLP-QGOAFFKASA-N 391.452 3.797 10 40 GHCB CCOC(=O)COc1ccc2ccccc2c1/C=C1/SC(=S)N(C)C1=O 4740084 SRQVKRXFDMKIQP-MHWRWJLKSA-N 387.482 3.613 10 40 GHCB CCCOc1cc(N(CC)CC)ccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 17136164 WIPJEVNJTPDMLZ-HKWRFOASSA-N 393.487 3.783 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccccc2C)C1=O 2446031 PQUMTDRWERLVRY-WJDWOHSUSA-N 384.482 3.550 10 40 GHCB Cc1cccc(N2CCN(CN3C(=O)/C(=C\c4ccco4)SC3=S)CC2)c1 20080777 OYSFKYLDMGCQMO-QGOAFFKASA-N 399.541 3.569 10 40 GHCB CNC(=O)COc1ccc(NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 104535138 LMXWAJKZKCLZSF-UHFFFAOYSA-N 391.471 3.780 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)Nc3ccccc3C)sc2n1 12553886 SMUQTKJNDYIUTI-ZDUSSCGKSA-N 383.473 3.988 10 40 GHCB COc1ccccc1NC(=O)Cc1noc(-c2sc3ccccc3c2O)n1 12978222 MYDSHVYZWZXWQV-UHFFFAOYSA-N 381.413 3.847 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2C)C1=O 408809162 KLKLPXSDYYVQJG-GHRIWEEISA-N 378.428 3.759 10 40 GHCB COc1ccc2c3c(n(Cc4ccncc4)c(=O)c2c1OC)-c1ccccc1C3=O 524731923 PCECIEHUMPZDMQ-UHFFFAOYSA-N 398.418 3.673 10 40 GHCB biogenic Cc1cc(/C=C2/Sc3ccccc3N2C)cc(C)[n+]1CCCN1CCOCC1 33405735 VKGRSCMEXOSJDA-UHFFFAOYSA-N 396.580 3.854 10 40 GHCB COc1cc(/C=C2/SC(N3CCCC[C@H]3C)=NC2=O)cc(OC)c1OC 83313503 ZVWJLAPBFIATOJ-PILJQMSFSA-N 376.478 3.557 10 40 GHCB CCOc1ccc(N2C[C@](O)(c3ccc(C)cc3C)[N+]3=C2SCCC3)cc1 2965990 WZHJAWGKKDXHFQ-QFIPXVFZSA-N 383.537 3.873 10 40 GHCB CC1CCN(C(=O)CCCN2C(=O)/C(=C\c3ccco3)SC2=S)CC1 4745569 ORKYGSAHPDRMCB-NTCAYCPXSA-N 378.519 3.520 10 40 GHCB O=C1N=C(N2CCN(c3ccc(F)cc3)CC2)S/C1=C\c1ccc(F)cc1 9189286 ZWBUOTHNHJVUPC-AQTBWJFISA-N 385.439 3.757 10 40 GHCB Cc1cc(C(=O)CSc2n[nH]c(N)n2)c(C)n1-c1cccc(C(F)(F)F)c1 6606502 NFHVWOAWXBZZHO-UHFFFAOYSA-N 395.410 3.788 10 40 GHCB C[C@H]1CN2C(=N[C@H](c3ccccn3)[C@@H]2c2ccc(N3CCOCC3)c(F)c2)S1 222596910 QSKQZWHMIVMZQO-KPOBHBOGSA-N 398.507 3.647 10 40 GHCB COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1cccc(OC)c1O 408891551 ADPMFQPOJHALGG-VVTMIQRTSA-N 393.439 3.835 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nc(-c4ccccc4C)nn3c2=O)cc1 13750365 YPWWLOVWIXQBSK-RGEXLXHISA-N 390.512 3.520 10 40 GHCB C[C@@H]1CN(c2ccc(CNC(=O)c3cn(C)c4ccccc34)cc2F)C[C@@H](C)O1 65475761 GTRURBXULHNHMT-HZPDHXFCSA-N 395.478 3.861 10 40 GHCB Cc1cc(C(=O)COC(=O)C2CC2)c(C)n1-c1cccc(Br)c1 5711234 JXKVCASULBIUBG-UHFFFAOYSA-N 376.250 3.993 10 40 GHCB COCCn1c(C)cc(/C=C2/C(=O)N(c3cccc(C)c3)C(=S)N=C2O)c1C 5815389 NWDGRKJBSYXOFG-LDADJPATSA-N 397.500 3.731 10 40 GHCB COCCN(Cc1ccccc1)C(=O)CSc1ncc(-c2ccccc2)n1C 7210740 YPIHAEGLXPQFEO-UHFFFAOYSA-N 395.528 3.854 10 40 GHCB COCCCN1C(=O)S/C(=C/c2ccc(N(C)C)c(Br)c2)C1=O 409221330 OPNLQWQUEZPLGY-GXDHUFHOSA-N 399.310 3.588 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)cc1C 223696241 MWISETWDKIBVQH-MRXNPFEDSA-N 388.533 3.718 10 40 GHCB CCOc1cc([N+](=O)[O-])c(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc1OC 96193419 WRSLFSNPAPKCKN-YBEGLDIGSA-N 381.388 3.808 10 40 GHCB CCc1cc2c(=O)c(-c3ccc4c(c3)OCCO4)coc2c(CN(C)C)c1O 630490 OBVFJCCARDWRFB-UHFFFAOYSA-N 381.428 3.561 10 40 GHCB biogenic CN1CCN(Cc2c(O)ccc3occ(C(=O)c4ccc(Cl)cc4)c23)CC1 105090118 PMSXGZGYATWSFW-UHFFFAOYSA-N 384.863 3.770 10 40 GHCB O=C(CN1C(=O)/C(=C\c2ccccc2F)SC1=S)OC1CCCCC1 1239053 SFRLMFYKHUPWDP-XNTDXEJSSA-N 379.478 3.903 10 40 GHCB Cc1cccc(-c2n[nH]c(=S)n2CCC(=O)NCc2ccc(N(C)C)cc2)c1 12587884 SCZNKRXMQGVEMF-UHFFFAOYSA-N 395.532 3.689 10 40 GHCB CC(C)C(=O)N1CCN(c2cccc(NC(=O)c3ccccc3Cl)c2)CC1 12655668 BAWYYSSXWXHUGM-UHFFFAOYSA-N 385.895 3.897 10 40 GHCB COCCCNCc1c(O)ccc2c(=O)c(-c3ccccc3OC)c(C)oc12 57312258 JWPQLZYJZRSVMQ-UHFFFAOYSA-N 383.444 3.609 10 40 GHCB CC(C)CCN1C(=O)/C(=C/N2CCN(c3ccccc3)CC2)SC1=S 30819351 OAAMMSMEJYIZAM-VKAVYKQESA-N 375.563 3.556 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cc1OCC 16684192 INXBTRFXNNCXRX-PTNGSMBKSA-N 395.502 3.550 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)NC3(c4noc(C)n4)CCCC3)c2C)c1 65565801 MKZCZALMJAIELA-UHFFFAOYSA-N 394.475 3.993 10 40 GHCB COc1cc(/C=C2/SC(=S)NC2=O)ccc1OCCOc1ccccc1 4954209 FGHXDPJMEXQOBO-SFQUDFHCSA-N 387.482 3.642 10 40 GHCB CC1=NN(c2ccc(C)c(Cl)c2)C(=O)/C1=C\Nc1ccc(O)c(C(=O)O)c1 408531521 KPZMIPGBCSOWED-DHDCSXOGSA-N 385.807 3.771 10 40 GHCB CC1CCN(CC(=O)N2N=C(c3ccsc3)C[C@@H]2c2ccccc2O)CC1 226779785 SKNAUDSJSLSISQ-LJQANCHMSA-N 383.517 3.863 10 40 GHCB CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C/c1ccc(C(C)C)cc1 5876767 IDCDZBGWXYTZGF-XDHOZWIPSA-N 384.457 3.863 10 40 GHCB COc1ccc(N2N=C(C)/C(=C/Nc3c(C)cc(C)cc3[N+](=O)[O-])C2=O)cc1 16267612 MUWFNNTUCWYOIQ-BOPFTXTBSA-N 380.404 3.939 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(O)c(OCC)c2)SC1=S 5372093 UHXLRUIWMIQOJE-GQVHDAKQSA-N 395.502 3.636 10 40 GHCB Cc1cc(C)c(C)c(S(=O)(=O)NC2=CC(=S)C(=O)c3ccccc32)c1C 11615801 MFDRVHSBJNOQSP-UHFFFAOYSA-N 385.510 3.806 10 40 GHCB COc1ccc(Br)c(C=C2C(=O)OC3(CCCCC3)OC2=O)c1 58865781 RTJFRZVVZRKJGM-UHFFFAOYSA-N 381.222 3.602 10 40 GHCB Cc1ccc(CN2C(=O)N/C(=C/c3cc(C)n(-c4cccnc4)c3C)C2=O)cc1 409237723 LEORDLWVUHSHKF-CIAFOILYSA-N 386.455 3.890 10 40 GHCB COCCn1c(C)cc(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)c1C 409138525 DDFOGBXZJJEPCK-YVLHZVERSA-N 387.530 3.548 10 40 GHCB N#Cc1ccccc1COc1ccccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 35112863 ZEBXDXVKSYMRCS-STZFKDTASA-N 395.418 3.599 10 40 GHCB CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1O[C@H](C)CC 409409942 XXVNSEJGEAESCC-QLENYVDCSA-N 380.444 3.724 10 40 GHCB CC[C@@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217028296 RHMAMRXHFSLOHS-JOCHJYFZSA-N 395.547 3.529 10 40 GHCB COc1cc(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c1OC(C)C 33696056 DZKOYKTUOQIMRP-YBEGLDIGSA-N 386.835 3.597 10 40 GHCB CN(c1ccc(CNC(=O)c2cccc3c2OCC(=O)N3)cc1)C1CCCCC1 97551736 HQWDDNCFOFOSDG-UHFFFAOYSA-N 393.487 3.716 10 40 GHCB CCCCOC(=O)CCN1C(=O)/C(=C/c2ccc(OC)cc2)SC1=S 3196731 OVUDEKNDMMQKFL-QINSGFPZSA-N 379.503 3.630 10 40 GHCB CCc1cc(=O)oc2c(CNC3CCN(Cc4ccccc4)CC3)c(O)ccc12 57140833 HIAAXAVZVZQMPG-UHFFFAOYSA-N 392.499 3.815 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C\c3cnc4ccccc4n3)SC2=S)cc1 7907559 ASFIZTONCTXEEV-CXUHLZMHSA-N 393.449 3.734 10 40 GHCB O=C(O)c1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(O)cc3)C2=O)cc1 408758477 KQZHUXUSHUXGCK-XSFVSMFZSA-N 384.391 3.925 10 40 GHCB CN1C(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)C(O)=NC1=S 33709760 AVZUDASLUWHGRZ-AQTBWJFISA-N 391.496 3.736 10 40 GHCB CN1C(=O)/C(=C\c2ccc(C(=O)N3CCc4ccccc4C3)cc2)SC1=S 5374812 AFBDWSVXWZPFJV-LDADJPATSA-N 394.521 3.716 10 40 GHCB CSCC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S 4619899 XVJQAAPMSJQAQB-OYGDSYQHSA-N 387.935 3.748 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)SC1=S 1756243 VCALAHVGQVBMSG-QPEQYQDCSA-N 379.846 3.886 10 40 GHCB COc1ccccc1NC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 10262359 NCXRVPBZSSJJOK-LJQANCHMSA-N 383.492 3.974 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)cc1C 5249973 IRIQWDIOSRYVSM-DVUFLMGDSA-N 377.473 3.960 10 40 GHCB CN1C(=O)N=C(O)/C(=C/c2ccc3c(c2)CCCN3Cc2ccccc2)C1=O 33438830 RUZKFRUPDCHLPI-AQTBWJFISA-N 375.428 3.571 10 40 GHCB Cc1ccc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2O)cc1[N+](=O)[O-] 59135959 YBPBWZJICMIBDI-XYOKQWHBSA-N 385.376 3.714 10 40 GHCB COc1ccc(OC)c(N/C=C2/C(=O)N(c3ccc(C)c(C)c3)C(=O)N=C2O)c1 103116579 ZCYLKGPLZIYPAX-LFIBNONCSA-N 395.415 3.740 10 40 GHCB CCN1C(=O)S/C(=C/c2cc(C)n(-c3cccc(C(=O)OC)c3)c2C)C1=O 409098984 RTPVXCPTAAKOPH-GZTJUZNOSA-N 384.457 3.937 10 40 GHCB Cc1ccccc1C(=O)NC[C@H](c1ccc2c(c1)CCCN2C)N1CCCC1 13008201 OOQIGYNPYJSIGA-HSZRJFAPSA-N 377.532 3.944 10 40 GHCB Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)c(C)n1-c1cccc(F)c1 5623819 FOHWSSVSQNRLBG-UHFFFAOYSA-N 394.233 3.980 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(I)o1 206172083 CIWTWHFJRFROEN-UKTHLTGXSA-N 378.169 3.690 10 40 GHCB O=S(=O)(Nc1cc(Sc2nc[nH]n2)c(O)c2ccccc12)c1ccccc1 2685329 DIHWMXSCKBJTOT-UHFFFAOYSA-N 398.469 3.616 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccccc1OC 4696428 ANAPEUQISSFCBE-UYRXBGFRSA-N 377.440 3.876 10 40 GHCB CCOC(=O)c1cccc(-c2ccc(/C=C3\C(=N)N4OC(C)=CC4=NC3=O)o2)c1 41078281 WDLCPOFLWBZFDO-SAIIIAOYSA-N 391.383 3.574 10 40 GHCB COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1Cl 6348196 OZLJAHYIDRRSEX-ZSOIEALJSA-N 378.812 3.577 10 40 GHCB Cc1ccc(COc2ccccc2/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1 1476365 MYFIAIPDVUBWIK-YVLHZVERSA-N 399.493 3.860 10 40 GHCB O=C(Nc1ccc2c(c1)OCCCO2)N(Cc1ccccc1O)C[C@@H]1CCCO1 58166804 MZDNXXUFHZKGBG-SFHVURJKSA-N 398.459 3.767 10 40 GHCB CCOc1ccccc1/C=C1/SC(=S)N(CC(=O)O[C@@H](C)CC)C1=O 20010467 ZITSVIPPJQDYKM-XBUHWIKASA-N 379.503 3.628 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 13601117 HPUGWKNZOKZEFC-LFIBNONCSA-N 384.482 3.550 10 40 GHCB CN(C)c1ccc([C@H](C(=O)NC2CCCC2)N(C(=O)c2ccco2)C2CC2)cc1 15935720 ZMUMOALLTUIXDP-OAQYLSRUSA-N 395.503 3.750 10 40 GHCB O=c1[nH]n2c(=O)c3c([nH]c2c1/N=N/c1cccc(C(F)(F)F)c1)CCCC3 103674905 JIXXPUVJQDKGFJ-GHVJWSGMSA-N 377.326 3.629 10 40 GHCB CSCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 104841068 VUKPUSJJOYTIRR-IBGZPJMESA-N 395.484 3.517 10 40 GHCB CCN(CC)c1ccc(CNc2nc(-c3cccnc3)nn2C(=O)C2CC2)cc1 4732560 ICTYGAGACWWAIX-UHFFFAOYSA-N 390.491 3.849 10 40 GHCB COc1ccc2ccc(O)c(CN3CCCc4c3cccc4S(C)(=O)=O)c2c1 83970385 WGMVREGKEJTCJG-UHFFFAOYSA-N 397.496 3.910 10 40 GHCB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(F)cc2)o1 13809754 LRTXGQIRTUIELX-ATVHPVEESA-N 392.411 3.917 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cn(CC)c4ccccc34)C2=O)cc1 9111561 WACFLZKAXHGLRZ-CPNJWEJPSA-N 387.439 3.890 10 40 GHCB Cc1c(Cc2ccccc2)c(=O)oc2c(C)c(O)c(CNC[C@@H]3CCCO3)cc12 6719731 DZHBDCLKZYKEAM-IBGZPJMESA-N 393.483 3.975 10 40 GHCB COc1cc(Br)cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c1O 408901892 IMHRNKZAVFCJHM-OQLLNIDSSA-N 387.233 3.969 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCCN2CCc3ccccc32)c1 225560500 HWROKXWEYRYHLY-UHFFFAOYSA-N 383.517 3.603 10 40 GHCB COc1ccc(OC)c(/C=C2\SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)c1 5372607 ZITXCSAYAFDSHC-WQRHYEAKSA-N 397.456 3.745 10 40 GHCB CC[n+]1c(C=C2C=C(C)N(N3CCN(C)CC3)C(C)=C2)sc2ccccc21 3179411 MHBXTXMSQAOINZ-UHFFFAOYSA-N 381.569 3.878 10 40 GHCB O=C1/C(=C/c2c[nH]c3ccccc23)SC(=S)N1C1=C[C@@H]2OCO[C@@H]2C=C1 26771497 XCWKBNLMOGZJKV-QYCKHGQWSA-N 382.466 3.564 10 40 GHCB CCN(CC)c1ccc(/C=c2/sc3nc(-c4cccc(C)c4)nn3c2=O)cc1 2437433 AXISJOJGEOZMJE-XMHGGMMESA-N 390.512 3.520 10 40 GHCB Cc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1C 6747956 HQFITYQUKZILGB-QHCPKHFHSA-N 396.531 3.956 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(F)c3)C2=O)cc1 409022287 MBDACTLCMVNFDC-FHXOWUIVSA-N 398.459 3.834 10 40 GHCB COc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OC(=O)c1ccccc1 408723901 ACMBAIALWUYUNA-LFIBNONCSA-N 385.466 3.745 10 40 GHCB Cc1cccc([C@H]2C[C@]3(CC(C)(C)NC(=S)N3)Oc3c2ccc(O)c3O)c1 881935 QXQIHBVWHIABHR-QVKFZJNVSA-N 384.501 3.663 10 40 GHCB CN1C(=O)C(=Cc2ccc(-c3cc(Cl)cc(Cl)c3)o2)C(=O)N(C)C1=O 6178548 NQJRJPYSSKINGM-UHFFFAOYSA-N 379.199 3.687 10 40 GHCB Cc1ccc(/C=C2/C(=O)N(c3ccc(Br)cc3)C(=O)N=C2O)o1 8994942 PNLSSMXWJHOOTL-MDWZMJQESA-N 375.178 3.857 10 40 GHCB COc1ccccc1OCCN1C(=O)S/C(=C\c2ccc(N(C)C)cc2)C1=O 976751 HQXXMXGNMKNORD-RGEXLXHISA-N 398.484 3.877 10 40 GHCB CCOC(=O)c1sc(N2N=C(C)/C(=C\c3ccc(OC)c(C)c3)C2=O)nc1C 1411434 HPRZLVMJWDMSTF-XNTDXEJSSA-N 399.472 3.751 10 40 GHCB CCOC(=O)N1CCN(Cc2c(O)ccc3cc(Br)ccc23)CC1 12812754 KLBHVEKZQWRIAX-UHFFFAOYSA-N 393.281 3.582 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)sc2c1CCCCC2 3634129 OKQSNZTXVSFHIS-OLZOCXBDSA-N 391.489 3.799 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)c1 408938657 QUXNNZXDMKKXTA-AQTBWJFISA-N 378.428 3.759 10 40 GHCB O=C(O)c1cccc(-c2ccc(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)o2)c1 4691341 TWALHXHOOIFRGH-PDGQHHTCSA-N 388.379 3.738 10 40 GHCB COCCn1c(-c2ccc(C)cc2)cnc1SCC(=O)Nc1cc(C)on1 44085900 HHHCIPPPLPAINM-UHFFFAOYSA-N 386.477 3.532 10 40 GHCB CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 222981089 XWKBEVPQBHOWGT-QFIPXVFZSA-N 382.504 3.818 10 40 GHCB O=C1NC(=S)N=C(O)/C1=C/c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1 6890224 WPEIYBMTBAQPIF-UHFFFAOYSA-N 385.426 3.501 10 40 GHCB CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc([N+](=O)[O-])o1 101525459 RYRKVBAKKGJKRF-MDWZMJQESA-N 376.166 3.756 10 40 GHCB C[C@H](Oc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2O)cn1)c1ccccc1 65607985 GDKYDDVUXQPBQM-AWEZNQCLSA-N 393.399 3.765 10 40 GHCB C=CCc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(OC)c1OC(C)C 34868380 DRTSHMREKLTVDD-UYRXBGFRSA-N 392.455 3.672 10 40 GHCB CCCN1C(=O)/C(=C\c2ccccc2OCc2ccc(C)cc2)C(=O)N(C)C1=O 575442993 KHZJXIXOLWJXPI-RGEXLXHISA-N 392.455 3.788 10 40 GHCB COc1cc(/C=C2/SC(Nc3cccc(O)c3)=NC2=O)cc(OC)c1OC 2593876 FUHKYECGYRQAKW-CXUHLZMHSA-N 386.429 3.500 10 40 GHCB O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)/C1=C/c1cccc2ccccc12 95346040 SOOHHFKPYUPHAX-XSFVSMFZSA-N 388.398 3.683 10 40 GHCB COC(=O)c1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 6441005 MZTOFXHVNVHJNX-UHFFFAOYSA-N 385.375 3.501 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1ccc(OC)cc1 59435785 NMQGQHJAXDARAW-MOSHPQCFSA-N 393.439 3.577 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)CN1C(=O)NC2(CCCCCC2)C1=O 23653159 FTDACEIQEWMEHS-UHFFFAOYSA-N 398.551 3.711 10 40 GHCB COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\c1cccc(C)c1 108213992 NMTLJDNQQHQIEM-PDGQHHTCSA-N 378.384 3.780 10 40 GHCB COc1ccc(Br)cc1/C=C1/C(=O)N(C(=O)c2ccccc2)N=C1C 408937684 JJWIQKYDAPAULQ-LFIBNONCSA-N 399.244 3.900 10 40 GHCB Cc1ccc(/C=C2\SC(N3CCN(c4ccc(F)cc4)CC3)=NC2=O)cc1 6331747 LAVWSSCQOABWJL-RGEXLXHISA-N 381.476 3.927 10 40 GHCB CC(=O)N1CCC2(CC1)Oc1ccccc1[C@H]1CC(c3cc(C)ccc3O)=NN12 10214042 GQJDMGAFFOIWIE-HXUWFJFHSA-N 391.471 3.583 10 40 GHCB COc1ccc(C2=C/C(=C\c3ccc(I)o3)C(=O)O2)cc1 6627045 GKHUHVRMDQPMTO-DHZHZOJOSA-N 394.164 3.874 10 40 GHCB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1ccc(Cl)cc1Cl 2208726 TTXXCIITLXGLEH-QVTJDRNWSA-N 396.270 3.845 10 40 GHCB Cc1cnc(-c2nc([C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)no2)cn1 19239025 KCJZAUXPFLTXSV-ZDUSSCGKSA-N 385.855 3.574 10 40 GHCB CCn1ccc([C@H]2CC(c3ccccc3O)=NN2c2ccc([N+](=O)[O-])cc2)n1 71785145 YXCSVAJGCHDPAR-LJQANCHMSA-N 377.404 3.873 10 40 GHCB Cc1cc(C(=O)CSc2ncn[nH]2)c(C)n1-c1ccc(OC(F)F)cc1 6477143 WUXKZMQSSHHVJY-UHFFFAOYSA-N 378.404 3.789 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)NC1CCCCC1 4263545 CULWZZVWMXRPMA-NTCAYCPXSA-N 378.519 3.710 10 40 GHCB CCCOc1ccc(/C=C2\SC(=S)N(CC(=O)OC(C)C)C2=O)cc1 12635798 TXDGETRFSPIJPK-GDNBJRDFSA-N 379.503 3.628 10 40 GHCB CC[C@@H](Oc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 113956150 RIEFBSVGMRHQQW-HXUWFJFHSA-N 388.895 3.650 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3ccc(F)cc3)C(C)=C2C(=O)OC)c1O 408587051 PQXOIPCPSIGUGQ-ATVHPVEESA-N 397.402 3.807 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)O)SC2=S)c1 210431889 QPAXBCKWJGYZDN-YBEGLDIGSA-N 385.466 3.864 10 40 GHCB COc1ccc(N2CCC(N(CCCc3ccccc3)CC(=O)O)CC2)cc1 257316478 VFUDTZPVUGTILG-UHFFFAOYSA-N 382.504 3.683 10 40 GHCB CCn1cc(/C=C2/C(=O)NC(=S)N(c3cccc(F)c3)C2=O)c2ccccc21 13546770 UGZTYOLWEYGNBE-YVLHZVERSA-N 393.443 3.632 10 40 GHCB COC(=O)c1ccc(-c2ccc(C=C3C(=O)OC4(CCCCC4)OC3=O)o2)cc1 58865518 ZUFKJRGSEHIPEV-UHFFFAOYSA-N 396.395 3.877 10 40 GHCB CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C/c3cccnc3)SC2=S)cc1 1465943 QMVISUGQWXMKKH-WJDWOHSUSA-N 397.525 3.925 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3C)C2=O)cc1 409142004 KSLIQCYRCUILEK-SFQUDFHCSA-N 380.469 3.533 10 40 GHCB CCOC(=O)c1c(NC(=O)CC2(C(=O)O)CCCCC2)sc2c1CCC2 13255675 VCQHRBYMASQFDI-UHFFFAOYSA-N 379.478 3.777 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)COc1ccc(F)cc1Br 7694129 MJZZZTSXFYOFOO-UHFFFAOYSA-N 395.272 3.692 10 40 GHCB CSc1cccc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2C)c1 22714847 FCVCTKACBZJTIU-UHFFFAOYSA-N 397.456 3.769 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2cc(Cl)cc(OC)c2)C1=O 408873709 WKBWAKXGZPRSTP-YBEGLDIGSA-N 384.819 3.577 10 40 GHCB CCn1c(S[C@@H](C)C(=O)Nc2ccc(N)cc2)nnc1-c1ccc(OC)cc1 930593 RVTYORAZGWTVPT-ZDUSSCGKSA-N 397.504 3.675 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)c(OC)c1 4702401 PSLHCZWXYYBLLP-XDHOZWIPSA-N 397.450 3.773 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(-n2ccnc2)ccn1 95458613 RLJLIMXPBLYMDJ-UHFFFAOYSA-N 375.476 3.530 10 40 GHCB O=C(Nc1cccc(N2CCOCC2)c1)c1cccc2c(=O)c3ccccc3[nH]c12 585140084 AYPGGMYLACXTQQ-UHFFFAOYSA-N 399.450 3.770 10 40 GHCB CCn1c(-c2ccc(Br)cc2)cnc1SCC(=O)NC(C)C 7124549 ICRVVMFTPDLQNA-UHFFFAOYSA-N 382.327 3.949 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1ccc(N(C)C)cc1 59959215 YPPKWBCWNTZDIU-MOSHPQCFSA-N 392.455 3.638 10 40 GHCB COc1ccc2c(c1)CCCN2CC(=O)NC[C@H](C)c1nc2ccccc2s1 58157018 DMTWMKXTKJELMZ-HNNXBMFYSA-N 395.528 3.977 10 40 GHCB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=C1/SC(=S)N(c2ccccc2)C1=O 408902120 KJPBVTLVGOGHIJ-QRYYFKOISA-N 393.493 3.974 10 40 GHCB CN(C)c1cc(NCCc2ccccc2)c2c(c1N)C(=O)c1ccccc1C2=O 6664852 HHQWHBLNOVHEPJ-UHFFFAOYSA-N 385.467 3.765 10 40 GHCB CCN1c2cc(C)c(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2C(C)=CC1(C)C 113820672 ZAUULJBBPVYPEX-UHFFFAOYSA-N 397.544 3.616 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1cc(Cl)cc(Cl)c1O 408965819 MIEKMHNSOLRXDH-WUXMJOGZSA-N 395.173 3.505 10 40 GHCB CSCC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 390755802 VUKPUSJJOYTIRR-LJQANCHMSA-N 395.484 3.517 10 40 GHCB CC(C)C[C@H](C(=O)O)N1C(=O)/C(=C/c2cn(C)c3ccccc23)SC1=S 5371541 QSOPYXJVMUYCLE-AVIKPIRVSA-N 388.514 3.879 10 40 GHCB COc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 16719200 JDTZVSGBHUBOLI-RVDMUPIBSA-N 388.470 3.518 10 40 GHCB O=C1c2ccccc2N[C@@H](c2ccc(O)c(O)c2)N1c1ccc2c(c1)OCCO2 8745811 VIBWJIAJJNPCLT-OAQYLSRUSA-N 390.395 3.640 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3ccccc3F)C(=S)N=C2O)cc1OC 17194683 MJTKRVDUVQKIIJ-XFXZXTDPSA-N 386.404 3.515 10 40 GHCB COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1ccc(Br)cc1 651404 VPVYKLZADDWOPP-DHDCSXOGSA-N 378.266 3.778 10 40 GHCB COc1cc(/C=C2\SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCC#N 7164991 LXEAIYNFBZZADW-PDGQHHTCSA-N 379.441 3.988 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c(C)c1C 225730520 QVBMANJIBVIDIE-UHFFFAOYSA-N 388.533 3.781 10 40 GHCB CCN(CC)c1ccc(C=c2sc3nc(-c4ccccc4C)nn3c2=O)cc1 254494282 YPWWLOVWIXQBSK-UHFFFAOYSA-N 390.512 3.520 10 40 GHCB CC[C@@H](C)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 2236577 RVSGHJRMKCMCIP-NPQOUYBPSA-N 391.471 3.933 10 40 GHCB CCOc1ccc(-c2ccc(/C=C3/SC(=S)NC3=O)o2)cc1[N+](=O)[O-] 5713803 ASZKTBAXZSWZLT-RIYZIHGNSA-N 376.415 3.742 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 2648282 FMRHWUYWMASAFV-UNOMPAQXSA-N 391.423 3.566 10 40 GHCB Cc1ccc(NC2(NC(=O)c3ccc(C)cc3)C(=O)c3ccccc3C2=O)cc1 226297753 QTUACGSDPPOFEI-UHFFFAOYSA-N 384.435 3.921 10 40 GHCB COc1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C)cc1OC 7128896 HRQDIBKWIYDFQO-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB Cc1ccccc1N/C=C1/C(=O)NC(=S)N(c2ccc(F)c(Cl)c2)C1=O 108032340 KZXQNIJSQDRMSA-XFXZXTDPSA-N 389.839 3.531 10 40 GHCB Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccc(O)cc1 222741269 RJUKDQUEUSVZMB-WOJBJXKFSA-N 378.501 3.797 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S)c1ccccc1O 5005492 VYYXMVUCNRDQPE-NTEUORMPSA-N 390.873 3.592 10 40 GHCB O=C1NC(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1cccc(O)c1 408722921 OJVIVNPLIVSYCZ-KPKJPENVSA-N 393.251 3.530 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(F)c2)C1=O 408913162 SVOUARLHFGFVKL-VVBXCHJUSA-N 382.391 3.669 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3ccccc3Cl)N3CCCC3)ccc21 8963331 GOYIKTSYNKMNGT-OAQYLSRUSA-N 383.923 3.899 10 40 GHCB COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nncs3)c2C)cc1 3288974 SWMVHVGXLULDBL-UHFFFAOYSA-N 387.486 3.707 10 40 GHCB COc1ccc(N2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)cc1 5383893 JWYKKKRVYAJBJI-UHFFFAOYSA-N 388.533 3.504 10 40 GHCB CC(=O)c1ccc(N2CCN(Cc3c(O)ccc4ccncc34)CC2)c(F)c1 12517621 JXFLAHSSAMRGGN-UHFFFAOYSA-N 379.435 3.604 10 40 GHCB Cc1cc(C(=O)COc2ccccc2C(N)=O)c(C)n1-c1ccc2c(c1)CCC2 7180742 HWVKMBZWJQNEGC-UHFFFAOYSA-N 388.467 3.943 10 40 GHCB COc1ccc(N2CCN(C(=O)C3CCN(c4ccc(C)cc4)CC3)CC2)cc1 219853332 HEFXFFZRAJGXNK-UHFFFAOYSA-N 393.531 3.569 10 40 GHCB O=C(CN1C(=O)S/C(=C/c2ccccc2)C1=S)Nc1cccc(C(=O)O)c1 1236284 XCASSIFSLXUUAA-OQLLNIDSSA-N 398.465 3.861 10 40 GHCB COc1ccc(/C=C2/SC(N3CCN(c4ccccc4F)CC3)=NC2=O)cc1 2349533 BBNYSPPNXZCGPS-XMHGGMMESA-N 397.475 3.627 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(CCCC(=O)NC(C)(C)C)C2=O)c1 1476493 YFEMPZIAKOOUBM-QINSGFPZSA-N 392.546 3.591 10 40 GHCB Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N1CCCC1 6973026 QQWQNPRNKRIXOB-UHFFFAOYSA-N 380.311 3.564 10 40 GHCB CCn1ccc([C@@H]2CC(c3ccccc3O)=NN2c2ccc([N+](=O)[O-])cc2)n1 71785144 YXCSVAJGCHDPAR-IBGZPJMESA-N 377.404 3.873 10 40 GHCB O=S(=O)(c1cccc(/N=N/c2cc(O)cc3ccccc23)c1)N1CCOCC1 110306377 AFLQEAMWFBHTSD-QURGRASLSA-N 397.456 3.982 10 40 GHCB COc1ccc(C[C@@H]2SC(=S)N(Cc3ccco3)C2=O)c(OC)c1C 8276449 BRLCOYNNOKHXDP-HNNXBMFYSA-N 377.487 3.577 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COc1ccc(C(C)(C)C)cc1 12595580 PCRRZPUBULZIPK-UHFFFAOYSA-N 396.531 3.858 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 32193770 XECZFUXVSQMNCW-LUJRCDHRSA-N 378.428 3.839 10 40 GHCB C[C@H]1CN(C2=NC(=O)/C(=C/c3cccc(Br)c3)S2)C[C@H](C)O1 39404220 LLFMTYDCNKDIDJ-ZCJISOJFSA-N 381.295 3.529 10 40 GHCB COc1ccc2c(c1)CCCN2CC(=O)NC[C@@H](C)c1nc2ccccc2s1 58157022 DMTWMKXTKJELMZ-OAHLLOKOSA-N 395.528 3.977 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)sc2c1CC[C@@H](C)C2 4662490 KNTLMNCJNFJXAY-AGIUHOORSA-N 393.505 3.879 10 40 GHCB CCOC(=O)c1ccc(/N=N/N(C)c2c(C)n(C)n(-c3ccccc3)c2=O)cc1 4765207 JXDRIHQJJLBTSS-GHVJWSGMSA-N 393.447 3.796 10 40 GHCB COc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1Cl 8739022 FAPBNGWVELSHKL-GDNBJRDFSA-N 399.834 3.921 10 40 GHCB CCOc1ccc(NC(=O)C[C@H]2SC(=O)N(c3ccc(F)cc3)C2=O)cc1 12136868 GFPNHNIXCQWEFP-MRXNPFEDSA-N 388.420 3.822 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1 408805582 GZEDRPDTKJYXOQ-QGOAFFKASA-N 378.428 3.759 10 40 GHCB CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(O)cc1O 409031971 HRVZBQLIQSPVAU-RUDMXATFSA-N 384.260 3.599 10 40 GHCB CCOC(=O)C1CCN(C2=NC(=O)/C(=C/c3ccc(Cl)cc3)S2)CC1 1438668 RXMROHIUYOJRSX-PTNGSMBKSA-N 378.881 3.585 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(OC(F)(F)F)cc3)CC2)cc1 2639572 VGNJCSMWPZUBNL-UHFFFAOYSA-N 380.366 3.556 10 40 GHCB O=C(O)COc1cccc(/C=C2/SC(Nc3ccc(Cl)cc3)=NC2=O)c1 16909758 OTODUKPCURNZIN-OQLLNIDSSA-N 388.832 3.886 10 40 GHCB COc1ccc([C@H](c2cc(Cl)c3cccnc3c2O)N2CCN(C)CC2)cc1 19898712 YNMYELPINOSQOE-OAQYLSRUSA-N 397.906 3.939 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)c2nn(-c3ccccc3)nc2C)cc1 24187423 FFAXGQIAOAIXCR-UHFFFAOYSA-N 377.492 3.694 10 40 GHCB CN(C)c1ccc(CNC(=O)CN(Cc2c(F)cccc2Cl)C2CC2)cc1 32836277 JAUXPQRIXILLPB-UHFFFAOYSA-N 389.902 3.826 10 40 GHCB COc1cccc(-n2c(C)cc(/C=C3/C(=O)NN(c4ccccc4)C3=O)c2C)c1 33766396 YEHZFOTZURZPGP-BKUYFWCQSA-N 387.439 3.564 10 40 GHCB COc1ccc(OC)c(/C=C2/SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)c1 35042530 ZITXCSAYAFDSHC-WOJGMQOQSA-N 397.456 3.745 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(Cl)ccc3O)C2=O)cc1Cl 408984566 JAFLYCOYMANHBT-QPEQYQDCSA-N 391.210 3.674 10 40 GHCB COc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1OC(F)F 83878075 DVAPZMSMFORYPL-UHFFFAOYSA-N 376.403 3.609 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(=S)N(c3ccccc3OC)C2=O)cc1 409330052 JFEDOSIYVDKHPJ-LFIBNONCSA-N 385.466 3.888 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)c2cccc(OCC(C)C)c2)c1 41091651 ZJRHWQKEGXGXFS-UHFFFAOYSA-N 384.476 3.819 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc4c(c3)CCCC4)CC2)cc1 223937229 AQIWXWLGGNGXBW-SFHVURJKSA-N 394.515 3.690 10 40 GHCB Cc1cccc([C@@H]2C[C@]3(CC(C)(C)NC(=S)N3)Oc3c2ccc(O)c3O)c1 881936 QXQIHBVWHIABHR-YCRPNKLZSA-N 384.501 3.663 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCCC4)C3=O)c2C)cc1C 4404783 JWYNVGAVQYFXCJ-UHFFFAOYSA-N 393.487 3.758 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S 5371410 BZLYZMREXKUJIT-GQVHDAKQSA-N 395.502 3.548 10 40 GHCB COc1ccc([N+](=O)[O-])cc1NC1(c2ccccc2)C(=O)c2ccccc2C1=O 7499996 WRCFKIRXVAGJLG-UHFFFAOYSA-N 388.379 3.990 10 40 GHCB COc1ccc(N2CCN(C[C@@](C)(O)c3cccc(C(F)(F)F)c3)CC2)cc1 58322918 YTPMZQWPRQMQET-HXUWFJFHSA-N 394.437 3.744 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c(Cl)c1Cl 113935699 HBDZVIOLWRLSCZ-UHFFFAOYSA-N 389.304 3.547 10 40 GHCB CCN1CCc2cc(/C=C3\C(=O)N(c4ccccc4C)C(=O)N=C3O)ccc21 1846479 QIDIZASZTOKMGA-LGMDPLHJSA-N 375.428 3.884 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(CNc3ccccc3OC)C2=O)cc1 3208625 FKYDLWIOEUVHEW-GZTJUZNOSA-N 386.498 3.975 10 40 GHCB COc1ccc(-c2nnc([C@H](C)N3CCN(c4ccc(OC)cc4)CC3)o2)cc1 57845272 OZHNBAACQBFICA-INIZCTEOSA-N 394.475 3.637 10 40 GHCB Cc1ccc(-c2ccc(C=C3C(=O)OC4(CCCC4)OC3=O)o2)cc1[N+](=O)[O-] 58865866 JAOFLFJOVKXCOD-UHFFFAOYSA-N 383.356 3.917 10 40 GHCB O=C1/C(=C/c2cccc(Br)c2)SC(=S)N1C[C@@H]1CCCO1 13712790 HIROVLNEBLWMHZ-OEMOTLHWSA-N 384.320 3.829 10 40 GHCB O=C1/C(=C\c2ccc(N3CCOCC3)cc2)SC(=S)N1c1ccccc1 4562023 NSXHZFZGHPTBKF-NBVRZTHBSA-N 382.510 3.929 10 40 GHCB C[C@@H]1CN2C(=N[C@@H](c3ccccn3)[C@H]2c2ccc(N3CCOCC3)c(F)c2)S1 260777911 QSKQZWHMIVMZQO-VOBQZIQPSA-N 398.507 3.647 10 40 GHCB CN(C)c1ccc(/C=C2\C(=N)N3N=C(Cc4cccs4)SC3=NC2=O)cc1 4618444 YBNWLXOEZBMKJB-DGBANISESA-N 395.513 3.676 10 40 GHCB CN1C(=O)C(=Cc2ccc(-c3cc(Cl)cc(Cl)c3)o2)C(=O)N(C)C1=S 1064104 JYJGIQACIMXVTG-UHFFFAOYSA-N 395.267 3.852 10 40 GHCB O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 5201185 KOEBINNAVCEWSW-NTEUORMPSA-N 387.398 3.909 10 40 GHCB C#CCOc1ccc(/C=C2\SC(=S)N(CC)C2=O)cc1Br 33741333 OJCSNPFIVDLIKD-LCYFTJDESA-N 382.304 3.682 10 40 GHCB CCOc1cc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)ccc1OC 59135266 COEFPQQGVAYVPI-XNTDXEJSSA-N 384.363 3.740 10 40 GHCB [N-]=[N+]=N[C@@H]1C[C@H](C(=O)O)N(C(=O)OCC2c3ccccc3-c3ccccc32)C1 98091005 HOPXMBBEYJTPNX-KZULUSFZSA-N 378.388 3.773 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2cc(Cl)ccc2O)C1=O 408891045 KJUHYIGKQLYTIB-NTUHNPAUSA-N 391.210 3.674 10 40 GHCB COc1ccc(C[C@@H]2SC(=S)N(CC(C)C)C2=O)cc1Br 6326108 VFACHRTXXHFRNF-ZDUSSCGKSA-N 388.352 3.885 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1ccc(C)cc1 59435790 PDOCIKSSIZRMSY-QNGOZBTKSA-N 391.467 3.919 10 40 GHCB CN(C)c1ccc(CN2CCC(c3cc(O)nc(-c4ccccn4)n3)CC2)cc1 72392826 FJDLTYDXWFTAKC-UHFFFAOYSA-N 389.503 3.690 10 40 GHCB CC[C@H](C)Oc1ccc(C=C2C(=O)N(CC)C(=S)N(CC)C2=O)cc1Cl 409017934 WLDKVDPGUXMWGO-LBPRGKRZSA-N 394.924 3.896 10 40 GHCB Cc1c(C)c2ccc(O)c(CN(C)C[C@@H]3CCCN4CCCC[C@@H]34)c2oc1=O 1565519802 HRDURUSTQFCTOI-PXNSSMCTSA-N 384.520 3.812 10 40 GHCB biogenic CCN1C(=O)/C(=C/c2ccccc2OCC(=O)Nc2ccccc2)SC1=S 409330759 MJDSHDFXLVIUTP-ATVHPVEESA-N 398.509 3.925 10 40 GHCB O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2C[C@H](O)c1cccc(O)c1 604403958 FXHLKLADYKKGDW-FQEVSTJZSA-N 383.403 3.652 10 40 GHCB biogenic Cc1ccc(-c2noc([C@@H]3C[C@@H](O)CN3Cc3ccc(N(C)C)cc3)n2)cc1F 15674308 IRGNOLSWOVIJLU-QUCCMNQESA-N 396.466 3.558 10 40 GHCB biogenic,in-vitro O=C(NN1C(=O)/C(=C/c2cccs2)SC1=S)c1cccc(Cl)c1 2258426 LRSGXLBTBMPDGF-WQLSENKSSA-N 380.903 3.948 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)Nc1ccc(O)cc1 1262382 UIGOTKLRKODFTP-RVDMUPIBSA-N 388.470 3.605 10 40 GHCB Cc1ccc(O)c(CN2CCC(c3cc(C(F)(F)F)n4ncnc4n3)CC2)c1 13226956 OAJNZGZRFPKDKO-UHFFFAOYSA-N 391.397 3.537 10 40 GHCB O=[N+]([O-])c1ccc(N2CCN(Cc3c(O)c(Cl)cc(Cl)c3O)CC2)cc1 25059873 ZCHMRIJWYZYVFT-UHFFFAOYSA-N 398.246 3.635 10 40 GHCB Cc1nc(-c2ccccn2)sc1C(=O)NCc1ccc2c(c1)CCCN2C 58769179 CRXSTIZGIHJILV-UHFFFAOYSA-N 378.501 3.826 10 40 GHCB Cc1cc(C(=O)N2CCN(c3ccc(OCc4ccccc4)cc3)CC2)no1 5587792 OORZMMRTKQFBQV-UHFFFAOYSA-N 377.444 3.524 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 409000497 YKQCFDGJODZUHD-WJDWOHSUSA-N 382.347 3.611 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cc(OC)ccc1OC 408794276 ISDIUNMIMZJYAG-UYRXBGFRSA-N 393.439 3.889 10 40 GHCB O=C1c2ccccc2N[C@@H](c2ccc(N3CCOCC3)cc2)N1Cc1ccco1 7112543 CWXMAWDRNRRSIC-JOCHJYFZSA-N 389.455 3.883 10 40 GHCB CCOc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCC2)cc1 5098031 DBOIRFOIHXNNHH-JOCHJYFZSA-N 381.520 3.718 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nc(-c4cccc(C)c4)nn3c2=O)cc1 13512919 AXISJOJGEOZMJE-RGEXLXHISA-N 390.512 3.520 10 40 GHCB Cc1cccc([C@@H]2C[C@@]3(CC(C)(C)NC(=S)N3)Oc3c2ccc(O)c3O)c1 881940 QXQIHBVWHIABHR-BTYIYWSLSA-N 384.501 3.663 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(C(F)(F)F)cc1 12555726 GDQLBXVUPSXLEB-UHFFFAOYSA-N 378.394 3.814 10 40 GHCB Cc1cc(NC(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)no1 8725593 DMNWINSXJMCIRT-MRXNPFEDSA-N 398.488 3.756 10 40 GHCB O=C1c2ccccc2C(=O)C1(c1ccccc1)N1CCN(Cc2ccccc2)CC1 20178051 NYQQLNFEZNJIIX-UHFFFAOYSA-N 396.490 3.779 10 40 GHCB Cc1c(NC2=NC(=O)/C(=C/c3ccccc3)S2)c(=O)n(-c2ccccc2)n1C 941226 OZHNBVIHNMEQPN-LGMDPLHJSA-N 390.468 3.567 10 40 GHCB CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 12607898 CIZCOHLSRKPOFH-KRWDZBQOSA-N 388.533 3.720 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N(NC(=O)c2ccc(C)cc2)C1=O 16661712 DDEYJMLUMXLRHK-LFIBNONCSA-N 384.482 3.550 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)NC2=S)cc1Cl 409220597 BXYRXCVGMKABNM-OVCLIPMQSA-N 395.871 3.961 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 101141774 DBXFRMLKCQOUEO-MHWRWJLKSA-N 394.387 3.628 10 40 GHCB CCOc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)cc1 13806030 IISAMBKJSBIVGB-RPKGUNMRSA-N 393.472 3.742 10 40 GHCB O=C1Nc2cc(Cl)ccc2/C1=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 6923026 ABBBBGOOGBZIJM-OQLLNIDSSA-N 385.807 3.578 10 40 GHCB CCOc1ccc2ccccc2c1/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O 408741225 ONDMEIZRBLYHFG-RGEXLXHISA-N 386.407 3.905 10 40 GHCB O=C(O)c1cc(N=Nc2ccc(S(=O)(=O)Nc3cccnc3)cc2)ccc1O 253618061 OBZRSTPTYSUKCF-UHFFFAOYSA-N 398.400 3.702 10 40 GHCB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 58883572 COWNUCMQJUADJV-ZJYZBMPFSA-N 383.488 3.836 10 40 GHCB Cc1ccc(C(C)(C)O[C@@H]2CC(=O)C[C@@H]3C(=O)c4cccc(O)c4C(=O)[C@@H]32)cc1 4568185 HWBQGRFPUCBOTB-DSKINZAPSA-N 392.451 3.995 10 40 GHCB COc1ccc(/C=C2/C(=O)N(C(=O)c3ccccc3)N=C2C)cc1Br 408946717 ZDPDDDGCOIHGCG-XNTDXEJSSA-N 399.244 3.900 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)OC)cc1 408999690 VNMAPPIAYKTEJS-UYRXBGFRSA-N 391.423 3.659 10 40 GHCB CN(C)c1ccc(CNC(=O)[C@@H]2CCn3c(C(=O)c4ccccc4)ccc32)cc1 51364607 DNGOOOZTIXJDAX-HXUWFJFHSA-N 387.483 3.589 10 40 GHCB Cc1cc(C(=O)CN(C)S(=O)(=O)c2ccccc2)c(C)n1-c1ccccc1 3491721 JEASKLFULANVJY-UHFFFAOYSA-N 382.485 3.598 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)Cc3ccc(Cl)cc3)N3CCCC3)ccc21 8963239 DLNDXDXHJQQDBD-JOCHJYFZSA-N 397.950 3.828 10 40 GHCB C[C@H](N1C(=O)NC(=O)/C(=C\c2cccs2)C1=O)C12CC3CC(CC(C3)C1)C2 16576086 KFXYLMXZWGPGMO-AKNKYRMWSA-N 384.501 3.815 10 40 GHCB COc1ccc(-c2cc(CN3CCN(c4ccc(OC)cc4)CC3)on2)cc1 57358836 IFCXILCAMQTJHH-UHFFFAOYSA-N 379.460 3.681 10 40 GHCB COC(=O)c1ccc(Cl)c(NC(=S)NCCN(C)c2ccc(C)cc2)c1 225796098 YCGPDHZHPMTCML-UHFFFAOYSA-N 391.924 3.858 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 4680110 XECZFUXVSQMNCW-VUODPORTSA-N 378.428 3.839 10 40 GHCB Cc1cc(C(=O)CSc2nnc[nH]2)c(C)n1-c1ccc(Br)cc1 5620747 ODNXONIKKINBEG-UHFFFAOYSA-N 391.294 3.950 10 40 GHCB CCOC(=O)/C=C/c1ccc(N(C)CCCN(C)C(=O)OC(C)(C)C)cc1 1772715299 RFSAVAVYWDFTFQ-SDNWHVSQSA-N 376.497 3.956 10 40 GHCB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 9494636 SQHGTQNKBSONKH-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB COc1ccc(N2CCN(C(=O)CCN3CCC[C@H]3c3cccs3)CC2)cc1 32776738 KGORLXXBJLBCGE-FQEVSTJZSA-N 399.560 3.633 10 40 GHCB O=C(O)COc1ccccc1/C=C1\SC(=S)N(C2CCCCC2)C1=O 33373294 APOFKFUVKPVNIL-GDNBJRDFSA-N 377.487 3.684 10 40 GHCB CCc1nc2ccccc2n1CC(=O)NCc1ccc(N2CCCCC2)cc1 35316942 HPTFMGLCWMYFRL-UHFFFAOYSA-N 376.504 3.905 10 40 GHCB Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)n1-c1ccccc1 223635545 BDXPCPFKIRKDQM-RTWAWAEBSA-N 392.528 3.536 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1ccccc1F 408796813 ZGFRARWBCIVOMW-PDGQHHTCSA-N 381.403 3.707 10 40 GHCB COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 3889830 NOVSSPYGFPZSIQ-RGEXLXHISA-N 395.455 3.948 10 40 GHCB CC1CCN(c2ccc([C@@H](C)NC(=O)c3ccc4oc(=O)n(C)c4c3)cc2)CC1 36752749 YWEQBWNQSCWYGC-MRXNPFEDSA-N 393.487 3.859 10 40 GHCB C[S@]([O])(=O)=C1C=CC(=C(CC2CCCC2)C(=O)Nc2nccs2)C=C1 1560406058 GZCBPTYXICPIPW-UHFFFAOYSA-N 377.511 3.517 10 40 GHCB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 58883567 COWNUCMQJUADJV-UZNZLNSGSA-N 383.488 3.836 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N([C@@H](C(=O)O)c2ccccc2)C1=O 13122584 LAVUPXNADVCYTE-UVQBRAAOSA-N 385.466 3.722 10 40 GHCB COc1ccc(N2CCN(C(=O)Cc3coc4cc(C)cc(C)c34)CC2)cc1 9409385 QHWRCLPZJNDRAV-UHFFFAOYSA-N 378.472 3.950 10 40 GHCB CCCCOc1ccccc1/C=C1\SC(=S)N(CCCC(=O)O)C1=O 26510012 GWSPVTRDTHMIBV-QINSGFPZSA-N 379.503 3.932 10 40 GHCB Cc1nn(C)cc1/C=C1/C(=O)N(c2ccccc2)N=C1C(F)(F)C(F)(F)F 35678572 LACHWMPXGKCRCA-MDWZMJQESA-N 384.308 3.712 10 40 GHCB CCOc1ccc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)cc1 2617054 QBMFDYUYKLOXHK-NTCAYCPXSA-N 379.503 3.932 10 40 GHCB CN1CCN([C@H]2Cc3ccccc3Sc3ccc(N4CCOCC4)cc32)CC1 95696716 BPSRTAPGDDZPEC-NRFANRHFSA-N 395.572 3.519 10 40 GHCB CCN(CCNC(=S)Nc1ccc(N2CCCC2=O)cc1)c1ccc(C)cc1 225793958 AMMVQRFIAAMAMF-UHFFFAOYSA-N 396.560 3.935 10 40 GHCB CC1CCN(CC(=O)N2N=C(c3ccsc3)C[C@H]2c2ccccc2O)CC1 226779792 SKNAUDSJSLSISQ-IBGZPJMESA-N 383.517 3.863 10 40 GHCB O=C(O)c1cccc(-c2ccc(/C=C3\NC(=O)N(C4CCCCC4)C3=O)o2)c1 409090852 PCVBPHQEXZAWDA-ATVHPVEESA-N 380.400 3.870 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(CCc3ccccc3)C2=O)c2ccccc21 2447882 KWCAERVPGHTFJI-XMHGGMMESA-N 387.439 3.570 10 40 GHCB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)Oc3ccc(Cl)cc3)ccc21 5234077 ASDGQDRDSKGMIQ-UHFFFAOYSA-N 398.823 3.883 10 40 GHCB Cc1nc(C(F)(F)F)ccc1C(=O)NCc1ccc(N2CCSCC2)cc1 84028739 BKPRPCRKGLOBSS-UHFFFAOYSA-N 395.450 3.892 10 40 GHCB Cc1cc(N(Cc2ccccc2O)C[C@H]2CCCO2)nc(-c2ccccn2)n1 95446145 IZRIGEKDPCQQOV-GOSISDBHSA-N 376.460 3.738 10 40 GHCB CCOC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(CC)C(=S)N=C3O)o2)cc1 33748305 SLHBYZYZEVWLSV-RVDMUPIBSA-N 398.440 3.610 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1/NC(=O)N(Cc2ccccc2F)C1=O 13546788 PFWRMVZDGLBIMO-DEDYPNTBSA-N 379.435 3.827 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1ccccc1O 5370767 PQPOPGLFXJTUFX-NPDFUIFFSA-N 396.493 3.788 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(-c3ccccc3F)o2)SC1=S 5429134 MUFFOAIRBWYSLL-MBBDXHFBSA-N 377.418 3.760 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C/c2cccc(F)c2)SC1=S 1774305 YOXUOPFXFNNIAV-DFSFMLJYSA-N 387.457 3.723 10 40 GHCB COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)Nc1ccc(C)cc1 112123357 LUKJOAGQVKPHQZ-QNGOZBTKSA-N 393.443 3.655 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(C)C2=O)cc1CSc1nccn1C 8782489 XKPOZVXXLXOKSV-ZROIWOOFSA-N 391.543 3.552 10 40 GHCB CCn1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)c2ccccc21 13553121 IGNSBUAPDSWGHL-PTNGSMBKSA-N 393.443 3.632 10 40 GHCB COc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(OC)c1 4178604 GHTUCCKVKDCYOW-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB COc1ccccc1/C=C1/SC(N2CCN(c3ccccc3F)CC2)=NC1=O 35623432 SPOCADJJVSHOCI-XMHGGMMESA-N 397.475 3.627 10 40 GHCB O=C(O)CCCCCN1C(=O)/C(=C/C2=Cc3ccccc3OC2)SC1=S 2672398 OSAXJIQYXBIGMP-WJDWOHSUSA-N 389.498 3.852 10 40 GHCB CCN1C(=O)NC(=O)/C(=C\c2ccc(-c3cccc(Cl)c3Cl)o2)C1=O 665264 ZLFKGPBYTAPONH-DHZHZOJOSA-N 379.199 3.735 10 40 GHCB CCCOC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)sc2c1CCCC2 2086584 DLCAKYXPUCYWGE-CHWSQXEVSA-N 391.489 3.799 10 40 GHCB O=c1oc2c3c(ccc2c2c1CCCC2)OCN(c1ccc2c(c1)OCO2)C3 2118821 XYEDQINFXCALAS-UHFFFAOYSA-N 377.396 3.757 10 40 GHCB biogenic CCN(CC)c1ccc(CNS(=O)(=O)c2c(C)cc(OC)cc2C)cc1 224357978 RKCPBAJORBRIBX-UHFFFAOYSA-N 376.522 3.637 10 40 GHCB COc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccccc2)SC1=S 1009703 RTGSTBRTQPTVOG-LGMDPLHJSA-N 398.509 3.925 10 40 GHCB Cc1ccccc1/C=C1\SC(=S)N([C@H](Cc2ccccc2)C(=O)O)C1=O 5373430 IPFTYYJDJFWZSW-WISAJEAXSA-N 383.494 3.892 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)N(C)c3ccccc3)sc2n1 10645098 MKDUEDVNWONKFX-CYBMUJFWSA-N 383.473 3.704 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNC(=O)c1cccc(Cl)c1 10962972 HVLUYRWQKZEVTG-UHFFFAOYSA-N 399.922 3.719 10 40 GHCB Cc1cc(C(=O)N2CCN(c3nccs3)CC2)c(C)n1-c1ccccc1F 25468087 SBRZGILBNXNQHU-UHFFFAOYSA-N 384.480 3.652 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(CCC(=O)Nc2ccccc2)C1=O 1188090 WCPYMVFSGUDCMV-LGMDPLHJSA-N 398.509 3.925 10 40 GHCB CC[C@@H](C)[C@H](NCc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12)C(=O)O 5467880 IJAAWTXJFCQYFT-YJYMSZOUSA-N 397.427 3.880 10 40 GHCB biogenic CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1nc(-c2ccc(F)cc2)no1 8776013 UXQSGWRYNGMIDY-UHFFFAOYSA-N 396.466 3.923 10 40 GHCB Cc1cc(NC(=O)c2ccco2)sc1C(=O)NCc1ccc(N(C)C)cc1 12561892 DYRKDVOMHQZCJK-UHFFFAOYSA-N 383.473 3.898 10 40 GHCB Cc1occc1C(=O)NN1C(=O)/C(=C\c2ccc3ncccc3c2)SC1=S 13693361 GXIJDTHRAYOJNT-MHWRWJLKSA-N 395.465 3.682 10 40 GHCB COc1ccc(-c2coc3c(CN4CCSCC4)c(O)ccc3c2=O)cc1 85879540 BPMPOUSHENUIGR-UHFFFAOYSA-N 383.469 3.723 10 40 GHCB biogenic Cc1ccccc1C1=NN2C(=N)/C(=C/c3ccc(N(C)C)cc3)C(=O)N=C2S1 4620881 PUVWDPMBJQGQBX-SABKFZPKSA-N 389.484 3.728 10 40 GHCB Cc1cc(C(=O)CSc2nc(N)cc(N)n2)c(C)n1-c1ccc(Cl)cc1 6533257 OKBYMROBWPOMJF-UHFFFAOYSA-N 387.896 3.677 10 40 GHCB CN(C)c1ccc(CN2CCC(c3cc(O)nc(-c4ccncc4)n3)CC2)cc1 72392701 HBDYWCOWUQNPEL-UHFFFAOYSA-N 389.503 3.690 10 40 GHCB COc1ccc(NC(=S)NCCCN2CCCc3ccccc32)cc1OC 225745294 DHRQBMOVQQLRQE-UHFFFAOYSA-N 385.533 3.833 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 408802837 IBOXLJDDLTUSQE-GZTJUZNOSA-N 384.819 3.795 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(C)n(-c2ccc(C(N)=O)cc2)c1C 408904045 CVKQHRMMGAACFH-HYARGMPZSA-N 398.466 3.999 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nnc(-c4ccccc4C)n3c2=O)cc1 637320 OHBSLURBCZIRKJ-RGEXLXHISA-N 390.512 3.520 10 40 GHCB CC[C@@H](Oc1cc(C)ccc1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 20453653 KIGOIQMCOJFZNX-OAQYLSRUSA-N 382.504 3.818 10 40 GHCB CCOC(=O)c1c(C)oc2c1c(CN1CCN(CC)CC1)c(O)c1ccccc12 19863999 QPCFEUQBFHHPKV-UHFFFAOYSA-N 396.487 3.914 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3cc(C)cc(C)c3)C2=O)o1 204986516 VDPOIZCZOVYIQF-SFQUDFHCSA-N 397.500 3.574 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc4ccccc4cc3OC)CC2)cc1 5094394 RTSKETQNQKDCDU-UHFFFAOYSA-N 376.456 3.819 10 40 GHCB COc1ccc(C[C@@H](C)NC(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 15108331 PPQPYEVGANUNLA-OAHLLOKOSA-N 399.446 3.832 10 40 GHCB COc1ccc2cc(S(=O)(=O)NCc3ccc(N4CCCC4)cc3)ccc2c1 223554135 LBKUBPGSVQJBMO-UHFFFAOYSA-N 396.512 3.927 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C)c(C)c3)C2=O)o1 408811215 KVIKZQQDOXOJJW-SFQUDFHCSA-N 397.500 3.574 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2cc(Cl)ccc2OC)C1=O 408865967 FNCPKZTZBBMFHK-PTNGSMBKSA-N 384.819 3.577 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c1 408935991 JKXQWPADNKJLFC-UYRXBGFRSA-N 378.428 3.759 10 40 GHCB Cc1cccc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)c1C 13810674 YETORBDYIAIZBO-NRKWFKHNSA-N 377.473 3.960 10 40 GHCB COc1ccc(N(CCC(N)=O)Cc2noc(-c3ccc(F)cc3)c2C)cc1 8708560 DAXZEGFZFQHPIT-UHFFFAOYSA-N 383.423 3.680 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(O)c(Cl)c1 5756970 SIHIPCSMDSDSMP-WUXMJOGZSA-N 393.251 3.530 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1C(=O)O 5374318 GNVKLEHABQMCOV-APSNUPSMSA-N 399.449 3.828 10 40 GHCB CC1=NN(c2ccc(C(=O)OC(C)C)cc2)C(=O)/C1=C\c1ccc([N+](=O)[O-])o1 4520430 HCCWBCACEAZPAI-YBEGLDIGSA-N 383.360 3.559 10 40 GHCB Cc1nn(CN(C)Cc2ccc(N3CCCCC3)cc2)c(=O)c2ccccc12 14215410 SVMZDEYEAKSFID-UHFFFAOYSA-N 376.504 3.785 10 40 GHCB O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1ccccc1OC(F)F 66247542 LQKZYMBCSRYTKF-UHFFFAOYSA-N 383.401 3.607 10 40 GHCB CCc1ccc(N2C[C@@](O)(c3ccc(OC)cc3F)[N+]3=C2SCCC3)cc1 2965923 LDZVQOLOTHMHKP-OAQYLSRUSA-N 387.500 3.567 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc([N+](=O)[O-])o3)c2C)cc1 6329546 WEOMHQBGLANZHE-UHFFFAOYSA-N 398.371 3.644 10 40 GHCB Cc1ccc(C(=O)CCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 21963286 WNOKYHBWYUERIB-UHFFFAOYSA-N 386.517 3.515 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)Nc3ccc(F)cc3)N3CCCC3)ccc21 35597202 JUJOLJUDGSFVJZ-NRFANRHFSA-N 382.483 3.777 10 40 GHCB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1ccc(Cl)cc1Cl 2208730 TTXXCIITLXGLEH-QDECMSLZSA-N 396.270 3.845 10 40 GHCB O=C1/C(=C/c2coc3ccc(O)cc3c2=O)SC(=S)N1Cc1ccccc1 2242077 PYAZDIRQWQQTGA-IUXPMGMMSA-N 395.461 3.900 10 40 GHCB CCc1cccc(C)c1N/C=C1/C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 2402428 GYFFKNTWCHPHSX-ATVHPVEESA-N 377.444 3.753 10 40 GHCB COc1ccc([C@@H](c2ccc3c(OC)cccc3c2O)N2CCN(C)CC2)cc1 22935330 SHGIENHXAMWUBU-QHCPKHFHSA-N 392.499 3.899 10 40 GHCB COc1cccc(N[C@H]2COC3(CCN(Cc4ccc(N(C)C)cc4)CC3)C2)c1 96221482 ZUCIFMHEVZZBAS-OAQYLSRUSA-N 395.547 3.997 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(-c2nc3ccccc3s2)o1 818829 SSGHXTSRAWMUBC-WJDWOHSUSA-N 397.481 3.859 10 40 GHCB CCCc1cc2c(=O)c(-c3ccc4c(c3)OCCO4)coc2c(CN(C)C)c1O 934347 KJNAEXDMQJHQJL-UHFFFAOYSA-N 395.455 3.951 10 40 GHCB biogenic COc1ccc(N2CCN(C3=NC(=O)/C(=C\c4ccc(C)cc4)S3)CC2)cc1 1443596 BFTYXXHSVZPRHA-HMMYKYKNSA-N 393.512 3.796 10 40 GHCB N=C1/C(=C/c2ccc(OC(=O)c3ccc(F)cc3)cc2)C(=O)N=C2SC=CN12 4656115 APBWMTSORKWQOV-HJMKZUPFSA-N 393.399 3.822 10 40 GHCB CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(CC(=O)O)C1=O 6265126 JGVQDEHBANIDEY-MHWRWJLKSA-N 387.482 3.914 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1Cl 13647255 FJODAQUVRKSGMM-UHFFFAOYSA-N 394.924 3.817 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccccc1Br 14099563 YTQNJWUDLMOSNV-UHFFFAOYSA-N 397.338 3.726 10 40 GHCB COc1ccc(CC(=O)c2ccc(O)c(CN3CCCC[C@@H]3C)c2O)cc1OC 23135318 DLJDTWLGKBTGRS-HNNXBMFYSA-N 399.487 3.915 10 40 GHCB biogenic COc1ccc(/C=C2\SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)c(OC)c1 54164266 ROZYRRARLJDOPT-MFOYZWKCSA-N 398.440 3.793 10 40 GHCB CCCC[C@@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 3263967 DEBCVGZOAATFKW-JOCHJYFZSA-N 381.476 3.778 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)sc2c1CCCC2 4291924 JXLFVINTYJJOLS-VXGBXAGGSA-N 379.478 3.633 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C\c3ccc4nccnc4c3)SC2=S)cc1 13734057 JRIPEOFONMPLHO-MHWRWJLKSA-N 393.449 3.734 10 40 GHCB CCn1cc(/C=C2\C(=O)NC(=S)N(C3CCCCC3)C2=O)c2ccccc21 6395909 RENAHQJEPWBXKA-SFQUDFHCSA-N 381.501 3.621 10 40 GHCB Cc1ccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccccc32)cc1C 35527520 SSJQBGGIXUCGAO-UHFFFAOYSA-N 382.485 3.693 10 40 GHCB Cc1ccc(NC2=NC(=O)/C(=C/c3ccc(O[C@@H](C)C(=O)O)cc3)S2)cc1 210836591 UXZMRJURIWHVGJ-MFVBVHDHSA-N 382.441 3.929 10 40 GHCB CCCOC(=O)CCCN1C(=O)/C(=C/c2cccc(OC)c2)SC1=S 7262439 VZRXQJTTZYPZKP-QINSGFPZSA-N 379.503 3.630 10 40 GHCB CN(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 4745546 HYEIEZAIJPHJJM-FOWTUZBSSA-N 386.498 3.530 10 40 GHCB CCOc1ccc(NC(=O)CN2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 1908323 QFGUEQRLTNLBFW-ATVHPVEESA-N 398.509 3.925 10 40 GHCB O=C(NN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccc(Cl)cc1 2258357 OLTXWQJXYQZUDA-WQLSENKSSA-N 380.903 3.948 10 40 GHCB O=C(O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)c1 3348500 YIIFDIAZZDHDAM-UHFFFAOYSA-N 394.861 3.963 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@H](CC(C)C)C3=O)c2C)cc1C 6832170 ISEAZPPCXKRKIH-HXUWFJFHSA-N 395.503 3.860 10 40 GHCB CCn1c(-c2ccccc2)cnc1SCC(=O)NC(=O)Cc1ccccc1 22229697 LFSZSUNVDJOCMM-UHFFFAOYSA-N 379.485 3.548 10 40 GHCB COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O 408801601 WHMOERHZGZTSJV-MHWRWJLKSA-N 384.819 3.632 10 40 GHCB CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 408873947 XRHNQJUJOIDNDO-MHWRWJLKSA-N 384.819 3.714 10 40 GHCB Cc1ccccc1-n1c(C)cc(C(=O)NCc2nnc3n2CCCCC3)c1C 42060376 VRIXFJDUQQINNS-UHFFFAOYSA-N 377.492 3.650 10 40 GHCB CCC[C@@H](c1nnnn1C1CCCCC1)N1CCN(c2ccc(OC)cc2)CC1 57669495 GWUOZJLEFSACOU-NRFANRHFSA-N 398.555 3.850 10 40 GHCB COc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccccc2)SC1=S 5005484 RTGSTBRTQPTVOG-GHRIWEEISA-N 398.509 3.925 10 40 GHCB O=C(NN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)c1ccc(F)cc1 19911108 UXQXSRCMWUMUIQ-SXGWCWSVSA-N 397.456 3.853 10 40 GHCB COCCCN1CCC(NC(=O)/C=C/c2cc(C)n(-c3ccccc3)c2C)CC1 69415151 QTCYEYIYVOIRSS-ZHACJKMWSA-N 395.547 3.724 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(C(=O)c3ccccc3OC)C2=O)c1 2751458 AJSDTTBNGHUBGS-WJDWOHSUSA-N 385.466 3.745 10 40 GHCB CSCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S 4619895 XVJQAAPMSJQAQB-SERMCNLOSA-N 387.935 3.748 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccccc2CS(C)(=O)=O)cc1 58762397 CYMIITSUZGKUAL-UHFFFAOYSA-N 382.485 3.891 10 40 GHCB COc1cc2c(cc1OC)C(=O)N[C@@H](c1ccc(N3CCCCCC3)cc1)N2 63775320 UGYWRSPAIVCYNB-NRFANRHFSA-N 381.476 3.938 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2cccc(F)c2)o1 409010949 DXYFCIBFMSDTEY-SFQUDFHCSA-N 376.343 3.752 10 40 GHCB CCOC(=O)c1cc(Br)cc(Br)c1/N=N/N(C)C 17820125 XHJSQIPQGRIXKF-CCEZHUSRSA-N 379.052 3.949 10 40 GHCB COc1cccc(CN2CCC[C@@H](c3cc(=O)[nH]c(-c4cccs4)n3)C2)c1O 19567202 XAUGIVLMPWJZDD-CQSZACIVSA-N 397.500 3.592 10 40 GHCB CCCc1cc(=O)oc2c3c(ccc12)OCN(c1ccc2c(c1)OCCO2)C3 2125227 PGDMFWXMOVRGTQ-UHFFFAOYSA-N 379.412 3.873 10 40 GHCB biogenic Cc1ccc(N2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)cc1C(=O)O 5373392 JEAWEICNYGWTSH-NVNXTCNLSA-N 399.449 3.797 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(CC(=O)Nc2cc(C)on2)C1=O 27530478 QAMDDICDXNARPE-NVXXTVOZSA-N 399.497 3.769 10 40 GHCB CN1C(=O)/C(=C\c2nc(-c3ccccc3)nn2-c2ccccc2)SC1=S 27562190 MVJPHXCCTLMFLW-NTCAYCPXSA-N 378.482 3.765 10 40 GHCB N=C1/C(=C/c2cccc3ccccc23)C(=O)N=C2SC(N3CCCCC3)=NN12 41084832 HGSSPWDTWITBET-LKUHCXOVSA-N 389.484 3.902 10 40 GHCB Cc1ccccc1NC1=NC(=O)/C(=C/c2ccc(O[C@H](C)C(=O)O)cc2)S1 210836544 ZRPGDHPMTJZZDI-GPLLRDDGSA-N 382.441 3.929 10 40 GHCB COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(O)c(OC)c1 408896242 WYEYMIKMZXQYPA-HIXWQLQUSA-N 393.439 3.835 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)o1 409332906 SSJDCDXSAVJZQB-MDWZMJQESA-N 378.862 3.788 10 40 GHCB CN1CCN([C@@H]2Cc3ccccc3Sc3ccc(N4CCOCC4)cc32)CC1 95696715 BPSRTAPGDDZPEC-OAQYLSRUSA-N 395.572 3.519 10 40 GHCB COc1ccc(N(C)CN2C(=O)S/C(=C/c3ccc4c(c3)OCO4)C2=O)cc1 5319510 QOEGADVAYORKTK-VCHYOVAHSA-N 398.440 3.554 10 40 GHCB CC[C@H](Oc1cc(C)ccc1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217028723 CCSFHTNZNFDWSV-QFIPXVFZSA-N 395.547 3.529 10 40 GHCB Cc1ccc(C(=O)[C@H]2Sc3nnc(C)n3N[C@H]2c2ccc(N(C)C)cc2)cc1 3258355 HUMULPMOVXZNNX-ICSRJNTNSA-N 393.516 3.603 10 40 GHCB CCN1CCC2(CC1)Oc1c(OC)cccc1[C@@H]1CC(c3ccccc3O)=NN12 10214462 CYNQPDVNUARUOJ-IBGZPJMESA-N 393.487 3.756 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1cccc(C)c1 14414444 NMPUFMHVWORFBQ-MOSHPQCFSA-N 377.440 3.876 10 40 GHCB O=C1N=C(NC2CCCC2)S/C1=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 33527903 VLOUPNAOZCPADG-SFQUDFHCSA-N 386.477 3.698 10 40 GHCB O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(-c2ccccc2F)o1 54284973 XXIXCHPTYVHSDN-UHFFFAOYSA-N 380.419 3.852 10 40 GHCB COc1ccc(N2N=C(c3ccccc3)/C(=C(\C)NCc3cccnc3)C2=O)cc1 100136031 GWZUVBYGVUSXEP-XLNRJJMWSA-N 398.466 3.905 10 40 GHCB CCN(CCNC(=S)Nc1cccc(C(=O)OC)c1C)c1ccc(C)cc1 225793485 FJQYSLYNRZUJIH-UHFFFAOYSA-N 385.533 3.903 10 40 GHCB CCOc1cc(C)c(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)cc1C(C)C 409391498 IHTGSEFKQJOXDT-LDADJPATSA-N 393.443 3.579 10 40 GHCB Cc1c2c(cc3c4c(c(=O)oc13)CCC4)CN(c1ccc3c(c1)OCO3)CO2 2112978 ODFVEDWMMSSRGM-UHFFFAOYSA-N 377.396 3.675 10 40 GHCB biogenic O=C(c1ccc([N+](=O)[O-])o1)N1N=C(c2cccs2)C[C@@H]1c1ccccc1O 4487162 YQTHNUMLGQDRLV-CYBMUJFWSA-N 383.385 3.946 10 40 GHCB COc1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C)C2)cc1 260572555 BEGXZZSTWNTATL-HNNXBMFYSA-N 392.496 3.549 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3cccc(C)c3)C(C)=C2C(=O)OC)ccc1O 408770586 ZFAZMSRMWQFMIA-PDGQHHTCSA-N 393.439 3.977 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(-c2ccccc2)n1-c1ccccc1 408783719 QLSKNTCIBNTUJP-UHFFFAOYSA-N 399.450 3.887 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=S)N(c3cc(C)ccc3C)C2=O)cc1 4724073 AAZFSCGLBUZKAE-AHEGLGOKSA-N 392.480 3.700 10 40 GHCB CC[C@H]1CCCCN1C(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 5370748 PIWBHHSUEATUDO-UESPBHMZSA-N 378.519 3.662 10 40 GHCB O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NC1CCCC1 5370870 ONDLKHADQYXODG-NPDFUIFFSA-N 386.542 3.893 10 40 GHCB Cc1cc(C)cc(CSCC(=O)NCc2ccc(N3CCOCC3)cc2)c1 10113292 NQHYEHYOCXKHJT-UHFFFAOYSA-N 384.545 3.690 10 40 GHCB O=C1NC(=S)N(CCC2=CCCCC2)C(=O)/C1=C\Nc1ccc2c(c1)CCC2 13511310 LCYAPRPPEZIRMH-RGEXLXHISA-N 395.528 3.605 10 40 GHCB COc1ccc(N2CCN(CCCNc3nc4ccccc4s3)CC2)cc1 26761330 ZNOGRQCUYMXCNG-UHFFFAOYSA-N 382.533 3.929 10 40 GHCB Cc1nn(-c2ccc(Cl)cc2)c(C)c1S(=O)(=O)Nc1ccc(O)cc1 36352575 OTTPLIHHELSPSX-UHFFFAOYSA-N 377.853 3.649 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1 408807384 CFMARHIEJKTZQI-MHWRWJLKSA-N 384.819 3.714 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2sccc2[C@H]1C1CC1 7255666 VESKIFVZZIVEGF-JOCHJYFZSA-N 383.561 3.782 10 40 GHCB O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C\c1ccccc1O 13547861 XMDVTBUQVKQDLO-PDGQHHTCSA-N 399.903 3.838 10 40 GHCB Cc1cc(/C=C/C(=O)NCc2nnc3n2CCCCC3)c(C)n1-c1ccccc1 25667638 LNQPDAYEEZIDAF-OUKQBFOZSA-N 389.503 3.742 10 40 GHCB CCN1C(=O)NC(=O)/C(=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1=O 665247 KSPLLJHNASWJRT-DHZHZOJOSA-N 379.199 3.735 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)Cn3nc(C)c([N+](=O)[O-])c3C)c2C)cc1 4500145 ZORGSNYMABDLMA-UHFFFAOYSA-N 382.420 3.707 10 40 GHCB CN1CCC2(CC1)N=C(c1ccccc1O)C[C@@H](c1cc(Cl)ccc1O)N2 15830400 YVFYVFRJJYUSQQ-SFHVURJKSA-N 385.895 3.697 10 40 GHCB COc1ccc(-n2c(C)ccc2[C@H]2[C@H](c3ccccn3)NC(=S)N2C)cc1 222764454 POOOHSAKXBDATK-PMACEKPBSA-N 378.501 3.792 10 40 GHCB CCOCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1OCC 224699337 DMAHYQIZQOJKQD-UHFFFAOYSA-N 398.503 3.593 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)CN3C(=O)c4ccccc4C3=O)c2C)cc1 4503884 MZMWOADTLNTSQN-UHFFFAOYSA-N 388.423 3.582 10 40 GHCB CCOC(=O)N1CCC(NC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)CC1 5483975 MYRDZQWKLQFIJJ-UHFFFAOYSA-N 383.492 3.753 10 40 GHCB COc1ccc(C[C@H]2SC(=S)N(CCc3ccccc3)C2=O)c(OC)c1 8115203 RMVKRHSNETUMIY-GOSISDBHSA-N 387.526 3.718 10 40 GHCB O=C(NCc1ccco1)[C@@H]1Cc2ccccc2CN1Cc1cc(Cl)ccc1O 199407644 MEHJVLYBEOTZRM-FQEVSTJZSA-N 396.874 3.882 10 40 GHCB Cc1cc(/C=C2/C(=O)N(C)C(=S)N=C2O)c(C)n1-c1ccc(F)c(Cl)c1 9009956 HBCJTDALZHFVAG-NTUHNPAUSA-N 391.855 3.983 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\Nc3ccc(Cl)cc3Cl)C2=O)c1 5548083 RRYMXVDNEVNWPH-UKTHLTGXSA-N 390.226 3.881 10 40 GHCB CC1(C)Cc2cc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)ccc2O1 408710865 QTURPIYPGMZFKG-CXUHLZMHSA-N 396.830 3.720 10 40 GHCB COCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc(C)n1-c1ccccc1 223033313 GQZWWWHCJIREGW-NHCUHLMSSA-N 392.528 3.800 10 40 GHCB CCn1cc(/C=C2\C(=O)NC(=O)N([C@H](C)c3ccccc3)C2=O)c2ccccc21 5478041 SDOHFGKMYDTTDO-DQPIFXJKSA-N 387.439 3.884 10 40 GHCB COCCCN1C(=O)/C(=C\c2cccc(OC)c2OC(F)F)SC1=S 14238518 QIQHBMQCKGVPPL-FMIVXFBMSA-N 389.445 3.534 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(Cl)c(C)c3)CC2)cc1 59317898 XFTPLBXOQQJQLT-INIZCTEOSA-N 388.895 3.773 10 40 GHCB COc1ccc(N2COc3c(cc4c5c(c(=O)oc4c3C)CCC5)C2)cc1OC 2118061 BFTWXOABOHGQFF-UHFFFAOYSA-N 393.439 3.964 10 40 GHCB biogenic O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1CCCCC1 4860395 HWVMNNCIPNQGEW-KAMYIIQDSA-N 380.560 3.788 10 40 GHCB Cc1cc2oc(=O)c3c(c2c(O)c1C1=NN[C@H](c2cccc(F)c2)C1)CCC3 12321915 LAJDKZJYILAEML-INIZCTEOSA-N 378.403 3.874 10 40 GHCB CC(C)Oc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCCN3C)N(C)C)cc1 13008155 PTTDMVQUKXWXKE-HSZRJFAPSA-N 395.547 3.889 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N(C)C3CCC(C)CC3)sc2n1 14152053 VVCMHIYFJVSYBT-UHFFFAOYSA-N 389.521 3.689 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)NCCc3cn4ccccc4n3)c2C)cc1 25529557 YIKYJHXIAOWURM-UHFFFAOYSA-N 388.471 3.723 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1cccc(OC)c1 408770118 SXTLQBOYUXEMEV-UYRXBGFRSA-N 379.412 3.581 10 40 GHCB O=C1NC(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1ccsc1 409235742 QDHKSRDRGHTMFP-WUXMJOGZSA-N 382.388 3.598 10 40 GHCB COc1ccccc1NC(=O)c1ccc(/C=C2/SC(=S)N(C)C2=O)cc1 5374776 GBYADSDQDIAVTK-LFIBNONCSA-N 384.482 3.779 10 40 GHCB CC[C@@H](C)c1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 5034466 RVSGHJRMKCMCIP-KWPCUBQOSA-N 391.471 3.933 10 40 GHCB CN(C)c1ccc(/C=C2/C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc1 12414028 DKSVZDXHTUQSSD-ZROIWOOFSA-N 376.243 3.521 10 40 GHCB CCOc1ccc(/C=C2/C(=O)N(c3cccc(C(=O)O)c3)N=C2C)cc1OC 13915471 JWNBZZUWWUPJKC-LICLKQGHSA-N 380.400 3.598 10 40 GHCB O=C1C[C@@H](c2ccco2)c2c(c(O)c(O)c3c(=O)cc(-c4ccccc4)oc23)O1 96115435 OYYMXKIAVDZMDR-LBPRGKRZSA-N 390.347 3.905 10 40 GHCB biogenic CCc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3ccccc3O)C2=O)cc1 1186720 MLWXOPTYDBELFI-BOPFTXTBSA-N 398.509 3.795 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)c(C)n1C(C)C 17193825 PFRLERCKNRZMFC-LICLKQGHSA-N 385.464 3.656 10 40 GHCB CN(C)C(=O)c1ccc([C@H]2CCCN(Cc3ccc4c(c3)CCCN4C)C2)nc1 19705604 CKOXZDJOAWORKK-NRFANRHFSA-N 392.547 3.545 10 40 GHCB Cc1ccc(O)c([C@@H]2CC(c3ccccc3Cl)=NN2C(=O)CCC(=O)O)c1 80316233 WYKJGHKPMLYESS-KRWDZBQOSA-N 386.835 3.897 10 40 GHCB CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 113969939 RLDSKYLOTNLMCO-JOCHJYFZSA-N 382.504 3.614 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)cc1C 260572648 MWISETWDKIBVQH-INIZCTEOSA-N 388.533 3.718 10 40 GHCB Cc1ccc(Sc2ccc(/C=C3\C(=O)NC(=O)N=C3O)cc2[N+](=O)[O-])cc1 6814854 VSUMFUYHPWHLMK-UHFFFAOYSA-N 383.385 3.644 10 40 GHCB CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(O)cc1 14415102 MPNUBADZXGHOEA-HKWRFOASSA-N 377.440 3.698 10 40 GHCB Nc1ccc(-n2nc(Br)c(Br)c2Br)cc1 2162928 JAGVFCQRKOACRN-UHFFFAOYSA-N 395.880 3.742 10 40 GHCB COc1ccc([C@@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)cc1OC 4942493 KUTOVKLALJKPHB-KRWDZBQOSA-N 392.411 3.994 10 40 GHCB Cc1oc2ccc(O)c(CN(C)C3CCN(C)CC3)c2c1C(=O)NC1CCCC1 5182461 JCFMPIWQMBECBT-UHFFFAOYSA-N 399.535 3.645 10 40 GHCB O=C(NN1C(=O)/C(=C/c2ccc[nH]2)SC1=S)c1ccc(Cl)cc1Cl 5552847 ITHZSQCQYUHPPI-GHXNOFRVSA-N 398.296 3.868 10 40 GHCB Cc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1[N+](=O)[O-] 5618312 HIEIVUKGVNJESR-UHFFFAOYSA-N 386.363 3.931 10 40 GHCB COc1cc(N2CCCC2)ccc1/C=C1/NC(=O)N(Cc2cccc(C)c2)C1=O 639584 VDPCYFBABDIXJR-DEDYPNTBSA-N 391.471 3.697 10 40 GHCB CCCCCCN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CCN3CCCC)C1=O 9111246 QSUQSTYGEIZELC-KNTRCKAVSA-N 397.519 3.891 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)c3c(F)cccc3F)N3CCCC3)ccc21 13008205 PKMFIQVSBLCNTJ-OAQYLSRUSA-N 399.485 3.914 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@H](C(=O)O)[C@H](C)CC)C2=O)cc1 5373642 CHJJPBZLESNBNE-YKXPOADNSA-N 379.503 3.786 10 40 GHCB O=C1/C(=C/c2ccccc2O)SC(=S)N1CNc1ccc([N+](=O)[O-])cc1 13398535 GRFVWIJERNOQKZ-DHDCSXOGSA-N 387.442 3.571 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)N3CCCCCC3)C2=O)cc1 1183324 MEYUYYUZDRTIMR-SAPNQHFASA-N 388.558 3.989 10 40 GHCB CCCCNC(=O)c1cc(NCCCC)c2c(c1N)C(=O)c1ccccc1C2=O 4170593 MMXBBSSSGMVROC-UHFFFAOYSA-N 393.487 3.786 10 40 GHCB Nc1c(Br)cc2c(c1Br)C(=O)c1ccccc1C2=O 4366266 ZDNLBGNACWKHAX-UHFFFAOYSA-N 381.023 3.569 10 40 GHCB CCC1=NN2C(=N)/C(=C\c3c(C)nn(-c4ccccc4)c3Cl)C(=O)N=C2S1 23343478 IWCYENBWEJPXTF-ILUQACKLSA-N 398.879 3.863 10 40 GHCB Cc1cccnc1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c1C 222748068 ZNBWVQXOQHQVLX-RTBURBONSA-N 377.517 3.795 10 40 GHCB CCCCCOc1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)cc1OC 2279131 MLOWZVIIVIYUTG-NBVRZTHBSA-N 390.505 3.567 10 40 GHCB CN(C)c1ccc([C@H](CNC(=O)c2ccc(Br)cc2)N(C)C)cc1 5097769 SWWKHGVQLBBHBT-SFHVURJKSA-N 390.325 3.548 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1ccc(C)cc1 59435778 YEZBMIDLDGYCHV-MOSHPQCFSA-N 377.440 3.876 10 40 GHCB COc1ccc(CN(Cc2cccnc2)C(=S)NCc2ccco2)cc1OC 933369 NJLVITGWRIOLMU-UHFFFAOYSA-N 397.500 3.769 10 40 GHCB O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(Br)cc1 694619 IJSNECNIBOMXHU-ZROIWOOFSA-N 377.625 3.564 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1O 1416609 BJWYUTHUVWPKSD-FRKPEAEDSA-N 387.438 3.535 10 40 GHCB O=S(=O)(Cc1cccc(Cl)c1)NCc1ccc(N2CCCCC2)cc1 10113266 PBYTURBUEJEXCK-UHFFFAOYSA-N 378.925 3.950 10 40 GHCB O=C1[C@H](Cc2ccc3c(c2)OCO3)SC(=S)N1Cc1ccc(F)cc1 409160855 JPTCXFWRJCNZLM-INIZCTEOSA-N 375.446 3.526 10 40 GHCB CCCc1nnc(S/C(=C\c2ccc(N(CC)CC)cc2O)C(=O)O)[nH]1 7342209 OVWXPWDMJSPFKG-GDNBJRDFSA-N 376.482 3.527 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1cccc(F)c1 6348285 GOELCLFSETWUMA-UNOMPAQXSA-N 381.403 3.707 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1 5555057 VYLVQHCHCKOKFL-VIZOYTHASA-N 385.422 3.519 10 40 GHCB COc1ccc(NC(=S)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 7518340 GPDPUGMNLBIHSY-UHFFFAOYSA-N 386.355 3.936 10 40 GHCB O=C1N=C(O)/C(=C\c2ccccc2O)C(=O)N1c1cccc(Br)c1 59198315 MXEQVAJGOGOBFI-MDWZMJQESA-N 387.189 3.661 10 40 GHCB CCOc1cc(/C=C2/C(=N)N3N=C(C4CCCCC4)SC3=NC2=O)ccc1O 8959008 XLNBBNFEDUQVQV-QBILMKHKSA-N 398.488 3.990 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2)o1 2262809 REUFEZWBAIAODS-GZTJUZNOSA-N 394.333 3.891 10 40 GHCB O=C1/C(=C/c2ccc(N3CCOCC3)cc2)SC(=S)N1c1ccccc1 4106888 NSXHZFZGHPTBKF-JXAWBTAJSA-N 382.510 3.929 10 40 GHCB Cc1cc(C(=O)CSc2nnnn2C)c(C)n1-c1ccc(Cl)c(Cl)c1 6626304 ZQFSEBYOIQQCBV-UHFFFAOYSA-N 396.303 3.899 10 40 GHCB CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(Cl)ccc2O)cc1 7988839 UQJRFPWDEGAQMR-SFHVURJKSA-N 388.895 3.933 10 40 GHCB CC1CCN([C@H](c2ccc(N(C)C)cc2)c2nnnn2Cc2ccccc2)CC1 4847688 RAOWSLXITKUKFR-JOCHJYFZSA-N 390.535 3.609 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)NC1CCCCC1 35640701 CULWZZVWMXRPMA-QINSGFPZSA-N 378.519 3.710 10 40 GHCB COc1ccc(COC[C@@H](O)CN(Cc2ccco2)Cc2ccccc2O)cc1 6082938 UTHQOGRCZCRLBQ-FQEVSTJZSA-N 397.471 3.574 10 40 GHCB C[C@@H]1CCCN(c2ccc([C@@H](C)NC(=O)[C@H]3COc4ccccc4O3)cc2)C1 218299090 SLGMRTWJAMPASR-DRSNIGMVSA-N 380.488 3.940 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3ccccc3F)SC2=S)cc1O 5374134 HOZBMZMCRJRMST-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/c3ccc(N4CCCCC4)o3)C2=O)c1C 4513297 MVIDNXXZGAWGFL-LGMDPLHJSA-N 393.443 3.553 10 40 GHCB COC(=O)c1ccc(-n2c(C)cc(-c3csc(N4CCOCC4)n3)c2C)cc1 21275229 MDWYAFIUWBWBGF-UHFFFAOYSA-N 397.500 3.841 10 40 GHCB CCCCNC(=O)CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S 4855680 GOBGGTGKPCENMK-KAMYIIQDSA-N 382.938 3.848 10 40 GHCB Cn1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)c2ccccc21 17124332 BXMANSWYTWAOQD-YBEGLDIGSA-N 379.416 3.989 10 40 GHCB O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1C(=O)c1ccccc1F 408719022 FYZQVHUWFXNTNG-NTEUORMPSA-N 388.401 3.776 10 40 GHCB COc1ccccc1Cc1cc(O)n2ncc(C(=O)Nc3ccc(C)cc3)c2n1 19210718 OOZKKNWRVAMKET-UHFFFAOYSA-N 388.427 3.595 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(Cc3ccco3)C2=O)c(OC)c1OC 1136691 XVHOCRZFTRZYMG-NTEUORMPSA-N 391.470 3.707 10 40 GHCB Cc1cc(C(=O)Cn2cnc3ccccc3c2=O)c(C)n1-c1ccc(F)cc1 3268448 HYXIKVXTAIPSTA-UHFFFAOYSA-N 375.403 3.826 10 40 GHCB Cc1cc(C(=O)CSc2nnnn2C)c(C)n1-c1cccc(C(F)(F)F)c1 6361842 BESCCPCQOVPAPN-UHFFFAOYSA-N 395.410 3.611 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3ccccc3Cl)N3CCCC3)ccc21 8963332 GOYIKTSYNKMNGT-NRFANRHFSA-N 383.923 3.899 10 40 GHCB O=C1/C(=C/c2ccc(-c3ccc(F)cc3)o2)SC(=S)N1N1CCOCC1 13073951 YITIJECGQUTUBP-WJDWOHSUSA-N 390.461 3.534 10 40 GHCB O=C1/C(=C/c2ccc(Br)o2)C(O)=NC(=S)N1c1ccccc1F 33785497 MYEGASLIUCPBEO-VQHVLOKHSA-N 395.209 3.853 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)O)SC2=S)cc1 210431932 DISHKCSSWOMNGD-YBEGLDIGSA-N 385.466 3.864 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCCN(C)c2ccccc2)c1C 225748419 IOTHPGYMOSVODS-UHFFFAOYSA-N 385.533 3.985 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccccc3C)C(=S)N=C2O)ccc1O 17122710 KSRMNXKLEPFIBM-UVTDQMKNSA-N 382.441 3.771 10 40 GHCB Cc1ccccc1NC(=O)c1c(C)oc2ccc(O)c(CN3CCOCC3)c12 19794002 AWGUHFTVPZLZPB-UHFFFAOYSA-N 380.444 3.840 10 40 GHCB Cc1cccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1C 6747958 QHZKRNBCAAROPO-QFIPXVFZSA-N 396.531 3.956 10 40 GHCB Cc1ccc(C)c(N2C(=O)NC(=O)/C(=C\c3cccc(Br)c3)C2=O)c1 408869846 UILXIJOMXOXEKO-XNTDXEJSSA-N 399.244 3.732 10 40 GHCB Cc1ccc(C)c(N2C(=O)NC(=O)/C(=C\c3c(O)ccc4ccccc34)C2=O)c1 408882357 QWKBKLQLYOQAOC-LDADJPATSA-N 386.407 3.829 10 40 GHCB Cc1ccsc1/C=C1\C(=O)NC(=S)N(c2cccc(C(F)(F)F)c2)C1=O 409238628 LIBWYIZHZYVZPM-XYOKQWHBSA-N 396.415 3.907 10 40 GHCB O=S(=O)(c1ccccc1)N1N=C(c2cccs2)C[C@H]1c1ccccc1O 4248188 COXATANIZCLHHA-KRWDZBQOSA-N 384.482 3.994 10 40 GHCB COc1ccc(N2CCN(Cc3cc(=O)oc4cc(C)cc(C)c34)CC2)cc1 54105896 HHSAXWSTWZZCNQ-UHFFFAOYSA-N 378.472 3.741 10 40 GHCB biogenic CCN(CC)c1ccc(CNS(=O)(=O)c2cc(Cl)ccc2OC)cc1 222766620 OSJQXCYJWOSVNF-UHFFFAOYSA-N 382.913 3.673 10 40 GHCB Cc1ccc(N(C)CCNC(=S)Nc2ccc(N3CCCC3=O)c(C)c2)cc1 225796677 ZRMYCVAMZWBAIZ-UHFFFAOYSA-N 396.560 3.853 10 40 GHCB Cc1cc(C)cc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 12062721 XJHSPSZSQIYXOE-QFIPXVFZSA-N 396.531 3.956 10 40 GHCB O=C(NCCc1ccc(O)c(O)c1)Nc1ccc(Oc2ccc(F)cc2)nc1 95410020 WZVCJYLZPUTENK-UHFFFAOYSA-N 383.379 3.788 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1O 35648714 BUBKQWXTIWZDEK-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB COc1cccc(CN2CCC[C@@H](c3nnsc3-c3cc(C)no3)C2)c1O 19120785 WUVPMGKUPJHDIY-CYBMUJFWSA-N 386.477 3.595 10 40 GHCB COc1ccccc1NC(=O)NC[C@@H](c1ccc2c(c1)CCN2C)N1CCCC1 35597214 BEAOTLZUURQTIW-NRFANRHFSA-N 394.519 3.646 10 40 GHCB C[C@@H](Oc1cccc2ccccc12)C(=O)NCc1ccc(N2CCOCC2)cc1 219040983 DIHHBOBGCIONNP-GOSISDBHSA-N 390.483 3.760 10 40 GHCB N=C1Nc2nc3ccccc3n2[C@@H](c2cc(Br)cc(Cl)c2O)N1 575442911 XTSYOQCKHCUKRI-ZDUSSCGKSA-N 392.644 3.655 10 40 GHCB COCCN1C(=O)/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)SC1=S 2688748 KBHQKUYHZSGTNT-GDNBJRDFSA-N 390.442 3.702 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1 4291567 BOJLNYGJIGQGFT-MFOYZWKCSA-N 398.465 3.780 10 40 GHCB O=C1c2ccccc2C(=O)c2c1ccc(N1C(=O)c3ccccc3C1=O)c2Cl 6496370 OJHVWWHFHPBTDU-UHFFFAOYSA-N 387.778 3.916 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)c1O 13547162 HRUGLZPOVGJIDR-WJDWOHSUSA-N 386.498 3.873 10 40 GHCB CCOc1cc(/C=C2\C(=N)N3N=C(C(CC)CC)SC3=NC2=O)ccc1O 13811027 UQIYZEUDHGHMJP-ILUQACKLSA-N 386.477 3.846 10 40 GHCB Cc1cccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccco4)oc3=O)c2C)c1 58367804 YWYJBHOIPNLTRY-UHFFFAOYSA-N 377.400 3.695 10 40 GHCB CCOc1cccc(N2C(=O)N=C(O)/C(=C\c3ccc(N4CCCC4)o3)C2=O)c1 59138519 PBQHOAIVVHOPGB-GHRIWEEISA-N 395.415 3.785 10 40 GHCB CN(C)c1ccc(/C=C2\SC(=O)N(CC(=O)Nc3ccc(F)cc3)C2=O)cc1 408871396 ZKRNNRULMVBFAS-BOPFTXTBSA-N 399.447 3.567 10 40 GHCB CC1(C)[C@H]2CC[C@@H]1[C@@H](O[C@@H]1CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@H]13)C2 4568188 NLLZPZMJMSXUEY-FKOVJARKSA-N 382.456 3.576 10 40 GHCB CCN1C(=O)/C(=C\c2cccs2)C(=O)N(c2ccc(Cl)cc2)C1=S 4739172 QNNALURLUOFGEU-GXDHUFHOSA-N 376.890 3.965 10 40 GHCB COc1cc(CN2CCC(OC3CCOCC3)CC2)c(O)c(C(C)(C)C)c1 95974170 TYBMUHDTPNUQJO-UHFFFAOYSA-N 377.525 3.858 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C\Nc2ccc(F)c(Cl)c2)C1=O 408527685 GFCVHJRKMPSVLV-JLHYYAGUSA-N 387.798 3.620 10 40 GHCB COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1C 408990341 XBIUBSJVLREGLY-DHDCSXOGSA-N 384.819 3.632 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=S)N(C3CC3)C2=O)c(C)n1-c1ccc(Cl)cc1 5029611 NRXGZNZGEMVFAZ-YVLHZVERSA-N 399.903 3.537 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)c2cccc(Br)c2)c1 7496855 NGHDYHGQBKATMJ-UHFFFAOYSA-N 391.265 3.547 10 40 GHCB CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccccc1O 14415032 FKOADVHNXQYWIR-CYVLTUHYSA-N 377.440 3.698 10 40 GHCB O=C(C1=CN(c2ccc3c(c2)CCC3)c2ccccc2S1(=O)=O)N1CCCC1 38655227 GNOLSMCMZQOJAQ-UHFFFAOYSA-N 394.496 3.565 10 40 GHCB C[C@@H](Oc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2O)cn1)c1ccccc1 65607986 GDKYDDVUXQPBQM-CQSZACIVSA-N 393.399 3.765 10 40 GHCB CCOc1ccc2ccccc2c1C[C@H]1SC(=S)N(CCOC)C1=O 6964726 RGAWQICGPMYOLY-QGZVFWFLSA-N 375.515 3.656 10 40 GHCB CCCN(CCC)c1ccc(/C=C2/C(=O)NN(c3ccc(F)cc3)C2=O)cc1 4063524 DVTAPCUAGQWSKN-HKWRFOASSA-N 381.451 3.914 10 40 GHCB COC(=O)c1ccc(C)c(NC(=S)NCc2ccc(N3CCCC3)cc2)c1 225424080 DCEKVHXFLGGOLC-UHFFFAOYSA-N 383.517 3.868 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NCCCOC(C)C 103917634 ZGCTYICGLWTNNA-CYVLTUHYSA-N 388.468 3.776 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)OCC(=O)Nc3ccccc3)c2C)cc1 7225946 ZZSJPIFEHSAAKO-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)C[C@H](C)O3)C1=O 408710846 PJNCAQODUHJLQF-RGZVIEDOSA-N 396.830 3.638 10 40 GHCB CN1CCN(c2ccc(CNC(=S)Nc3ccc(F)c(Cl)c3)cc2)CC1 225776443 VGQGHDBHHGBOAA-UHFFFAOYSA-N 392.931 3.718 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1cccc(O)c1 5370768 YSTZZJSECBUWKB-BJXWFGTRSA-N 396.493 3.788 10 40 GHCB CC(C)Oc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N(C)C)cc1 13008157 PTTDMVQUKXWXKE-QHCPKHFHSA-N 395.547 3.889 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3sccc3C)C(=O)NC2=S)cc1Cl 686747 YPFRXISDLHVRBL-XYOKQWHBSA-N 376.890 3.850 10 40 GHCB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 4062677 JZMBXAQQOFJYKV-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB Cc1cccc(CN2C(=O)N/C(=C/c3cc(C)n(-c4ccncc4)c3C)C2=O)c1 4661125 OFYJSXDSCKNVEW-FYJGNVAPSA-N 386.455 3.890 10 40 GHCB O=C1/C(=C/c2ccccc2Br)SC(=S)N1C[C@@H]1CCCO1 9190101 SDBQLZVMIJAPLA-LFTLCWSBSA-N 384.320 3.829 10 40 GHCB CCCCC[C@H](OC)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O 13374816 RNOYIZPXILLZCR-HNNXBMFYSA-N 386.400 3.552 10 40 GHCB biogenic,in-vitro COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cc(C)ccc2C)C1=O 408803101 LGHWJDTWFGVVPS-XNTDXEJSSA-N 384.819 3.632 10 40 GHCB COc1cc(OC)c(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc1Cl 409084214 XEEIHFAKAVYCJS-LYGDGENHSA-N 399.921 3.737 10 40 GHCB COc1ccc(N2C(=O)N=C(O)/C(=C\c3cn(C)c4ccccc34)C2=O)cc1 1406624 WXKKRFFTBPALMC-GZTJUZNOSA-N 375.384 3.694 10 40 GHCB COC(=O)COc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1 4544560 JEASWVBDCAGMKP-LFIBNONCSA-N 385.466 3.644 10 40 GHCB Cc1cc(C2=NN=C(NC[C@H]3CCCO3)SC2)c(C)n1-c1ccc(F)cc1 7985349 CZZJXSDVDWQZIW-QGZVFWFLSA-N 386.496 3.809 10 40 GHCB CCCCCCN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CCN3CCCC)C1=O 5865111 QSUQSTYGEIZELC-MNDPQUGUSA-N 397.519 3.891 10 40 GHCB COc1ccc(NC(=O)c2c(C)oc3ccc(O)c(CN4CCOCC4)c23)cc1 19793997 DESBBNDVNHDBLM-UHFFFAOYSA-N 396.443 3.540 10 40 GHCB CC(C)c1ccc(S(=O)(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc1 5653000 KKZUJEVEEMNEDS-LBPRGKRZSA-N 392.546 3.896 10 40 GHCB COc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)o1 58865877 DYCNABFTHIDZJF-UHFFFAOYSA-N 399.355 3.617 10 40 GHCB COc1ccc(N(C)CCNC(=S)Nc2cccc(Br)c2)cc1 225797512 RUMROFYIPQISAQ-UHFFFAOYSA-N 394.338 3.881 10 40 GHCB Cc1cc(C(=O)CN2C(=O)NC3(CCCC3)C2=O)c(C)n1-c1ccc(Cl)cc1 2631384 IYHMKZLIXFEIDA-UHFFFAOYSA-N 399.878 3.795 10 40 GHCB Cc1ccc(NC2(NC(=O)c3cccc(C)c3)C(=O)c3ccccc3C2=O)cc1 226297816 HBKFOPPRDNSSFM-UHFFFAOYSA-N 384.435 3.921 10 40 GHCB COc1cc(N2N=C(C)/C(=C/Nc3cccc(C(=O)O)c3)C2=O)ccc1Cl 408537144 ZIDJKCZIERBPNW-GDNBJRDFSA-N 385.807 3.765 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=CSC4=NC3=O)c2C)c(C)c1 33332259 PPVQGNWUHLMJQU-YAPNPGLHSA-N 377.473 3.960 10 40 GHCB CCOc1ccc(N2C(=O)N=C(O)/C(=C\c3ccccc3OCC)C2=O)cc1 59860360 RIALJOCLCJPYIR-GHRIWEEISA-N 380.400 3.991 10 40 GHCB c1csc([C@@H](CNCc2ccc(N3CCCCC3)cc2)N2CCOCC2)c1 22921965 MDMXZZQQWKNKCU-OAQYLSRUSA-N 385.577 3.902 10 40 GHCB COc1ccc(N2CCN(c3ccc(N4CCN(C(C)C)C4=O)cc3)CC2)cc1 33358752 KMIIRMKLQKPOAL-UHFFFAOYSA-N 394.519 3.672 10 40 GHCB O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1 1098504 XSMDNNPUUGUTQS-NTEUORMPSA-N 394.349 3.676 10 40 GHCB O=C(O)COc1cccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)c1 1157506 UPIDMWRRSQWOBA-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C\c2ccccc2OCC(=O)O)SC1=S 16909791 JRPPOZUGADTCAG-MHWRWJLKSA-N 385.466 3.864 10 40 GHCB CCn1c(S[C@H](C)C(=O)Nc2ccc(N)cc2)nnc1-c1cccc(C)c1 930597 WDTACZLWBPRHHN-CQSZACIVSA-N 381.505 3.975 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1O 59417967 ARWGMLVBALZNRT-NVNXTCNLSA-N 388.426 3.715 10 40 GHCB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1 408959845 GUSZECLZSKKCBT-XDJHFCHBSA-N 391.496 3.508 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)c1 408933525 ANDICYGAKIMJQQ-RGEXLXHISA-N 378.428 3.704 10 40 GHCB COc1cccc(CNC(=O)Nc2cc(C(F)(F)F)ccc2N(C)C)c1O 97552262 FIYPCQKNWCYPAU-UHFFFAOYSA-N 383.370 3.807 10 40 GHCB CC1=C(C(=O)O[C@H]2CC[C@H](C)[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 4043517 PGIBQQKMAPFGKC-GCYDMZABSA-N 385.508 3.748 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccc(O)cc1 17299829 DIPOVWWCRGYBNN-UYRXBGFRSA-N 379.412 3.668 10 40 GHCB COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(Cl)c1OC(C)C 409408525 QZVQOTNASAWCNC-DHDCSXOGSA-N 386.835 3.597 10 40 GHCB COc1cc(/C=C2/C(=N)N3C(c4ccccc4)=CSC3=NC2=O)ccc1O 1300490 XPHUGXBOPLSGQO-LCJGLDDCSA-N 377.425 3.705 10 40 GHCB CCCN1C(=O)/C(=C/c2cc3ccccc3nc2N2CCOCC2)SC1=S 20310807 SAYDRWORYZANCW-LGMDPLHJSA-N 399.541 3.683 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccccc1Cl 408723657 ZBTRKAGTCOVSNB-MDWZMJQESA-N 377.252 3.825 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccccc1OC 5482400 SNSSZAOKHOIEDL-CYVLTUHYSA-N 377.440 3.611 10 40 GHCB COc1ccc([C@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)cc1O 12297006 ZCOWMEDZXJULJW-CQSZACIVSA-N 394.427 3.577 10 40 GHCB biogenic CC(=O)Nc1ccc(NC2=NC(=O)/C(=C\c3cccc([N+](=O)[O-])c3)S2)cc1 35043511 TUGAGACEQKUDDC-MHWRWJLKSA-N 382.401 3.636 10 40 GHCB O=C(NCc1ccccc1O)C1CCN(C(=O)c2cccc3ccccc23)CC1 58158280 WYSHSWXUCRTFPC-UHFFFAOYSA-N 388.467 3.714 10 40 GHCB Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)C(F)(F)F)nn1C 101609495 OMFWHYZSLFSCPC-UKTHLTGXSA-N 384.308 3.712 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1 408967149 SPIVPEQXUDIXRB-QZRSKMOPSA-N 376.412 3.535 10 40 GHCB O=C1[C@@H](Cc2ccc3c(c2)OCO3)SC(=S)N1CCCc1ccccc1 409160368 HFZQPTDCPNOISM-GOSISDBHSA-N 385.510 3.820 10 40 GHCB COc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)C(=O)NC2=S)cc1 2873531 HXJAIQJWBKQZLU-PDGQHHTCSA-N 380.469 3.650 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C/c3cccc([N+](=O)[O-])c3)S2)c(OC)c1 5551372 BBGHWGWNJPPUAT-SXGWCWSVSA-N 385.401 3.694 10 40 GHCB O=C1NC(=S)S/C1=C\c1ccc(Sc2ccccn2)c([N+](=O)[O-])c1 12370126 ISMQVFNYDZQZAL-WQLSENKSSA-N 375.456 3.630 10 40 GHCB S=C(NCc1ccc(N2CCCC2)cc1)Nc1ncc(Cl)nc1Cl 223951859 POTAOCIFCKCMSQ-UHFFFAOYSA-N 382.320 3.870 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1C1CCCCC1 409390588 FZSTVBDZMKZZOB-CPNJWEJPSA-N 392.459 3.672 10 40 GHCB COc1ccc(N2C(=O)c3ccccc3N(C)[C@@H]2c2ccc(O)c(O)c2)cc1 23624189 FRHZKVYYSAFBHY-NRFANRHFSA-N 376.412 3.902 10 40 GHCB Cc1cc(C(=O)OCC(=O)Nc2ccc(Cl)cn2)c(C)n1-c1ccccc1 2635162 PVFHICHWWAEZDJ-UHFFFAOYSA-N 383.835 3.938 10 40 GHCB Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C/C(=O)N1CC(=O)Nc2ccccc21 3408054 WJVSUDQLLDPKPC-VAWYXSNFSA-N 390.418 3.627 10 40 GHCB CCN1C(=O)/C(=C/c2ccc(OC)c(Cn3nc(C)cc3C)c2)SC1=S 1015982 SBBZWBDLMGBQNH-YVLHZVERSA-N 387.530 3.778 10 40 GHCB CC1CCN(C(=O)CCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1217957 CKLSKBTYGOPXOY-KAMYIIQDSA-N 380.560 3.598 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)SC1=S 5032410 MUFFOAIRBWYSLL-ZJTXEKFPSA-N 377.418 3.760 10 40 GHCB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(N2CCOCC2)cc1 113945429 YXDKIRGKKPOJQL-GOSISDBHSA-N 390.483 3.760 10 40 GHCB COc1ccc(/C=C2\SC(NC3CCCC3)=NC2=O)cc1Br 21313945 BENBCEGWFYJPGB-ZROIWOOFSA-N 381.295 3.960 10 40 GHCB CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1 100469106 JREMZRTXUOLJDI-XSFVSMFZSA-N 375.428 3.791 10 40 GHCB COc1ccccc1NC(=O)c1cc2ccccc2c(CN2CCOCC2)c1O 95350617 YEPHHZCHPOZIGW-UHFFFAOYSA-N 392.455 3.639 10 40 GHCB CC(=O)c1cccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)c1 8036111 VFQRQVHVHXNXCL-UHFFFAOYSA-N 386.454 3.706 10 40 GHCB O=C(O)c1ccc(Nn2c3c(c4ccccc4c2=O)C(=O)c2ccccc2-3)cc1 1547139598 VFIXNXKHGVSRES-UHFFFAOYSA-N 382.375 3.786 10 40 GHCB biogenic CC1=NN2C(=N)/C(=C/c3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C(=O)N=C2S1 41108135 JAWBOZZNWIUXEO-AKYNJECVSA-N 395.400 3.802 10 40 GHCB COc1ccc(N2N=C(C)/C(=C/Nc3ccc(Cl)c(C(=O)O)c3)C2=O)cc1 16160723 OTLQDTOMZXKNKD-YBEGLDIGSA-N 385.807 3.765 10 40 GHCB COC(=O)c1ccc(NCN2C(=O)/C(=C\c3ccccc3)SC2=S)cc1 5320337 VUFWUVUEVMCGAX-LFIBNONCSA-N 384.482 3.744 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)sc2c1CCCC2 4291922 JXLFVINTYJJOLS-NEPJUHHUSA-N 379.478 3.633 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(c3cccc(OC)c3)C2=O)c2ccccc21 5100379 QVDOMVHKIGHKQI-WOJGMQOQSA-N 389.411 3.541 10 40 GHCB Cc1ccccc1-n1c(C)cc(C(=O)CSc2nnc(N)n2C2CC2)c1C 44040498 AORORLFUPQQCMF-UHFFFAOYSA-N 381.505 3.886 10 40 GHCB O=S(=O)(c1ccccc1N1CC=C(c2cncc(F)c2)CC1)C(F)(F)F 95468680 QPOAYFFVGONHSK-UHFFFAOYSA-N 386.370 3.808 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)N[C@@H]1c1ccc(N(C)C)cc1 6570061 DYVMPPCPEBUWBK-HXUWFJFHSA-N 379.460 3.861 10 40 GHCB C[C@H](c1ccccc1)N1C(=O)N=C(O)/C(=C/c2coc3ccccc3c2=O)C1=O 20332170 HFCIWXHMGUJBFK-GPLLRDDGSA-N 388.379 3.856 10 40 GHCB COc1ccc(/C=C2\SC(N3CCc4ccccc4C3)=NC2=O)cc1OC 13496608 FGUCSSWHLIZSDL-UNOMPAQXSA-N 380.469 3.732 10 40 GHCB Nc1c(N2CCOCC2)cc(Nc2ccccc2)c2c1C(=O)c1ccccc1C2=O 5485788 BIGJLWBSAXWXLH-UHFFFAOYSA-N 399.450 3.624 10 40 GHCB Cc1cccc(N2C(=O)/C(=C\c3cn(C)c4ccccc34)C(=O)N=C2S)c1 6898280 JJZSWDZHSAZVDN-BOPFTXTBSA-N 375.453 3.729 10 40 GHCB CC1CCN(C(=O)C2=CN(c3ccccc3)c3ccccc3S2(=O)=O)CC1 44169796 NKQXRTIODYFICQ-UHFFFAOYSA-N 382.485 3.712 10 40 GHCB COc1ccc(N2C(=O)/C(=C\c3cccn3C(C)(C)C)C(O)=NC2=S)cc1 642269 RYRHKOMWUNSCET-VBKFSLOCSA-N 383.473 3.923 10 40 GHCB O=C1/C(=C\c2ccncc2)SC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 7100027 FLHMNTKCDAPEFU-LZYBPNLTSA-N 399.541 3.530 10 40 GHCB COc1cc([C@H]2CC(=O)Nc3c(-c4ccccc4)nsc32)c(OC)c(O)c1O 35324566 SDEBBUFMKHWZRE-GFCCVEGCSA-N 398.440 3.713 10 40 GHCB O=C1N=C(O)/C(=C\c2cc([N+](=O)[O-])ccc2Cl)C(=O)N1c1ccc(F)cc1 59106200 NJVNFQMURMKVAD-MDWZMJQESA-N 389.726 3.894 10 40 GHCB O=C1/C(=C\c2ccc([N+](=O)[O-])o2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 113830612 UKBFWTNOJBJKAI-YRNVUSSQSA-N 377.359 3.502 10 40 GHCB O=C1/C(=C/c2ccc(Br)cc2)SC(=S)N1C(=O)C(F)(F)F 1027648 SPMFYCOOXXYYMO-YVMONPNESA-N 396.209 3.739 10 40 GHCB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC1=NN(c2ccccc2)C(=O)C1 1171287 HVLZJTHVKXQUHZ-NSHDSACASA-N 392.242 3.627 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)sc2c1CC[C@H](C)C2 17080415 KNTLMNCJNFJXAY-XQQFMLRXSA-N 393.505 3.879 10 40 GHCB CCOc1cc(/C=C2/SC(NC(C)=O)=NC2=O)ccc1OCc1ccccc1 32111737 NYTJMGZZOWPXIW-XDHOZWIPSA-N 396.468 3.771 10 40 GHCB C[C@H](Sc1nccs1)C(=O)N1CC(=O)Nc2cc(C(F)(F)F)ccc21 52914132 CPPWCYXSNSIXKS-QMMMGPOBSA-N 387.408 3.628 10 40 GHCB Cc1c(C)c2cc3c(c(C)c2oc1=O)OCN(c1ccc2c(c1)OCCO2)C3 2123247 LJRDJHDPKXGECL-UHFFFAOYSA-N 379.412 3.846 10 40 GHCB biogenic COc1ccc(-n2c(C)c(C(C)=O)c3c(CN4CCOCC4)c(O)ccc32)cc1 38558501 CGQKOJRCNHSFRY-UHFFFAOYSA-N 394.471 3.688 10 40 GHCB COc1ccc(Cl)cc1-n1c(C)cc(C(=O)O[C@@H](C)C(=O)NC(C)C)c1C 16685456 HPPCTNUYZMKGLK-AWEZNQCLSA-N 392.883 3.826 10 40 GHCB Cc1cccc(NC2=NC(=O)/C(=C/c3ccc(N4CCOCC4)cc3)S2)c1 97990561 VIAZELKFVMOWFW-RGEXLXHISA-N 379.485 3.914 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C\c1ccc(F)cc1 4699102 TWVQEFDGHAKXHB-BOPFTXTBSA-N 397.402 3.720 10 40 GHCB CCOC(=O)c1ccc(NC2=NC(=O)/C(=C/c3ccc(OC)cc3)S2)cc1 8783584 ATMTVRDGBFPUEC-ATVHPVEESA-N 382.441 3.954 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cnn(-c2ccccc2)n1 10962566 KJECXHZMSXXGBP-UHFFFAOYSA-N 375.476 3.530 10 40 GHCB O=C(Nc1cccc(-c2nnco2)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 47487497 UXKBJXPUYNIZLR-SFHVURJKSA-N 394.431 3.655 10 40 GHCB COc1ccc(N2CCN(c3nccn4nc(-c5cccs5)cc34)CC2)cc1 67285251 WRPZULGQMHRJPV-UHFFFAOYSA-N 391.500 3.793 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Cl)cc(OC)c3)C2=O)cc1 408875521 JQFCMDUIHAWZMB-LICLKQGHSA-N 384.819 3.577 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)c1 6211492 VXXZGVGIZMTKIS-WJDWOHSUSA-N 384.482 3.550 10 40 GHCB COc1cc(N/C(C)=C2\C(=O)N(c3ccc(F)cc3)N=C2C)cc(OC)c1OC 100423037 OHARCYGBIXDPQD-UNOMPAQXSA-N 399.422 3.960 10 40 GHCB Cc1cccnc1-n1c(C)cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c1C 222748249 ZNBWVQXOQHQVLX-OALUTQOASA-N 377.517 3.795 10 40 GHCB COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1cccc(OC)c1O 409059785 OKMJIOWTEQSHEL-JXAWBTAJSA-N 397.471 3.964 10 40 GHCB O=C1/C(=C\c2nc3ccccc3[nH]2)C(O)=NC(=S)N1CCC1=CCCCC1 13774148 ISHBKOHSXYEZGJ-OWBHPGMISA-N 380.473 3.920 10 40 GHCB CC(C)c1ccccc1O[C@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1 19933551 LMQXPBIBERZYFG-GOSISDBHSA-N 382.504 3.730 10 40 GHCB COc1ccc(CC(=O)c2ccc(O)c(CN3CCCC[C@H]3C)c2O)cc1OC 23135321 DLJDTWLGKBTGRS-OAHLLOKOSA-N 399.487 3.915 10 40 GHCB biogenic N#Cc1ccccc1COc1cccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c1 35132712 AVTZMGTVEBMOOS-HMAPJEAMSA-N 395.418 3.599 10 40 GHCB COc1ccc(S[C@H](C)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 42241135 OGTHOUAMAJLZDB-MRXNPFEDSA-N 386.517 3.533 10 40 GHCB CC[C@H](Oc1ccccc1Cl)C(=O)N1CCN(c2ccc(OC)cc2)CC1 44948590 SMHGBDPXNZLMDX-IBGZPJMESA-N 388.895 3.855 10 40 GHCB CCc1ccc(N2C(=O)N=C(O)/C(=C\c3ccc(N4CCCC4)o3)C2=O)cc1 59138532 QUFWHEUSCFZFAM-GHRIWEEISA-N 379.416 3.949 10 40 GHCB CCCCCCN/C=C1/C(=O)NC(=S)N(c2cccc3ccccc23)C1=O 101042904 FKOKVOSXLMGERG-VKAVYKQESA-N 381.501 3.641 10 40 GHCB CC[C@H]1CCc2c(sc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)c2C(=O)OC)C1 5476953 RSSRWUKYZJVTQJ-XQQFMLRXSA-N 393.505 3.879 10 40 GHCB Cc1ccc(N2NC(=O)/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1 5541393 YPMUKGGDCGLBHG-PDGQHHTCSA-N 389.367 3.625 10 40 GHCB O=C1S/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)N1Cc1ccccc1 106680690 MBVFUVVDEQXVQJ-RGEXLXHISA-N 380.469 3.760 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C\c1cccc(F)c1 107803781 CZGUYSNTJYMRCT-BOPFTXTBSA-N 397.402 3.720 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1OCC 409086105 YIIGXPNWVJCPHO-FMNVXAMXSA-N 393.530 3.864 10 40 GHCB CN1C(=O)/C(=C\c2ccc(C(=O)Nc3nc4ccccc4[nH]3)cc2)SC1=S 5236028 FAOKGQZRAMLUIP-XNTDXEJSSA-N 394.481 3.646 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cc1 12468209 YYJPISKOPJUFCR-OQLLNIDSSA-N 399.449 3.577 10 40 GHCB O=C1/C(=C\NOCc2ccc(Cl)cc2Cl)C=NN1c1cccc(Cl)n1 15953328 ZOVJRGPHVSEDBB-FLIBITNWSA-N 397.649 3.980 10 40 GHCB CN(C)c1ccc(CN2CCCC[C@H]2c2cc(=O)[nH]c(-c3ccccn3)n2)cc1 19584973 HNQBBBCRJWNNMK-NRFANRHFSA-N 389.503 3.625 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 408803055 KTWHRAIIWYKZDT-MDWZMJQESA-N 391.210 3.668 10 40 GHCB COc1cc(/C=C2/SC(=S)N(NC(=O)c3cccs3)C2=O)ccc1C 409345747 JMALWMJXRYYHNN-NTEUORMPSA-N 390.511 3.611 10 40 GHCB Cc1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 4256350 VRJQWEDTMKZNTD-UHFFFAOYSA-N 386.363 3.931 10 40 GHCB COC(=O)CN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 6003455 YHGBWGBIXILYIW-GZTJUZNOSA-N 399.493 3.640 10 40 GHCB CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(OC)c(OC)c3)C2=O)cc1 9058751 FPXCAUDIWGMIGL-WJDWOHSUSA-N 396.399 3.609 10 40 GHCB CCn1cc(C(=O)N2CCCc3ccccc32)c2nn(-c3ccccc3)c(=O)c-2c1 9661428 HSAKPUDDLOOSHJ-UHFFFAOYSA-N 398.466 3.752 10 40 GHCB COc1cccc(NC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 11562556 ISOHVSVVNKPYHV-OAQYLSRUSA-N 383.492 3.974 10 40 GHCB COC(=O)C1=C(C)N(C2CCCC2)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1Cl 33726065 GDNHWMRBZURPRG-GDNBJRDFSA-N 390.823 3.863 10 40 GHCB CC(=O)Nc1ccc(N/C=C2\C(=O)N(c3cccc(Cl)c3)C(=O)N=C2O)cc1 102620481 YXYBIQUIEXHUQH-YBEGLDIGSA-N 398.806 3.718 10 40 GHCB CN1C(=O)/C(=C\c2ccc(Oc3nc(Cl)ncc3F)cc2)SC1=S 9310449 QJQIFIJSCYWDDW-IZZDOVSWSA-N 381.841 3.892 10 40 GHCB Cn1cc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)c2ccccc21 2411988 ZMPADSUMTCEDHR-GZTJUZNOSA-N 393.493 3.725 10 40 GHCB CCN(CC)c1ccc(/C=C2/SC(=O)N(CCCOC)C2=O)c(OC)c1 409230887 HAZUBZHYRYAFMS-SFQUDFHCSA-N 378.494 3.614 10 40 GHCB Cc1cc(=O)oc2c(C)c(O)c(CN(C)C[C@@H]3CCCN4CCCC[C@H]34)cc12 524730019 RIJRAOMXGWECHM-FXAWDEMLSA-N 384.520 3.812 10 40 GHCB biogenic Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cc(C)on3)C2=O)cc1 1181679 KYBLZOHOEMFTHM-GXDHUFHOSA-N 387.486 3.521 10 40 GHCB Cc1cccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007800 RYKJADPZSGZFHK-QHCPKHFHSA-N 377.532 3.944 10 40 GHCB COc1ccc(/C=C2\SC(N3CCN(c4ccc(C)cc4)CC3)=NC2=O)cc1 1471431 OQFPBSNRSDEJHY-HKWRFOASSA-N 393.512 3.796 10 40 GHCB CC[C@H](C)[C@H](NCc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12)C(=O)O 5468735 IJAAWTXJFCQYFT-DJJJIMSYSA-N 397.427 3.880 10 40 GHCB biogenic Cc1ccc(COc2ccc(/C=C3\SC(N4CCOCC4)=NC3=O)cc2)cc1 13547522 CABJKJRLUJAFOS-ZHZULCJRSA-N 394.496 3.877 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(CC(=O)Nc2cccnc2)C1=O 16711604 UJYUORPOXWBWRS-JMRZXEDWSA-N 395.509 3.868 10 40 GHCB CCOc1ccc(N2C(=O)N=C(O)/C(=C\c3cc(C)c(O)c(C)c3)C2=O)cc1 38176866 DPYRUDUPRRTVQG-GZTJUZNOSA-N 380.400 3.914 10 40 GHCB CC[C@H](Oc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 113956148 RIEFBSVGMRHQQW-FQEVSTJZSA-N 388.895 3.650 10 40 GHCB CCc1cc(I)ccc1NC(=O)Cc1ccc(N)cc1 226269191 MHGIWJXKAABAMH-UHFFFAOYSA-N 380.229 3.617 10 40 GHCB COc1ccccc1NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCC1 22418411 FULHDPGLMZEWEN-HXUWFJFHSA-N 382.508 3.720 10 40 GHCB COc1ccc(N2CCCn3c(nc4ccccc43)C2)cc1NC(=O)C1CC1 20729379 AZJIRMOVGKLBMR-UHFFFAOYSA-N 376.460 3.804 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)cc1 1241388 HHVFYPORFJLLDS-NXVVXOECSA-N 382.466 3.813 10 40 GHCB Nc1ccc(NC(=O)c2cc3c(s2)CCC3)c2c1C(=O)c1ccccc1C2=O 4871471 IGQPXHWVCWGDBC-UHFFFAOYSA-N 388.448 3.847 10 40 GHCB Cc1cccc(COc2ccccc2/C=C2\SC(=S)N(CC(=O)O)C2=O)c1 59272401 WJGDORGWYGDNEU-YVLHZVERSA-N 399.493 3.860 10 40 GHCB CC1=NN(c2ccc(C)cc2)C(=O)/C1=C\Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 100929745 VAKGBAJIHLXWCS-GDNBJRDFSA-N 381.348 3.530 10 40 GHCB COc1ccc(-c2csc(NS(=O)(=O)c3ccc(C)cc3)n2)cc1N 217686506 IBXYLRDKFZTNBO-UHFFFAOYSA-N 375.475 3.510 10 40 GHCB Cc1[nH]c2ccccc2c1/C=C1\C(=O)N=C(O)N(CCc2ccc(F)cc2)C1=O 17044923 ZUEBZDGNHIXBJM-LDADJPATSA-N 391.402 3.524 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)Nc1cccc(O)c1 4536615 HUJJYUWTLOXNCP-RVDMUPIBSA-N 388.470 3.605 10 40 GHCB COc1cc2c(cc1C[C@@H]1SC(=S)N(CCC3CCCC3)C1=O)OCO2 8114134 OHVLKWGUYNIYIX-KRWDZBQOSA-N 393.530 3.776 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)Nc3ccccc3F)sc2n1 10645072 PALJTTICUJKJIW-LLVKDONJSA-N 387.436 3.818 10 40 GHCB CN1CCc2nc([C@H]3CCCCN3Cc3ccc4c(c3)CCCN4C)ncc2C1 19590335 XFKRQXPQANVZJQ-HSZRJFAPSA-N 391.563 3.574 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=S)N(c3cc(C)ccc3C)C2=O)cc1 409230282 BSXARISHGXBRGJ-SFQUDFHCSA-N 380.469 3.533 10 40 GHCB O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2C[C@@H](O)c1cccc(O)c1 604403959 FXHLKLADYKKGDW-HXUWFJFHSA-N 383.403 3.652 10 40 GHCB biogenic O=C1/C(=C/N2CCN(c3ccccc3)CC2)SC(=S)N1c1ccccc1 618254945 KMASKEPKDGPBBW-SDXDJHTJSA-N 381.526 3.715 10 40 GHCB Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)c(C)n1-c1ccccc1 3352935 ICPHBOIKYFVFQL-UHFFFAOYSA-N 376.243 3.841 10 40 GHCB O=C1N=C(O)/C(=C/c2ccc(O)cc2)C(=O)N1c1ccc(Br)cc1 8995738 NCKKOWAMSCMEQF-ZROIWOOFSA-N 387.189 3.661 10 40 GHCB Cc1cc(C(=O)CSc2nnc3n2CCCCC3)c(C)n1-c1ccccn1 9945489 UMGTUUMEMPULSB-UHFFFAOYSA-N 381.505 3.782 10 40 GHCB O=C(CSc1nc2ccccc2[nH]1)NCc1cc(Cl)c2cccnc2c1O 12360105 LMWXXMPKGSEJBN-UHFFFAOYSA-N 398.875 3.879 10 40 GHCB COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccccc1C(=O)O 409071104 ONCOISGYZKUFBT-RGEXLXHISA-N 395.455 3.948 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 1022095 HPUGWKNZOKZEFC-WJDWOHSUSA-N 384.482 3.550 10 40 GHCB O=C(NC(=S)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1 4310057 SCTIOOPXWHZGGS-UHFFFAOYSA-N 386.432 3.589 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)N1CCCCCC1 5370787 FGHXXNDXVIIKTE-JUBDITTISA-N 386.542 3.847 10 40 GHCB Cc1cc(C(=O)Cn2nc(-c3cccs3)oc2=O)c(C)n1-c1cccc(F)c1 16462064 MJFQVCBNEACALJ-UHFFFAOYSA-N 397.431 3.994 10 40 GHCB Fc1ccccc1OC1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 19658381 MSYOGQSWJHDWQF-UHFFFAOYSA-N 388.458 3.845 10 40 GHCB CC[C@H](Oc1cccc(C)c1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 20450413 XLTZWCAYQOYRAC-NRFANRHFSA-N 382.504 3.818 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)Nc3ccc4c(c3)NC(=O)CO4)c2C)c1 32796524 OKQIZFXDRRVWSH-UHFFFAOYSA-N 391.427 3.686 10 40 GHCB COc1ccc(OC)c(N/C=C2/C(=O)N(c3cc(C)cc(C)c3)C(=O)N=C2O)c1 103099027 PTTVVXJAQZAOIJ-LFIBNONCSA-N 395.415 3.740 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(Br)cc3)C2=O)cc1 408982647 DQADAWXKMFAKJP-WJDWOHSUSA-N 399.244 3.678 10 40 GHCB COc1ccccc1NC(=O)CN1C(=O)/C(=C\c2cccs2)SC1=S 6096777 JACILMGOGWRKOA-NTEUORMPSA-N 390.511 3.597 10 40 GHCB Cc1ccc(CN2C(=O)N/C(=C\c3cc(C)n(-c4ccccn4)c3C)C2=O)cc1 6546408 CLMPZQGQXVTLAW-MOSHPQCFSA-N 386.455 3.890 10 40 GHCB CCCCCOc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1OC 20582711 FWPUMAJDXGZWED-GDNBJRDFSA-N 395.502 3.550 10 40 GHCB biogenic CCOC(=O)c1c(N/C=C2\SC(=S)N(C)C2=O)sc2c1CCCC2 618255310 VZLUUOGGKRMZMG-FLIBITNWSA-N 382.532 3.547 10 40 GHCB CCOC(=O)c1ccc(N2N=C(C)/C(=C\c3ccc(O)c(OCC)c3)C2=O)cc1 1010729 LOSWVBTWKYPLFH-LDADJPATSA-N 394.427 3.774 10 40 GHCB COc1ccc([C@@]2(O)CN(c3cc(C)ccc3C)C3=[N+]2CCCS3)c(F)c1 2965851 NWCJKZDJELDKPF-NRFANRHFSA-N 387.500 3.622 10 40 GHCB CCCc1nnc(S/C(=C\c2ccc(N(CC)CC)cc2OC)C(=O)O)[nH]1 7342243 XGWYZQZRUPEDOZ-WJDWOHSUSA-N 390.509 3.830 10 40 GHCB CCOc1ccc([C@@]2(O)CN(c3ccccc3OCC)C3=[N+]2CCCS3)cc1 27525100 SWNKNRABFJCICO-QFIPXVFZSA-N 399.536 3.655 10 40 GHCB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)NCCc1ccc(F)cc1 100422670 JIXVRCXKJWHHGK-CPNJWEJPSA-N 382.395 3.563 10 40 GHCB CCOC(=O)c1cnc2c(/N=N/c3cccc(C(F)(F)F)c3)c(N)nn2c1N 97944946 KZPDHINHJRKRSE-WCWDXBQESA-N 393.329 3.505 10 40 GHCB Cc1ccccc1-n1c(C)cc(C(=O)Cn2nc(-c3ccco3)oc2=O)c1C 58366842 OYURVNMGYZKUDN-UHFFFAOYSA-N 377.400 3.695 10 40 GHCB COc1ccc(-c2cc(=O)oc3c(CNCc4ccncc4)c(O)ccc23)cc1 5427331 RFKAAMFTDKQZOS-UHFFFAOYSA-N 388.423 3.859 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3c(Cl)cccc3Cl)C2=O)cc1 4824353 VDNWMRUOLOYKGP-UKTHLTGXSA-N 375.211 3.968 10 40 GHCB Cc1cccc(/C=C2\SC(N3CCN(c4ccccc4F)CC3)=NC2=O)c1 13547559 STRJVLDWCYYRCX-RGEXLXHISA-N 381.476 3.927 10 40 GHCB O=C(O)C[C@H](c1ccccc1)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 6061830 ZBJMXVOFRVUGRG-VGVSSDJJSA-N 385.466 3.809 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)c3c(F)cccc3F)N3CCCC3)ccc21 13008208 PKMFIQVSBLCNTJ-NRFANRHFSA-N 399.485 3.914 10 40 GHCB COc1ccc(S[C@@H](C)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 42241133 OGTHOUAMAJLZDB-INIZCTEOSA-N 386.517 3.533 10 40 GHCB COC(=O)c1ccc(NCc2c(O)ccc(O)c2Br)cc1Cl 1650376 KTAXLDMUDOECBY-UHFFFAOYSA-N 386.629 3.912 10 40 GHCB CCOC(=O)c1[nH]c2ccc(F)cc2c1/N=N/N1CCC(C(=O)OCC)CC1 2297624 ZJYPZURQEOCMRH-GHVJWSGMSA-N 390.415 3.758 10 40 GHCB O=C1NN(c2ccc(Br)cc2)C(=O)/C1=C\c1c(F)cccc1Cl 3038710 MRXBCWUWZORWDQ-WQLSENKSSA-N 395.615 3.703 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(C(F)(F)F)c3)C2=O)cc1 408981259 ABFBXBDGMITCJL-WJDWOHSUSA-N 388.345 3.934 10 40 GHCB O=C(O)CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 6889856 XIWBZYQQPVIQNF-ATVHPVEESA-N 399.493 3.942 10 40 GHCB CCOc1cc(/C=C2\SC(Nc3ccccc3C(=O)O)=NC2=O)ccc1O 20227041 TYNGCJXASWHBPX-YBEGLDIGSA-N 384.413 3.572 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NN(c3ccc(C)c(Cl)c3)C2=O)c(O)c1 33410527 FZGBEUAERNFIJU-LICLKQGHSA-N 399.878 3.662 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1O[C@@H](C)CC 409335362 ZFVIKZDLNXJQRZ-GPILYODUSA-N 395.502 3.548 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C/c2cc(C)n(C(C)(C)C)c2C)C(=O)NC1=S 409246594 JHEGMJSVAXLXJV-SFQUDFHCSA-N 395.528 4.000 10 40 GHCB CCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)OC)C3=O)c2C)cc1 1018582 ARJOWZMEGRFANY-WOJGMQOQSA-N 398.484 3.866 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)cc1OCC 4145273 QBFFZLBCKAKVKX-FYFVVDILSA-N 390.505 3.564 10 40 GHCB Cc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1C 6747957 HQFITYQUKZILGB-HSZRJFAPSA-N 396.531 3.956 10 40 GHCB CC1=NN(c2nnn[nH]2)C(=O)/C1=C\c1ccc(-c2cc(Cl)ccc2Cl)o1 12412857 NCMUPEKWOMUHJR-XFFZJAGNSA-N 389.202 3.573 10 40 GHCB CCN(C(C)=O)c1nc(/C=C2/SC(Nc3cccc(C)c3)=NC2=O)cs1 96401380 BTNIAUKHBNQODM-OQLLNIDSSA-N 386.502 3.907 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(NC(=O)c2ccncc2)C1=O 27229175 QLZMBBWAMXJYKC-PKRRCJCNSA-N 381.482 3.574 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)sc2n1 10644899 KDVKQCRAACCTRS-DDTOSNHZSA-N 389.521 3.593 10 40 GHCB O=C(CSc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 13670692 PJAZJOZCLJNPOK-UHFFFAOYSA-N 376.909 3.585 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=S)N(CCc3ccccc3)C2=O)cc1 4622890 ZGZRIZLITVYWFX-CAPFRKAQSA-N 379.529 3.833 10 40 GHCB Oc1c([C@@H](c2ccccn2)N2CCN(c3ccccn3)CC2)ccc2cccnc12 4247748 OZSANKKZTCLFJI-QHCPKHFHSA-N 397.482 3.642 10 40 GHCB CCN(CC)C(=O)CCN1C(=O)S/C(=C/c2ccc(OC)cc2)C1=S 5010031 FXRJMYGAOPOPFK-NTCAYCPXSA-N 378.519 3.791 10 40 GHCB Cc1cc(/C=C2/SC(=N)NC2=O)c(C)n1-c1ccc(Br)cc1 16268322 RCMSWEPEXRUTTJ-RIYZIHGNSA-N 376.279 3.995 10 40 GHCB CC1=C(C(=O)O[C@@H]2CCC[C@H](C)C2)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1 825853 AMOMSDKTONIICD-IRWQIABSSA-N 387.549 3.667 10 40 GHCB CCOCCCN/C(C)=C1\C(=O)N(c2ccccc2)N=C1c1ccc(OC)cc1 112123375 ISYRVRFPQMEHHE-FXBPSFAMSA-N 393.487 3.736 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 408807775 OREOSHRTINICOS-LFIBNONCSA-N 384.819 3.795 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NC1CCCCC1 12273933 HYHJTFLHHIWMKX-DESBJYGPSA-N 386.542 3.893 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C/C=C/c1ccco1 5372793 MLBTUOLAWPFVDS-OBQYLLBLSA-N 383.448 3.767 10 40 GHCB O=C(O)CCCCCN1C(=O)/C(=C\c2cc(Cl)ccc2O)SC1=S 2798633 OVTJEZNVVSKFIN-UKTHLTGXSA-N 385.894 3.892 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(C3CCCCC3)C(C)=C2C(=O)OC)c1O 6964906 GUNNQYAFUGFREF-LGMDPLHJSA-N 385.460 3.796 10 40 GHCB CC1=NN(C(=O)c2ccncc2)C(=O)[C@@H]1/N=N\c1ccc(-c2ccc(N)cc2)cc1 104204171 PVPHEEWBXNVLGB-ZELGORGJSA-N 398.426 3.842 10 40 GHCB Cc1ccccc1NS(=O)(=O)c1cccc2c1C(=O)c1ccccc1C2=O 4289694 QAPXKTJOMDCGOK-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB COc1ccc(C)cc1-n1c(C)cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c1C 5489717 QMGRWTJHIWITIZ-AZCZGVSUSA-N 393.472 3.660 10 40 GHCB Cc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3ccccc3O)C2=O)cc1 16739212 DUKKKAKUOKSVGI-YBEGLDIGSA-N 384.482 3.541 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)NC[C@H]1CCCO1 8748262 GOVCROOZZHJTHG-QGZVFWFLSA-N 397.500 3.579 10 40 GHCB Cc1cc(N2CCCC2)ccc1/C=C1\NC(=O)N(Cc2ccccc2F)C1=O 4688442 PFWRMVZDGLBIMO-MOSHPQCFSA-N 379.435 3.827 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(F)c(Oc2ccccc2)c1 6890057 IFGBRKMCNWAROM-AQTBWJFISA-N 384.432 3.921 10 40 GHCB C[C@@H](NC(=O)c1ccc2c(c1)ncn2C1CC1)c1ccc(N2CCOCC2)cc1 19714334 KGXHVNQPZCWKHL-MRXNPFEDSA-N 390.487 3.699 10 40 GHCB COc1ccc([C@@H](c2cc(Cl)c3cccnc3c2O)N2CCN(C)CC2)cc1 19898713 YNMYELPINOSQOE-NRFANRHFSA-N 397.906 3.939 10 40 GHCB Cc1ccc(C)c(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)NC2=S)c1 409225809 LKXVYIWDISENNB-MHWRWJLKSA-N 375.453 3.616 10 40 GHCB O=C(O)c1cc(C(=O)O)cc(N2C(=O)/C(=C/c3cccs3)SC2=S)c1 35643809 OWZXZIAQTFKZCY-GHXNOFRVSA-N 391.451 3.550 10 40 GHCB COc1ccc([C@@H]2CC(c3c(C)cc4oc(=O)cc(C)c4c3O)=NN2)c(OC)c1 12390576 RYWHQQNPZUYHIE-HNNXBMFYSA-N 394.427 3.571 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)CCc3ccccc3)N3CCCC3)ccc21 8963303 FJAHARSEJTZAPY-HSZRJFAPSA-N 377.532 3.565 10 40 GHCB COc1cccc(NC(=O)COC(=O)c2cc(C)n(-c3ccccc3)c2C)c1 6830924 RWMHFWNKBOHLOD-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB CCCCOc1ccc(/C=C2\SC(=S)N([C@@H](C)C(=O)OC)C2=O)cc1 27563099 LXAZIVQNFBMEHX-CMHHUMAZSA-N 379.503 3.628 10 40 GHCB CC(C)Oc1ccccc1/C=C1/C(=O)N(c2ccc3c(c2)OCO3)C(=O)N=C1O 59104732 KOYSUCAYWDDINU-OQLLNIDSSA-N 394.383 3.709 10 40 GHCB CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)c3ccc(C)s3)CC2)c1O 72312063 INXGEHUOSIKOFP-UHFFFAOYSA-N 392.908 3.576 10 40 GHCB COc1ccc(Nc2nnc(SCC(=O)c3ccc(O)c(O)c3)s2)cc1 89453740 BIBLMWJIERRLRY-UHFFFAOYSA-N 389.458 3.677 10 40 GHCB CCCN/C(C)=C1\C(=O)N(c2ccc(OC)cc2)N=C1c1ccc(OC)cc1 112120099 DDQYAHOLWUXLEZ-HKWRFOASSA-N 379.460 3.728 10 40 GHCB COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c(C)c1 224561429 FYLDTAYECBQAIK-UHFFFAOYSA-N 388.533 3.781 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccc(Br)c3)C2=O)cc1C 408851002 UEJUGTNBLKVTJB-MHWRWJLKSA-N 399.244 3.732 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc2c(c1)OCO2 408895184 UENJDZNJIFDWSJ-WQRHYEAKSA-N 391.423 3.991 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)NCc1ccco1 924820 XKLMZZVDIGSWTM-GOSISDBHSA-N 397.500 3.731 10 40 GHCB CN(C)c1ccc(/C=C2\NC(=S)N(c3ccc(OC(F)F)cc3)C2=O)cc1 3261567 GNUUTPCKXKIRIN-WJDWOHSUSA-N 389.427 3.616 10 40 GHCB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1ccccc1C(F)(F)F 6634343 FSJKQZVFMHXHOT-MKRLJBPISA-N 395.377 3.557 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1ccc(Cl)cc1 17112603 IMSNCUCJROYWKT-UHFFFAOYSA-N 387.911 3.561 10 40 GHCB COc1ccc(O)c(/C=C2\SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c1 113830586 RMBAAZAUTBVFQX-DHDCSXOGSA-N 388.426 3.715 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(-c3ccc(F)cc3)o2)SC1=S 5423535 VFWZCEBSMLJBQZ-MBBDXHFBSA-N 377.418 3.760 10 40 GHCB CC(C)c1noc(-c2ccc(OCC(=O)NCc3ccc(N(C)C)cc3)cc2)n1 32579102 BYKUDJYKYJCMNK-UHFFFAOYSA-N 394.475 3.621 10 40 GHCB CN(C)c1ccc(CNC(=O)Nc2cc(Cl)ccc2N2CCOCC2)cc1 40103422 FXEVXDAGSYXKSY-UHFFFAOYSA-N 388.899 3.564 10 40 GHCB Cc1ccc(N/C=C2/C(=O)NC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 408552412 TUVQPWULOBBXEQ-LCYFTJDESA-N 389.839 3.531 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)c1 1909686 UWFQYCKTRNOFEF-ZSOIEALJSA-N 386.410 3.699 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C/C=C/c2ccco2)SC1=S 4356989 XUMNCGLQAXIZJU-XYLAZCFOSA-N 385.466 3.733 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C\c2csc(-c3ccccc3)n2)SC1=S 7787029 ZUMYYHOVQIUKBY-UKTHLTGXSA-N 390.511 3.876 10 40 GHCB CCc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3cccc(O)c3)C2=O)cc1 16770034 NXTBONLXMTYIKI-YVLHZVERSA-N 398.509 3.795 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)S1 35043540 XJBSOKCNTZKSLN-OVCLIPMQSA-N 383.385 3.684 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C\c3ccccc3F)SC2=S)cc1O 35648685 HOZBMZMCRJRMST-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB N=C1/C(=C/c2cccc3ccccc23)C(=O)N=C2SC(c3ccncc3)=NN12 41074360 JSUWWOYWTBOVAT-SABKFZPKSA-N 383.436 3.902 10 40 GHCB Cc1ccc(NC(=S)NCc2ccc(N3CCN(C)CC3)cc2)cc1Cl 225776192 RWLIXKLFJCPWHM-UHFFFAOYSA-N 388.968 3.887 10 40 GHCB O=C1Nc2ccccc2S[C@H]1[C@@H]1SC(=S)N(Cc2ccccc2)C1=O 1567431 UVLNNIKGDNAHSD-GJZGRUSLSA-N 386.523 3.529 10 40 GHCB CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 12607897 CIZCOHLSRKPOFH-QGZVFWFLSA-N 388.533 3.720 10 40 GHCB N=C1/C(=C/c2cccc3ccccc23)C(=O)N=C2SC(N3CCCC3)=NN12 41084946 DKOMRXVEDBZMEA-PSPCYXPKSA-N 375.457 3.512 10 40 GHCB CC[C@@]12OC(=N)[C@@](C#N)([C@H]1C)C(C#N)(C#N)[C@@H](c1ccc(Br)cc1)O2 5902135 PJDMWSIYHHJOAQ-PDLPPMLWSA-N 399.248 3.814 10 40 GHCB CCN1C(=O)/C(=C\c2ccccc2OCc2ccccc2)C(C(=O)OC)=C1C 408978225 LMVYQWXFHKIRJB-RGEXLXHISA-N 377.440 3.958 10 40 GHCB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C/Nc1nc2ccc(C(=O)O)cc2s1 101124869 PREAFBJMAFZOLV-NTEUORMPSA-N 396.403 3.852 10 40 GHCB COC(=O)CCCCCN1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S 4860761 CFOZMXMGHQGBBF-SDNWHVSQSA-N 394.474 3.529 10 40 GHCB COc1ccccc1-c1c(O)c2ccc(O)c(CN3CCCCC3)c2oc1=O 20650201 OMFRITSCEXDSTE-UHFFFAOYSA-N 381.428 3.866 10 40 GHCB biogenic C[C@@H]1CN(C2=NC(=O)/C(=C/c3cccc(Br)c3)S2)C[C@@H](C)O1 32249587 LLFMTYDCNKDIDJ-QOWMEECXSA-N 381.295 3.529 10 40 GHCB CC(=O)c1ccc(S(=O)(=O)NCc2ccc(-n3c(C)ccc3C)cc2)cc1 40158372 IGIKJNQVALZHEJ-UHFFFAOYSA-N 382.485 3.775 10 40 GHCB Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccccc1O 222741065 JKCUIGXEHSWDIR-UXHICEINSA-N 378.501 3.797 10 40 GHCB CCCCCCOc1ccc(/C=C2/SC(NC(C)=O)=NC2=O)cc1OC 408539291 GNKLBUIYTJIFTG-SFQUDFHCSA-N 376.478 3.761 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OCc4ccccc4F)cc3)C(=N)N2O1 41078320 AXPPEMALYMSASD-DJCXZETLSA-N 377.375 3.855 10 40 GHCB O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C\c1cc(Cl)cc(Cl)c1O 5569764 MNKZNRNUAJMKEY-SDQBBNPISA-N 383.618 3.814 10 40 GHCB COc1cccc(NC(=O)CN2C(=O)/C(=C\c3cccs3)SC2=S)c1 6094106 JTKCTCRTOBRQEE-NTEUORMPSA-N 390.511 3.597 10 40 GHCB CCN1C(=O)C(=CNc2ccc(Nc3ccccc3)cc2)C(=O)N(CC)C1=S 6910866 KKWKNXWYQOYGCN-UHFFFAOYSA-N 394.500 3.722 10 40 GHCB O=C1/C(=C/c2cc3ccccc3[nH]c2=O)SC(=S)N1Cc1ccccc1 8575240 CPQAHEHIMGNFIP-BOPFTXTBSA-N 378.478 3.930 10 40 GHCB O=C1c2ccccc2N[C@@H](c2cccc(O)c2O)N1c1ccc2c(c1)OCCO2 8774431 AYRBMCZQABJOEM-OAQYLSRUSA-N 390.395 3.640 10 40 GHCB CC(=C\c1ccccc1)/C=C1/SC(=S)N(CC(=O)Nc2ccccn2)C1=O 16711602 TVGVNRGGWHBBPF-MHMBTURYSA-N 395.509 3.868 10 40 GHCB COc1ccc(N2CCN([C@H](CNC(=O)CC(C)(C)C)c3ccco3)CC2)cc1 56946205 SKQRIYBIESAZHQ-HXUWFJFHSA-N 399.535 3.704 10 40 GHCB CC(C)Cn1cc(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)c2ccccc21 409204053 CEVAONHVBIILIT-WQRHYEAKSA-N 379.460 3.702 10 40 GHCB Cc1cccc(C)c1-n1c(C)cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c1C 2417890 UTNSYQYAPCXLQF-NRKWFKHNSA-N 377.473 3.960 10 40 GHCB COc1ccc([C@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)cc1 12296967 PVHLEDPJIDIXJJ-MRXNPFEDSA-N 378.428 3.871 10 40 GHCB biogenic COc1cc(N2CCCC2)c(OC)cc1/C=C1/SC(=O)N(C(C)C)C1=O 15013237 QCCOXUGMJVOMNQ-LICLKQGHSA-N 376.478 3.749 10 40 GHCB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(O)c(O)c2)c2c(C)n[nH]c2N1 72332688 HTTCYNACRGLMIY-IBGZPJMESA-N 376.416 3.599 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)/C(=C\c2ccc(N(C)C)cc2)C(=O)NC1=S 409108220 SJXNMDAZKMPFOS-PTNGSMBKSA-N 399.903 3.546 10 40 GHCB COCCN(CC(=O)N1c2ccccc2CC[C@H]1C)c1ccc(OC)c(OC)c1 78969918 XPGASGNTIACYOW-QGZVFWFLSA-N 398.503 3.525 10 40 GHCB CCN1C(=O)N=C(O)/C(=C\c2ccc(-c3ccc(Cl)c(C(=O)O)c3)o2)C1=O 20518165 GSRLQQSKHXKQQT-XYOKQWHBSA-N 388.763 3.620 10 40 GHCB CCN(CC)c1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3)C2=O)cc1 408741088 KCHVISPKCFIOIM-XMHGGMMESA-N 393.512 3.673 10 40 GHCB Oc1cc(C2CCN(Cc3cc(Cl)ccc3O)CC2)nc(-c2ccccn2)n1 72392843 ZOZNNZKJYUJZLQ-UHFFFAOYSA-N 396.878 3.983 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)cc1 13603236 IAPKMUYRQWMAFB-LGMDPLHJSA-N 398.509 3.925 10 40 GHCB C[C@@H](NC(=O)c1cc(-c2ccc(F)cc2)no1)c1ccc(N2CCOCC2)cc1 19659398 OMZBZVNBQPXEII-OAHLLOKOSA-N 395.434 3.808 10 40 GHCB C[C@H]1CCCC[C@@]12NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 23653293 UQEQEIIUUFHENS-FDDCHVKYSA-N 398.551 3.567 10 40 GHCB O=C(NC1(NC2CCCCC2)C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1 226297991 HUKGSKOTZVYLPD-UHFFFAOYSA-N 396.874 3.768 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(C)c3C)C2=O)cc1 664577 WGKGBVCPRDPGJV-SFQUDFHCSA-N 380.469 3.533 10 40 GHCB CC(=O)N1CCN(C(=S)c2ccc(-c3ccc(Br)cc3)o2)CC1 1307088 ZMRBDOONPJUPJT-UHFFFAOYSA-N 393.306 3.549 10 40 GHCB CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)OC(=O)c3cc(N)ccc32)cc1 4253416 JJTXQNPQIWNFFS-UHFFFAOYSA-N 387.483 3.863 10 40 GHCB COc1ccc(-c2ccc(/C=C3\SC(=S)N(C)C3=O)o2)c([N+](=O)[O-])c1 5025798 JWRCRNHEYCKLGB-ZSOIEALJSA-N 376.415 3.694 10 40 GHCB CC[C@H](C(=O)O)N1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 5374211 KRLJBJDTZMANLB-PAKSIRSJSA-N 386.292 3.514 10 40 GHCB COc1ccc([C@@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)cc1O 12297005 ZCOWMEDZXJULJW-AWEZNQCLSA-N 394.427 3.577 10 40 GHCB biogenic COc1ccc(-n2cccc2/C=C2/C(=N)N3N=C(C)SC3=NC2=O)cc1Cl 13280874 HGGKEFIEODVKNA-TUQWILOLSA-N 399.863 3.778 10 40 GHCB O=C1Nc2ccc(Br)cc2/C1=C/c1ccc(N2CCOCC2)cc1 13780175 VBZGAESQTIHMPD-BOPFTXTBSA-N 385.261 3.778 10 40 GHCB CCc1ccc(N/C(C)=C2\C(=O)N(c3ccccc3)N=C2CC(=O)OC)cc1 17077198 JKFDZWGPGFMELC-QNGOZBTKSA-N 377.444 3.901 10 40 GHCB CCOC(=O)c1ccc(N2C(=O)/C(=C\c3cccs3)C(C(=O)OC)=C2C)cc1 4699094 KRICUMJTUDZGOW-ATVHPVEESA-N 397.452 3.802 10 40 GHCB Cc1cc(C(=O)CSc2ncnc3c2cnn3C)c(C)n1-c1ccccc1 11495011 PJIGNXHZHOXINB-UHFFFAOYSA-N 377.473 3.746 10 40 GHCB COc1ccc(/C=C2\SC(N3CCc4ccccc4C3)=NC2=O)c(OC)c1 13513393 CCMQXMYXNOWKBX-ODLFYWEKSA-N 380.469 3.732 10 40 GHCB CCOc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c1C 20462077 FVADFTDCXSPASK-HWCWCTJWSA-N 393.472 3.742 10 40 GHCB Cc1sc2nc3n(c(=O)c2c1C)CC/C3=C\c1ccc(N2CCOCC2)cc1 96759104 FIUJDXAYYGPHDX-GHRIWEEISA-N 393.512 3.856 10 40 GHCB COc1ccc(N2CCN(C(=O)c3ccc(C)c(Cl)c3)CC2)c([N+](=O)[O-])c1 4125180 MBBRKYLWEUQXCX-UHFFFAOYSA-N 389.839 3.528 10 40 GHCB CC(C)c1ccc(C(=O)Nc2cccc(N3CCN(CCN(C)C)CC3)c2)cc1 48374657 BLXSNWZKEXUQEE-UHFFFAOYSA-N 394.563 3.746 10 40 GHCB CN(C)c1ccc(N/C=C2/C(=O)N=C(S)N(CCC3=CCCCC3)C2=O)cc1 103116610 PAYNRMATCDSZPY-JXAWBTAJSA-N 398.532 3.594 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1Cl 408787040 ZZOHDWXJMFXKGP-LFIBNONCSA-N 398.846 3.968 10 40 GHCB Cc1ccc(O)c(CN2CCC[C@]3(CC2)CN(c2cccc(F)c2)C(=O)CO3)c1 2037977797 KBTYYVRDAMOJTM-QHCPKHFHSA-N 398.478 3.628 10 40 GHCB Cc1cc(C)cc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)O)C3=O)c2C)c1 409134134 MWFZKJHZEDWADI-RQZCQDPDSA-N 384.457 3.832 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)COc2ccc(Cl)cc2C)c1 20528512 DXBMXPZUFHDWLI-UHFFFAOYSA-N 390.867 3.511 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1 408902047 DXHWWRDDKFYTFU-NTEUORMPSA-N 378.281 3.511 10 40 GHCB c1csc([C@H](CNCc2ccc(N3CCCCC3)cc2)N2CCOCC2)c1 22921970 MDMXZZQQWKNKCU-NRFANRHFSA-N 385.577 3.902 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccccc1C(=O)O 409001256 OQUFGQRJJHROON-AQTBWJFISA-N 377.396 3.652 10 40 GHCB COc1ccc2cc(C(=O)NCc3ccc4c(c3)CCCN4C)c(C)nc2c1 60456964 BRZXLEDFIJIUEH-UHFFFAOYSA-N 375.472 3.864 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)NCc1ccc(Cl)cc1 17081392 ZRCHHAYKBNIJKY-ZHZULCJRSA-N 397.862 3.670 10 40 GHCB COc1cccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc3c(c2)OCO3)c1O 7885032 DIFIAROMYGVNSN-OAQYLSRUSA-N 390.395 3.901 10 40 GHCB Cc1ccccc1N1C[C@](O)(c2ccc(OC(F)F)cc2)[N+]2=C1SCCC2 2966077 PRWYSFWWHSEJLL-FQEVSTJZSA-N 391.463 3.767 10 40 GHCB CCOc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCC2)cc1 8963337 MJTLFZRECXEZBN-QHCPKHFHSA-N 393.531 3.645 10 40 GHCB CCN(CC)c1ccc(CNC(=O)c2ccc(CN3CCCC3=O)cc2)cc1 193746070 YNNCZUNLBLNXID-UHFFFAOYSA-N 379.504 3.585 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3ccccc3O)C(C(=O)OC)=C2C)cc1 4976558 CSFMSSHHMXGVMR-AQTBWJFISA-N 379.412 3.668 10 40 GHCB O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(Br)cc1 5671161 OZTRYSPPKYVFKP-ZSOIEALJSA-N 377.625 3.564 10 40 GHCB CCCOc1cc(/C=C2/SC(=S)N(CCCOC)C2=O)ccc1OC 96930821 WNINBCIBZNIPFH-FOWTUZBSSA-N 381.519 3.722 10 40 GHCB COCCCN[C@@H](CC(=O)Nc1ccc(/N=N\c2ccccc2)cc1)C(=O)O 101090834 PRTGFJCXPROHHV-XZSMOWGESA-N 384.436 3.510 10 40 GHCB Cc1cc(F)ccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C)C2)cc1 225598700 GVATYJCAXSFPKL-OAHLLOKOSA-N 376.497 3.849 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(N(C)C)cc1 408770452 XRLDQVLTITVGFK-ZHZULCJRSA-N 376.456 3.938 10 40 GHCB Cc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCCC2)cc1 13007805 XLRVLIUJGFVNST-QHCPKHFHSA-N 377.532 3.944 10 40 GHCB CCN(CC)c1ccc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1 13582300 JBHXGRMFFHZGFB-BQGMYUGNSA-N 376.547 3.913 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)cc1 13943000 BAPAVFIAXYOZLS-CXZDZRJTSA-N 395.410 3.714 10 40 GHCB CCN(CC)c1ccc(C=c2sc3nc(-c4cccc(C)c4)nn3c2=O)cc1 254440122 AXISJOJGEOZMJE-UHFFFAOYSA-N 390.512 3.520 10 40 GHCB CC[C@@H](C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 390770385 IUZBIAPAMJMEKV-SPLOXXLWSA-N 377.444 3.810 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCCCCC1 4976587 JLHYZVGJCMYRJC-OWBHPGMISA-N 380.560 3.742 10 40 GHCB CCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 6747940 FZGVMXGBCYZWDS-QFIPXVFZSA-N 382.504 3.973 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3cccc(Cl)c3)N3CCCC3)ccc21 8963334 XXUWZXZSPUJVGT-NRFANRHFSA-N 383.923 3.899 10 40 GHCB COc1ccc(N2CCN(CC(=O)NC3CCC(C(C)(C)C)CC3)CC2)cc1 13323406 KDPAVGUKLLZHDO-UHFFFAOYSA-N 387.568 3.538 10 40 GHCB Oc1ccc2ccccc2c1CN1CCc2c(O)nc(-c3cccnc3)nc2C1 19376305 UOWTYSZBKPIDAC-UHFFFAOYSA-N 384.439 3.661 10 40 GHCB COc1ccc(N2CCN([C@@H](CC(C)C)c3nnnn3C3CCCC3)CC2)cc1 57669633 OYPPFTULZQIQBQ-NRFANRHFSA-N 398.555 3.706 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)cc1 409249739 VLWBRWAQTGAKFN-LDADJPATSA-N 380.469 3.650 10 40 GHCB COc1ccccc1COC[C@@H](O)CN(Cc1ccco1)Cc1ccccc1O 3394639 AKZURUOWLYNVIC-FQEVSTJZSA-N 397.471 3.574 10 40 GHCB COc1ccc(NC(=O)COC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1 6831054 ATMKCWRUUYGEPH-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB Cc1ccccc1Cn1cccc1/C=C1/C(=O)N(Cc2ccco2)C(=O)N=C1O 8770259 LIZGTYWOOGITSX-XDHOZWIPSA-N 389.411 3.940 10 40 GHCB Cn1cc(/C=C2\SC(Nc3ccc(C(=O)O)cc3)=NC2=O)c2ccccc21 16936531 VNVXGVRIPIUILP-YVLHZVERSA-N 377.425 3.959 10 40 GHCB COc1ccccc1NC1=NC(=O)/C(=C/c2ccc(OC(C)=O)c(OC)c2)S1 34828004 RDJIZZCUXLXGCO-WQRHYEAKSA-N 398.440 3.712 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(Br)c3)C2=O)cc1 408983181 FWZOVLFXYVQKEV-WJDWOHSUSA-N 399.244 3.678 10 40 GHCB CCN(CC)c1ccc(/C=C2\SC(NC(=O)c3ccccc3)=NC2=O)cc1 409130610 WTONLJLMCHXNQF-JXAWBTAJSA-N 379.485 3.933 10 40 GHCB Cc1c(Cc2ccccc2)sc(NS(=O)(=O)c2ccccc2)c1C(N)=O 1088060 BVCZYMYIMDOSME-UHFFFAOYSA-N 386.498 3.547 10 40 GHCB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)Nc1ccc(Cn2cncn2)cc1 100422621 MBPVUZUUZUVINT-ZHZULCJRSA-N 390.422 3.574 10 40 GHCB Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1ccccc1O 222741115 JKCUIGXEHSWDIR-VQTJNVASSA-N 378.501 3.797 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/c3c(C)n(C)c4ccccc34)C2=O)c1C 408850317 LFBKWFLJMODNTA-PDGQHHTCSA-N 387.439 3.770 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccccn1 661765 SBAPFYCAOJYFDI-XDHOZWIPSA-N 390.418 3.721 10 40 GHCB aggregator CN1CCc2cc([C@@H](CNC(=O)c3c(F)cccc3F)N3CCCC3)ccc21 8963237 BBIMNCFVDBVUBG-HXUWFJFHSA-N 385.458 3.524 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 260795957 NIWUQLOTIJNECK-KBPBESRZSA-N 377.510 3.567 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c1 408873648 ULCPCFGXOVSOCK-RQZCQDPDSA-N 384.819 3.632 10 40 GHCB COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2C)C1=O 409066641 PEBLTKRSHQOABW-RFRKOGIWSA-N 388.489 3.583 10 40 GHCB CN(C)c1ccc([C@H]2CC(c3ccc(Cl)cc3)=NN2C(=O)CCC(=O)O)cc1 4834602 QEXXSDPLTRYSMZ-LJQANCHMSA-N 399.878 3.949 10 40 GHCB Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)on1 7226755 UPXZVLBGWIYGOJ-UHFFFAOYSA-N 378.428 3.919 10 40 GHCB COc1ccc(N2CCN(C(=O)CCc3nc4ccccc4s3)CC2)cc1 8029073 WTHZZSRENFKVBG-UHFFFAOYSA-N 381.501 3.586 10 40 GHCB CNC(=O)Cc1nc(CN(Cc2ccccc2O)[C@H](C)c2ccccc2)cs1 95451559 PWKLVEPACOWFLY-MRXNPFEDSA-N 395.528 3.901 10 40 GHCB CC[C@@H](Oc1cccc(C)c1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 20450411 XLTZWCAYQOYRAC-OAQYLSRUSA-N 382.504 3.818 10 40 GHCB O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C/c1cn(C2CCC2)nn1 585091636 BUCABJLVOIOUPV-FLIBITNWSA-N 387.365 3.676 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cn(CC)c4ccccc34)C2=O)cc1 4703289 WACFLZKAXHGLRZ-UYRXBGFRSA-N 387.439 3.890 10 40 GHCB COc1ccccc1[C@@H]1CC(c2c(C)cc3oc(=O)c4c(c3c2O)CCC4)=NN1 12391696 YCRHEGJJXXKDCE-INIZCTEOSA-N 390.439 3.743 10 40 GHCB CCOc1ccccc1/C=C1\SC(=S)N(CCCCCC(=O)O)C1=O 13343103 PQYWGMWQZITRDB-QINSGFPZSA-N 379.503 3.932 10 40 GHCB CC1=NN(c2cccc(Br)c2)C(=O)/C1=C\c1ccc2c(c1)OCO2 13603113 GPEGFFXILIQUNQ-CHHVJCJISA-N 385.217 3.984 10 40 GHCB O=C1/C(=C\c2ccc3nccnc3c2)SC(=S)N1c1ccc2c(c1)OCO2 13721019 AQYZEJXUKWVVON-CAOOACKPSA-N 393.449 3.764 10 40 GHCB O=C(Cc1c(F)cccc1Cl)NCc1ccc(N2CCSCC2)cc1 54035666 CUFOZFAKEJNUEW-UHFFFAOYSA-N 378.900 3.891 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)cc1 408805494 KSPYHSOVFSERHX-QGOAFFKASA-N 378.428 3.703 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(CNc3ccc(OC)cc3)C2=O)cc1 3044318 MTIJBWJDCMVRCE-GZTJUZNOSA-N 386.498 3.975 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C/c3cccn3-c3ccccc3)C2=O)c1C 4704525 ONAFEDPJKXTTEF-RGEXLXHISA-N 385.423 3.761 10 40 GHCB CN(C)c1ccc(/C=C/C=C2/SC(=O)N(CC(=O)OC(C)(C)C)C2=O)cc1 4933341 FNBDSJGBLIZHAM-QICXOPSUSA-N 388.489 3.687 10 40 GHCB Cc1ccc(-c2ccc(/C=C3/C(=O)NN(c4ccccc4)C3=O)o2)c([N+](=O)[O-])c1 33320005 JEOSHHADGPASFG-ATVHPVEESA-N 389.367 3.625 10 40 GHCB O=C(C1=CN(c2ccc(F)cc2)c2ccccc2S1(=O)=O)N1CCCCC1 48988476 PCSLINHTXHKMFW-UHFFFAOYSA-N 386.448 3.605 10 40 GHCB CCOc1ccc(OCC)c(N2C(=O)N=C(O)/C(=C\c3ccccc3O)C2=O)c1 59104676 OSOCPILNFJDECC-RVDMUPIBSA-N 396.399 3.696 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)Nc3ccccc3OC)n2C)cc1 881673 KVFVDOWDRCZOGV-UHFFFAOYSA-N 383.473 3.835 10 40 GHCB Cc1ccc(COc2cccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)c2)cc1 1455452 KGYHXMBWRQTXRK-YVLHZVERSA-N 399.493 3.860 10 40 GHCB COc1ccc(NC(=O)CN2C(=O)/C(=C\c3cccs3)SC2=S)cc1 6090641 VLRIJDBCKNRQRX-NTEUORMPSA-N 390.511 3.597 10 40 GHCB COc1ccc(C(=O)O)cc1NC1(c2ccccc2)C(=O)c2ccccc2C1=O 6901859 LDCPJTULYVPPRH-UHFFFAOYSA-N 387.391 3.780 10 40 GHCB Cc1cnc(-c2nc(C3CCN(Cc4cc(Cl)ccc4O)CC3)no2)cn1 12187344 YTKCVEGVKWUMES-UHFFFAOYSA-N 385.855 3.574 10 40 GHCB COc1cc2c(cc1NCC(=O)Nc1ccc(C(N)=O)cc1)oc1ccccc12 12563606 LNABRWPAUGOVDM-UHFFFAOYSA-N 389.411 3.744 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)Cc1cc2c(cc1OCCOC)OCO2 95453784 MDYSCIGSFSUFHF-UHFFFAOYSA-N 386.492 3.529 10 40 GHCB Oc1c([C@H](c2ccccn2)N2CCN(c3ccccn3)CC2)ccc2cccnc12 4247747 OZSANKKZTCLFJI-HSZRJFAPSA-N 397.482 3.642 10 40 GHCB O=C1/C(=C\c2ccc(-c3ccc(F)cc3)o2)SC(=S)N1N1CCOCC1 5032677 YITIJECGQUTUBP-LFIBNONCSA-N 390.461 3.534 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)O)sc2c1CCC2 5408483 FELSALOMWGPMNN-ZIAGYGMSSA-N 391.489 3.799 10 40 GHCB Cc1cc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)c(C)n1-c1ccc(Cl)cc1 9234961 NPEZYQNEEXKUKJ-FPYGCLRLSA-N 386.795 3.615 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(Br)c1 10906875 LXLHMMDMJHGRIO-UHFFFAOYSA-N 389.293 3.558 10 40 GHCB COc1ccc(N2CCN([C@H](CC(C)C)c3nnnn3C3CCCC3)CC2)cc1 57669636 OYPPFTULZQIQBQ-OAQYLSRUSA-N 398.555 3.706 10 40 GHCB CN(C)c1ccc(CN2CCOC[C@H]2c2nc(-c3ccc(F)cc3)c[nH]2)cc1 67898754 KRPCVRBKZGVKHJ-NRFANRHFSA-N 380.467 3.855 10 40 GHCB biogenic,in-vitro CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2c(O)ccc3ccccc23)C1=O 408888352 UPXPUFCNTVGVPI-AQTBWJFISA-N 386.407 3.774 10 40 GHCB CC[C@@H](C)N1C(=O)/C(=C\c2ccc(Br)cc2)C(C(=O)OC)=C1C 409017085 WJVRUNRQKSKSTH-MKVLZVNKSA-N 378.266 3.920 10 40 GHCB CCC(=O)Nc1cccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 79048937 GXOHOLJHXRKXNU-UHFFFAOYSA-N 385.427 3.997 10 40 GHCB Cc1cccc(C)c1-n1c(C)cc(/C=C2/SC(=O)N(CC(=O)O)C2=O)c1C 409129708 SCYVVGPSPBABNA-CXUHLZMHSA-N 384.457 3.832 10 40 GHCB CCOc1ccc([C@]2(O)CN(c3ccc(CC)cc3)C3=[N+]2CCCS3)cc1 2684575 ODWLICCSAWDURZ-JOCHJYFZSA-N 383.537 3.818 10 40 GHCB CC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3ccc(C)cc3)cs2)cc1 7990570 DZLQIXMVDVWVMU-UHFFFAOYSA-N 387.486 3.878 10 40 GHCB Cc1oc2c(c1C(=O)NCCc1c[nH]c3ccccc13)C(=O)c1ccccc1C2=O 2700673 VYEDGJVGZUPPAN-UHFFFAOYSA-N 398.418 3.817 10 40 GHCB Cc1c(Cc2ccccc2)c(=O)oc2c(C)c(O)c(CNC[C@H]3CCCO3)cc12 6719732 DZHBDCLKZYKEAM-LJQANCHMSA-N 393.483 3.975 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(F)c(Oc3ccccc3)c2)SC1=S 9310623 STARRZHAQIKULS-OQLLNIDSSA-N 389.429 3.904 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCCCn2c(=O)[nH]c3ccccc32)cc1 15152115 ZDWMRBFEODSIKQ-UHFFFAOYSA-N 389.455 3.984 10 40 GHCB CN(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 53914735 DAXPWKHWTNCFGD-KRWDZBQOSA-N 386.879 3.556 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cn[nH]c3-c3ccc(Cl)cc3)CC2)cc1 54446826 RYGCZUMDGFLGEE-UHFFFAOYSA-N 396.878 3.701 10 40 GHCB COc1ccc(-n2c(C)ccc2[C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)cc1 222764273 POOOHSAKXBDATK-WOJBJXKFSA-N 378.501 3.792 10 40 GHCB CCCCCCc1c(C)nc(N2CCN(c3ccc(OC)cc3)CC2)[nH]c1=O 14608483 CTQDHKJBBFLASA-UHFFFAOYSA-N 384.524 3.536 10 40 GHCB COc1c(C(C)C)c(O)c(O)c2c1[C@H](OC)[C@H]1OC(=O)[C@@]23CCCC(C)(C)[C@H]13 67912650 DHNUPRDARUHAJK-WEMPKCCASA-N 390.476 3.920 10 40 GHCB endogenous,in-man CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1ccccc1C(=O)O 409046915 LKLLUCMMSBNNKP-POHAHGRESA-N 396.271 3.886 10 40 GHCB Cc1cccc(C(=O)N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1 5364241 ZIUIPCBWSMWZAY-CXUHLZMHSA-N 383.450 3.765 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cccc(Br)c3)C2=O)c1 408782207 FYHWYROXCBXECG-MHWRWJLKSA-N 399.244 3.732 10 40 GHCB Cc1[nH]c2ccccc2c1/C=C1/C(=N)N2N=C(c3cccnc3)SC2=NC1=O 49672413 VAHKOPJUHFIHQE-ATNGQLTKSA-N 386.440 3.539 10 40 GHCB O=C1C[C@H](c2ccco2)c2c(c(O)c(O)c3c(=O)cc(-c4ccccc4)oc23)O1 96115436 OYYMXKIAVDZMDR-GFCCVEGCSA-N 390.347 3.905 10 40 GHCB biogenic Cc1ccc(O)c(CNC(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)c1 1215657766 UMGGWYQNEXPXNU-UHFFFAOYSA-N 391.427 3.914 10 40 GHCB Cc1ccc(O)c(CN2CCC[C@@]3(CC2)CN(c2ccc(F)cc2)C(=O)CO3)c1 2037977787 HUOYDJAXEFXSOD-HSZRJFAPSA-N 398.478 3.628 10 40 GHCB O=C(O)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1F)N2 4623740 RLKOYHOLVHMMLV-LRAJWGHMSA-N 398.409 3.996 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)CN(C)CC(=O)NC(C)(C)C)c2C)cc1F 26885416 YDDMZGDYSOQPTQ-UHFFFAOYSA-N 387.499 3.571 10 40 GHCB Cn1c(=O)c(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc2ccccc21 36625749 BQJFYUGPRYJFOX-PDGQHHTCSA-N 392.505 3.940 10 40 GHCB COc1cc(/C=C2\SC(=S)NC2=O)cc(Br)c1OC(C)C 40942104 UYBIFHBFPIQJRW-WDZFZDKYSA-N 388.308 3.734 10 40 GHCB Cc1ccc(C)n1-c1ccsc1C(=O)NCc1ccccc1N1CCOCC1 65881662 VDCXMGWLENMSIH-UHFFFAOYSA-N 395.528 3.922 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1cccc(OC)c1O 408893954 OWIXTLFLGHBEDF-PDGQHHTCSA-N 393.439 3.895 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(N3CCCC3)cc2)C1=O 408960646 NKWPOQPIJLPZBQ-XDJHFCHBSA-N 389.455 3.516 10 40 GHCB CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NCc2ccccc2)cc1 820347 GUSYMMLBLSXYLY-HAVVHWLPSA-N 399.494 3.840 10 40 GHCB Cc1ccc2c(c1NS(=O)(=O)c1ccccc1)C(=O)c1ccccc1C2=O 3847599 GQTDYNWMKUROOG-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB biogenic COc1cc(Br)cc([C@H]2Nc3ccccc3C(=O)N2C2CC2)c1O 7886341 TYSDTEMBWOVZTR-KRWDZBQOSA-N 389.249 3.892 10 40 GHCB O=C(COc1ccc(Nc2ccccc2)cc1)NCc1cc([N+](=O)[O-])ccc1O 34852213 IXVRWBKWQDERNA-UHFFFAOYSA-N 393.399 3.739 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3cnc4ccccc4n3)SC2=S)c1 54361182 SXQXLLCDVMUPMB-SXGWCWSVSA-N 393.449 3.734 10 40 GHCB COc1cccc(NC(=S)/C=C2\NCCc3cc4c(cc32)OCCCO4)c1 101377005 OQOOSSCWBHERJP-AQTBWJFISA-N 382.485 3.783 10 40 GHCB O=C1/C(=C2\C(O)=Nc3ccc([N+](=O)[O-])cc32)SC(=S)N1Cc1ccccc1 17179996 CWJRFUMWQDBGOL-CCEZHUSRSA-N 397.437 3.968 10 40 GHCB N=C1/C(=C/c2c(F)cccc2Cl)C(=O)N=C2SC(c3cccnc3)=NN12 41074335 FIILKGACMCCCIE-ABVCEMAWSA-N 385.811 3.542 10 40 GHCB Oc1ccc2c(-c3ccccc3)noc2c1CN1CCN(c2ccccn2)CC1 41585927 LTCHAVMLPPEEAW-UHFFFAOYSA-N 386.455 3.918 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3cccc(C)c3)C(C)=C2C(=O)OC)c1O 408589072 YIJMADSOYVFDKZ-AQTBWJFISA-N 393.439 3.977 10 40 GHCB CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C1/C(=O)Nc2ccccc21 409033501 LXQFCSXMTAYQCK-MDZDMXLPSA-N 393.271 3.511 10 40 GHCB O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2C[C@@H](O)c1ccc(O)cc1 604405319 YWYXDQRYRAQORH-HXUWFJFHSA-N 383.403 3.652 10 40 GHCB biogenic O=C([C@H]1CCCN(Cc2cc(Br)ccc2O)C1)N1CCCCCC1 1246108 KGTFRLMZACQVPP-HNNXBMFYSA-N 395.341 3.769 10 40 GHCB CCSC1=NSC2=NC(=O)/C(=C\c3cccn3-c3ccccc3)C(=N)N12 20211055 IXFVDTWGPBGAAG-JCOXHHPGSA-N 381.486 3.807 10 40 GHCB CCCC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCC(=O)O)c(OC)c1 9434452 VWDMVDVQNSTJMS-ATVHPVEESA-N 394.427 3.745 10 40 GHCB CC1CCN(CC(=O)N2N=C(c3cccs3)C[C@H]2c2ccccc2O)CC1 7814778 ZVTYGQPQDWOICF-SFHVURJKSA-N 383.517 3.863 10 40 GHCB O=C(CN1C(=O)S/C(=C/c2ccccc2)C1=S)Nc1ccccc1C(=O)O 1236282 YIPOKUSRVRTCSA-XNTDXEJSSA-N 398.465 3.861 10 40 GHCB Cc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 6747933 YBFCQKFAKITKIY-JOCHJYFZSA-N 382.504 3.648 10 40 GHCB COc1cc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)ccc1O 13685234 QCEMVOFCBJNZBB-APSNUPSMSA-N 387.438 3.535 10 40 GHCB Cc1ccc(NC(=O)c2c(C)oc3ccc(O)c(CN4CCOCC4)c23)cc1 19794006 OJGIPEYIYDWOGZ-UHFFFAOYSA-N 380.444 3.840 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)CN1C(=O)CC2(CCCCC2)C1=O 22358776 AENBWZPRUAATFF-UHFFFAOYSA-N 383.536 3.776 10 40 GHCB Cc1cc(/C=C2/C(=N)N3N=CSC3=NC2=O)c(C)n1-c1cccc(Cl)c1 33367603 HVRBTWWJGBRCAZ-ZFWHUMDSSA-N 383.864 3.997 10 40 GHCB Cc1cccc(NC(=O)CN2C(=O)N/C(=C/c3cc(C)n(C(C)C)c3C)C2=O)c1 13116681 ARGLRXKUMZJZEZ-YBFXNURJSA-N 394.475 3.526 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C/c2cc(Br)cs2)SC1=S 40161153 ZQBJNZJSNKIQGM-UITAMQMPSA-N 392.321 3.577 10 40 GHCB Cc1cccnc1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c1C 222748197 ZNBWVQXOQHQVLX-RBUKOAKNSA-N 377.517 3.795 10 40 GHCB CCN(CCCNC(=S)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(C)cc1 225735025 FTGNRJWFYHNBSI-UHFFFAOYSA-N 398.576 3.900 10 40 GHCB COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)cc1F 260572559 CEYQYMZLRHPKRE-HNNXBMFYSA-N 392.496 3.549 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c1 408867045 JAIQXDAPFGJOFI-VIZOYTHASA-N 391.210 3.668 10 40 GHCB Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)o1 27831247 RCEHNRFSZCAYTL-LDADJPATSA-N 389.367 3.625 10 40 GHCB Cc1cc(C)cc(N2C(=O)/C(=C/C=C/c3ccc(N(C)C)cc3)C(=O)N=C2O)c1 5025987 AOXQMDNIXINZBX-RGQKVHTQSA-N 389.455 3.796 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 16400273 LTXCGZGDSCCXTK-ZROIWOOFSA-N 387.398 3.909 10 40 GHCB Cc1cc2oc(=O)cc(C)c2c(O)c1C1=NN[C@H](c2ccc(N(C)C)cc2)C1 12296424 LIURVZZZOFUGCO-INIZCTEOSA-N 377.444 3.620 10 40 GHCB biogenic COc1ccc([C@H]2CC(c3c(C)cc4oc(=O)cc(C)c4c3O)=NN2)c(OC)c1 12390577 RYWHQQNPZUYHIE-OAHLLOKOSA-N 394.427 3.571 10 40 GHCB COc1ccc2c(c1)CCCN2Cc1nc(-c2ccc(OC)c(OC)c2)no1 15565985 SRIYUZOAYCZXSC-UHFFFAOYSA-N 381.432 3.715 10 40 GHCB CC[C@@H](Oc1cc(C)ccc1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217028686 CCSFHTNZNFDWSV-JOCHJYFZSA-N 395.547 3.529 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccccc1F 4498320 TZWGBWKXSAARSE-LDADJPATSA-N 383.398 3.658 10 40 GHCB CCOc1ccc(N/C=C2/C(=O)NC(=S)N(CCC3=CCCCC3)C2=O)cc1 18144657 MUIIXGSTUOQNRO-JXAWBTAJSA-N 399.516 3.515 10 40 GHCB CC1=NN(c2ccc(C)cc2)C(=O)/C1=C/Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 101346798 VAKGBAJIHLXWCS-XNTDXEJSSA-N 381.348 3.530 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccccc3[N+](=O)[O-])SC2=S)cc1 2702144 OLWSAEFWAJGVKK-YBEGLDIGSA-N 399.453 3.959 10 40 GHCB O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(N2CCCC2=O)cc1 219202025 HBQKSUJVBUNEKQ-UHFFFAOYSA-N 377.488 3.734 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2F)C1=O 408878008 ZZRXTZGONKNRCI-RAXLEYEMSA-N 388.782 3.544 10 40 GHCB COc1ccc(COC[C@H](O)CN(Cc2ccco2)Cc2ccccc2O)cc1 6082934 UTHQOGRCZCRLBQ-HXUWFJFHSA-N 397.471 3.574 10 40 GHCB Cc1cccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)Nc3cc(C)on3)c2C)c1 16056051 IQOVGLTVTWXASG-MRXNPFEDSA-N 381.432 3.883 10 40 GHCB COc1cc([N+](=O)[O-])ccc1N/C=C1/C(=O)N(c2ccc(Cl)cc2)N=C1C 100296116 JVVHPNKRXXLKBZ-XNTDXEJSSA-N 386.795 3.975 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 408797782 GZFZLFLLCSXJRB-FOWTUZBSSA-N 384.819 3.795 10 40 GHCB Cc1ccc(Sc2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2)cc1 409250292 WVLIRHYMFZVCMN-UHFFFAOYSA-N 382.510 3.745 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)cc1 4723881 JOOVAYYQSGPSJF-UKTHLTGXSA-N 392.889 3.632 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)COc2ccc(C(C)(C)C)cc2)c1 20529143 LMFOHCUPIOBXIH-UHFFFAOYSA-N 398.503 3.847 10 40 GHCB O=C1/C(=C/c2c[nH]c3ccccc23)SC(=S)N1C1=C[C@H]2OCO[C@@H]2C=C1 26771498 XCWKBNLMOGZJKV-RUSUGFBFSA-N 382.466 3.564 10 40 GHCB CN(C)c1ccc(CNC(=O)C2(c3ccc4c(c3)OCCO4)CCCC2)cc1 32413394 NGXGAPGZAFAFPN-UHFFFAOYSA-N 380.488 3.652 10 40 GHCB COc1cccc2c1OC1(CCN(C)CC1)N1N=C(c3cc(C)ccc3O)C[C@@H]21 10214496 ABTSMSBRYGFSQH-IBGZPJMESA-N 393.487 3.675 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)NC(C)(C)C)C2=O)cc1 16661690 SSISWJCQOMOOJE-NTCAYCPXSA-N 376.547 3.891 10 40 GHCB Cc1ccc(N(C)CCNC(=S)Nc2cccc(N3CCCC3=O)c2)cc1 225796741 QLCFYVSPHULYTB-UHFFFAOYSA-N 382.533 3.545 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2ccc(N3CCCC3)o2)C1=O 409235094 NUMGGCHNAPRXAL-SDNWHVSQSA-N 399.834 3.508 10 40 GHCB CCOc1ccccc1/C=C1/SC(=S)N(NC(=O)c2cccs2)C1=O 409347675 QSKDLZBISFOAEN-GXDHUFHOSA-N 390.511 3.693 10 40 GHCB O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2C[C@H](O)c1ccc(O)cc1 604405317 YWYXDQRYRAQORH-FQEVSTJZSA-N 383.403 3.652 10 40 GHCB biogenic CC(=O)Oc1ccccc1N1C(=O)c2ccc(Oc3ccc(N)cc3)cc2C1=O 793753 NUTVGRIOVSOKKJ-UHFFFAOYSA-N 388.379 3.787 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(Cl)c(O)c(Cl)c3)C2=O)cc1 4704486 LKUKBMXNOKYYCJ-SDQBBNPISA-N 391.210 3.674 10 40 GHCB O=C(Cc1ccccc1)NN1C(=O)/C(=C/c2ccccc2Cl)SC1=S 5551870 JWTRTUPXDPXGJV-PTNGSMBKSA-N 388.901 3.815 10 40 GHCB N=C1/C(=C/c2cccn2-c2ccc([N+](=O)[O-])cc2Cl)C(=O)N=C2SC=CN12 20210830 GCXPKIHVCQQOJE-RFCLUPQTSA-N 399.819 3.816 10 40 GHCB Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)c(C)n1-c1ccc(F)cc1 58133526 BAGNTJBUVDHURP-UHFFFAOYSA-N 378.451 3.591 10 40 GHCB CCCC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NC[C@@H]1CCCO1 112121848 ILGQKKGGYFRSLS-RVAQLADHSA-N 384.505 3.842 10 40 GHCB O=C(CCCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)N1CCCC1 5370892 LSPWUYCGTQTDBG-ZNXZVAGTSA-N 386.542 3.847 10 40 GHCB C[C@H]1CCCC[C@]12NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 23653299 UQEQEIIUUFHENS-MBSDFSHPSA-N 398.551 3.567 10 40 GHCB C[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCCC4=O)c3)cc2)C1 225636683 AUAIJVVKVCNCKN-GOSISDBHSA-N 391.515 3.980 10 40 GHCB CCc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)cc1 408967063 PQPGALQKSUYIEI-UKTHLTGXSA-N 376.890 3.795 10 40 GHCB Cc1nn(-c2ccccc2)c2c1CC1(C(=O)c3ccccc3C1=O)[C@@H]1CCCN21 6558867 CRPRWBVHNBNMBO-FQEVSTJZSA-N 383.451 3.771 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(CO)cc3)c2C)cc1 6830980 AJCQYCGDVAXGHO-UHFFFAOYSA-N 377.440 3.935 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1cccc(OC)c1OC 408794562 JOQIDBBGVZHFQA-QINSGFPZSA-N 397.402 3.720 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(C)=C2C(=O)OC)cc1OC 6964042 WUSSOOSQQLSRMA-BOPFTXTBSA-N 397.427 3.560 10 40 GHCB Cc1cc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c(C)n1-c1ccccc1 3318679 IPTXKZWUQWVNAR-UHFFFAOYSA-N 392.411 3.618 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N3c4ccccc4C[C@@H]3C)sc2n1 10644878 IIGSAWHBVGOGTM-ZDUSSCGKSA-N 395.484 3.630 10 40 GHCB CN(Cc1ccccc1)C(=O)CN1C(=O)/C(=C\c2cccs2)SC1=S 4745423 ORRMXCXADSMKSH-XNTDXEJSSA-N 388.539 3.608 10 40 GHCB O=c1oc2c3c(ccc2c2c1CCCC2)OCN(c1ccc2c(c1)OCCO2)C3 2122897 PQMMJXFEBUNXJY-UHFFFAOYSA-N 391.423 3.800 10 40 GHCB biogenic Cc1cccc(C)c1OCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 11915020 CNTCHBFMVOZOSB-QFIPXVFZSA-N 396.531 3.956 10 40 GHCB COc1cccc(/C=C2/C(=N)N3C(c4ccccc4)=CSC3=NC2=O)c1O 13810297 NCISEEOARLTXFS-CTLFBJNRSA-N 377.425 3.705 10 40 GHCB COC(=O)c1c(NC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)O)sc2c1CCCC2 4651475 FNFQUUVVMMQRLD-KGLIPLIRSA-N 391.489 3.799 10 40 GHCB CC(=O)Nc1ccc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 409351119 ZPISTGNGANDMCG-IUXPMGMMSA-N 398.465 3.780 10 40 GHCB CC(=O)NC1(c2ccc(F)cc2)CCN(Cc2ccc3c(c2)CCCN3C)CC1 12219477 HCTUTDDBUUNGPP-UHFFFAOYSA-N 395.522 3.836 10 40 GHCB CCC(=O)N[C@@H](C)[C@H](c1cccs1)N1CCN(c2ccc(OC)cc2)CC1 23181500 VVQIVVCYGKKCRM-HRAATJIYSA-N 387.549 3.535 10 40 GHCB CN(C)c1ccc(CN(CCCn2ccnc2)Cc2nc3ccccc3[nH]2)cc1 12146978 MVFZCHWTZXXQRV-UHFFFAOYSA-N 388.519 3.918 10 40 GHCB CN(C)c1ccc(/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)cc1 12628391 MLTIWNDZINNMSK-ZDLGFXPLSA-N 398.509 3.883 10 40 GHCB CN(C)c1ccc(/C=c2\sc3nc(-c4cccc5ccccc45)nn3c2=O)cc1 16736058 UZNUUFKFXMVLQJ-ZHZULCJRSA-N 398.491 3.585 10 40 GHCB Cc1cc(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)c(C)n1-c1cccc(F)c1 225431648 UINXOUPBTSEYGL-UHFFFAOYSA-N 393.418 3.841 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(c3ccccc3OC)C2=O)c2ccccc21 2403527 SLRSTMMKBGVBJK-FOWTUZBSSA-N 389.411 3.541 10 40 GHCB O=C1/C(=C\c2ccccc2O)SC(=S)N1CNc1ccc([N+](=O)[O-])cc1 3843273 GRFVWIJERNOQKZ-OQLLNIDSSA-N 387.442 3.571 10 40 GHCB COc1ccc(-c2cc(=O)oc3c(CNCc4ccccn4)c(O)ccc23)cc1 5427108 ZXZAHVWVYNTDAX-UHFFFAOYSA-N 388.423 3.859 10 40 GHCB COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C(/C)NCC(C)C)cc1 9059903 UIWYPYAWWCKXCX-PGMHBOJBSA-N 393.487 3.974 10 40 GHCB COC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)[C@H](C)CC(C)(C)N3C)C1=O 208198979 WXCNUWMFERZOAQ-GFQQVXNGSA-N 388.489 3.618 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)c1C 4743535 IHDNUVGKYNQOPB-XYOKQWHBSA-N 376.890 3.850 10 40 GHCB Cc1c(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)C(F)(F)F)cnn1C 35678533 HBIAWMHHFVSPED-MDWZMJQESA-N 384.308 3.712 10 40 GHCB O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C\c1ccc(O)cc1 1471541 QGDATRCKKBGLBA-PDGQHHTCSA-N 399.903 3.838 10 40 GHCB CCOc1ccc([C@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)cc1 17307541 SGHFRVFVJAVDIR-HXUWFJFHSA-N 389.928 3.909 10 40 GHCB CCN(CC)c1ccc(/C=C2/SC(=O)N(CC(=O)OC(C)(C)C)C2=O)cc1 4933326 KZJHQEIDIULPLN-FOWTUZBSSA-N 390.505 3.911 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cccn3-c3ccccc3)C2=O)cc1C 5571044 VWKMNDITVHCTMB-ZHZULCJRSA-N 385.423 3.761 10 40 GHCB COC(=O)Cn1c(-c2ccc(C)cc2)cnc1SCC(=O)Nc1ccccc1 44085960 BAKNWAIMMOQXBO-UHFFFAOYSA-N 395.484 3.762 10 40 GHCB Cc1cc(/C=C2\SC(=O)N(CC(=O)O)C2=O)c(C)n1-c1ccc(Cl)cc1 409135782 ZWYUPGILYSEWEQ-NVNXTCNLSA-N 390.848 3.868 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N([C@H](C(=O)O)c2ccccc2)C1=O 1452289 LAVUPXNADVCYTE-SFKKXYGYSA-N 385.466 3.722 10 40 GHCB Cc1cccc(N2C(=O)/C(=C\c3ccc(Cl)s3)C(=O)NC2=S)c1C 9263200 IHDNUVGKYNQOPB-WQLSENKSSA-N 376.890 3.850 10 40 GHCB Cc1ccc(N2NC(=O)/C(=C\c3cccc(Br)c3)C2=O)cc1Cl 59416947 QMZUKGXWUBUGHG-RIYZIHGNSA-N 391.652 3.872 10 40 GHCB CC[C@H](C)Oc1cccc(C(=O)Nc2cc(OC)ccc2N2CCOCC2)c1 7496945 KLUYBKJMIHUHCZ-INIZCTEOSA-N 384.476 3.961 10 40 GHCB Cc1ccc(N(C)CCNC(=S)Nc2ccc(N3CCCC3=O)cc2)cc1 225796342 GLNKXAKBLPATKO-UHFFFAOYSA-N 382.533 3.545 10 40 GHCB Cc1nc(-c2cccc(NC(=O)NCc3ccc4c(c3)CCCN4C)c2)no1 58645033 ZEFSMNBFGHKBPU-UHFFFAOYSA-N 377.448 3.749 10 40 GHCB CCN(CC)c1ccc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc1 13582303 JBHXGRMFFHZGFB-WISAJEAXSA-N 376.547 3.913 10 40 GHCB O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc2c1C(=O)c1ccccc1C2=O 4947217 LPLOAQXAIMFAJR-UHFFFAOYSA-N 387.347 3.727 10 40 GHCB CC1=NN(c2ccc(C)cc2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 100041001 WSNXTRNUBBXDJU-YVLHZVERSA-N 381.348 3.530 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O 408804374 FBWITYAJNPCVDU-XNTDXEJSSA-N 384.819 3.714 10 40 GHCB Cc1ccc(NC2=NC(=O)/C(=C/c3cn(CC(N)=O)c4ccccc34)S2)cc1 33660615 RIDHYNYMSUVKTD-ZDLGFXPLSA-N 390.468 3.517 10 40 GHCB CCOC(=O)CN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S 1277077 CJVQICBXXKORMR-WZUFQYTHSA-N 376.286 3.758 10 40 GHCB COc1ccc(-c2ccc(/C=C3\SC(=S)N(CCC(=O)O)C3=O)o2)cc1 5032396 HLRKUPNNEHAWGW-GDNBJRDFSA-N 389.454 3.631 10 40 GHCB COc1cc(/C=C2\SC(=S)N(C3CCCC3)C2=O)cc(OC)c1OC 13787407 XBVYDJWATISBOU-GDNBJRDFSA-N 379.503 3.856 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(C(F)(F)F)c1 22287304 LKFUTHBLXGZASR-UHFFFAOYSA-N 386.439 3.982 10 40 GHCB COc1cc([N+](=O)[O-])ccc1N/C=C1/C(=O)N(c2cccc(Cl)c2)N=C1C 100535672 YIOJYQDWEVBMMC-XNTDXEJSSA-N 386.795 3.975 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)S1 408754187 DYCGVWSXYLMSBW-AUWJEWJLSA-N 391.792 3.615 10 40 GHCB Cc1ccc2nsnc2c1S(=O)(=O)Nc1ccc(Br)cc1 792598 SDRUAHQSLKWFBJ-UHFFFAOYSA-N 384.280 3.563 10 40 GHCB O=C(NN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccc(F)c(F)c1 3267536 MEGUWCCBEJSBKH-GHXNOFRVSA-N 382.438 3.573 10 40 GHCB COc1cc(/C=C2/C(=N)N3N=C(C4CCCCC4)SC3=NC2=O)ccc1O 12285446 CUTKGWUSPVMPFH-PNZWKLPWSA-N 384.461 3.600 10 40 GHCB CNc1snc(C)c1C(=O)OCC(=O)c1cc(C)n(-c2ccccc2)c1C 12651839 GBZSMWHOGRELKN-UHFFFAOYSA-N 383.473 3.940 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Cl)ccc3OC)C2=O)cc1 2810661 YXEMCNXGXDEDFU-LFIBNONCSA-N 384.819 3.577 10 40 GHCB COc1cccc(/C=C2\SC(=S)N([C@H](C(=O)O)c3ccccc3)C2=O)c1 12032584 YBJFBVHJAYUQFB-QZFKAFNDSA-N 385.466 3.722 10 40 GHCB O=C(CSc1nnc(NCCc2ccccc2)s1)c1ccc(O)c(O)c1 12822088 QGFMEODLXKNDLP-UHFFFAOYSA-N 387.486 3.579 10 40 GHCB COc1cc(/C=C2/SC(N3CCCC[C@@H]3C)=NC2=O)cc(OC)c1OC 83313505 ZVWJLAPBFIATOJ-JASJWYONSA-N 376.478 3.557 10 40 GHCB CC[C@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 223005112 DXDGDZFKMWKCOR-QHCPKHFHSA-N 395.547 3.529 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C\c1cccc(C)c1 408583322 HLHOIUUHKBUHKT-PDGQHHTCSA-N 393.439 3.889 10 40 GHCB CN1C(=O)/C(=C\c2ccc(C(=O)Nc3cccnc3Cl)cc2)SC1=S 5374813 NJBLOVCZNDDTBH-UKTHLTGXSA-N 389.889 3.818 10 40 GHCB O=C(COC(=O)CC1CCCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 7026786 OVCBXGFHEIOOTI-UHFFFAOYSA-N 391.423 3.524 10 40 GHCB CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1cccc(O)c1 14415036 NPZDPANMCFWNEA-HKWRFOASSA-N 377.440 3.698 10 40 GHCB CCOC(=O)c1sc(N2N=C(C)/C(=C\c3ccc(N(C)C)cc3)C2=O)nc1C 4663107 FNYSIEFJKMCANZ-LFIBNONCSA-N 398.488 3.500 10 40 GHCB COC(=O)c1c(NC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)O)sc2c1CCCC2 4651477 FNFQUUVVMMQRLD-KBPBESRZSA-N 391.489 3.799 10 40 GHCB CC1(C)OC(=O)C(=Cc2ccc(-c3ccc(Br)cc3)o2)C(=O)O1 1446283 SFZSCYVKKDLMLZ-UHFFFAOYSA-N 377.190 3.929 10 40 GHCB biogenic Cc1oc2c(CN3CCC[C@H]3C(=O)O)c(O)ccc2c(=O)c1-c1ccc(F)cc1 4029497 ZBEYEZOELOMFRG-KRWDZBQOSA-N 397.402 3.662 10 40 GHCB biogenic Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cn(C)c4ccccc34)C2=O)cc1Cl 5797506 VOMXDUKVZLWMPV-SXGWCWSVSA-N 393.830 3.807 10 40 GHCB Cc1cccc(-c2n[nH]c(=S)n2CC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 12556087 XGVFSZYTMIXEQC-UHFFFAOYSA-N 395.532 3.641 10 40 GHCB CC(C)OCCS(=O)(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 95461775 RVCPMBZQCAQXQK-QGZVFWFLSA-N 377.506 3.710 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)c(C)c1 408965584 JAQQVHNTNBNAHP-XYOKQWHBSA-N 376.890 3.850 10 40 GHCB O=C(O)CSc1cc(NS(=O)(=O)c2cccs2)c2ccccc2c1O 1795810 GVAXUAIZKLJWSB-UHFFFAOYSA-N 395.483 3.584 10 40 GHCB in-vivo COc1ccc(N2C[C@@](O)(c3ccc(Cl)cc3)[N+]3=C2SCCC3)cc1 2965938 ZBXMHEHVAWOJHT-LJQANCHMSA-N 375.901 3.519 10 40 GHCB Cc1ccc(N2NC(=O)/C(=C/c3cccc(Br)c3)C2=O)cc1Cl 5547192 QMZUKGXWUBUGHG-ZSOIEALJSA-N 391.652 3.872 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3c(O)ccc4ccccc34)C2=O)c(C)c1 408897142 WCMMAFLJHHSESS-LDADJPATSA-N 386.407 3.829 10 40 GHCB COc1ccc(N2CCN(C(=O)c3c(-c4ccccc4)noc3C)CC2)cc1 816382 QOEOKUAZHXOIRZ-UHFFFAOYSA-N 377.444 3.621 10 40 GHCB CN(Cc1ccccc1)Cc1c(O)c(C(=O)N2CCOCC2)cc2ccccc12 7814629 QBGYHVOBVSCCJW-UHFFFAOYSA-N 390.483 3.650 10 40 GHCB Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\Nc3ccc(C)c(C)c3)C2=O)c(C)c1 408535903 UNURBJHNMXDIKX-WOJGMQOQSA-N 377.444 3.808 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C\c2ccc3c(c2)OCO3)S1 35648157 VVHZQALURHJMQL-FRKPEAEDSA-N 382.397 3.504 10 40 GHCB COc1ccc(N2CCN(Cc3cc(=O)oc4ccc(Cl)cc34)CC2)cc1 54147542 XOAWGABLPXPHPD-UHFFFAOYSA-N 384.863 3.777 10 40 GHCB aggregator,biogenic O=C(O)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(F)c1)N2 103020655 DNWUTOQEGRTHMD-LZJOCLMNSA-N 380.419 3.857 10 40 GHCB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@H]2c1c(O)ccc2ccccc12 7499341 RREWOSFCBNTOGT-OAQYLSRUSA-N 397.438 3.851 10 40 GHCB Cc1cccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 3363428 VBEJPQIOOSEMCS-XMHGGMMESA-N 385.423 3.761 10 40 GHCB COc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(Cl)c(Cl)c2)C1=O 2256945 SLUMYRNDCAWEKH-DHZHZOJOSA-N 391.210 3.668 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)N3CCCC3)n2Cc2ccco2)cc1 44086161 MUWKODMOOFVKKG-UHFFFAOYSA-N 397.500 3.915 10 40 GHCB CC(/C=C1\SC(=S)N(NC(=O)c2cccnc2)C1=O)=C\c1ccccc1 13804081 HKSSAIYIDJUMME-VKDWSQHSSA-N 381.482 3.574 10 40 GHCB O=C1NN(c2ccccc2)C(=O)/C1=C\c1cccn1-c1cccc(C(F)(F)F)c1 108133431 BFQYDEBUNFYGTK-AQTBWJFISA-N 397.356 3.958 10 40 GHCB O=C(O)COc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1 409084572 WVLQEXGNZGNLMJ-QNGOZBTKSA-N 398.418 3.985 10 40 GHCB O=C1NC(=O)N(c2ccc(OCc3ccccc3)cc2)C(=O)/C1=C/c1ccco1 409211874 OLFQFWMNIYBSPU-CPNJWEJPSA-N 388.379 3.525 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)c2nn(-c3ccccc3)cc2OC)cc1 9932505 FNSUPNRSGALXDO-UHFFFAOYSA-N 392.503 3.999 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3C(C)C)CC2)cc1 20111098 BGXOUCHVIJUGJE-GOSISDBHSA-N 382.504 3.935 10 40 GHCB CSc1ccc2c(c1)[C@@H](N1CCN(CCO)CC1)Cc1ccccc1S2 22859275 STMRSBFWRHDXLV-IBGZPJMESA-N 386.586 3.767 10 40 GHCB C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCCc2cc(OC(F)F)ccc21 65596893 QSLDDXPMLMXCPQ-GFCCVEGCSA-N 390.386 3.797 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 223536444 NIWUQLOTIJNECK-ZIAGYGMSSA-N 377.510 3.567 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)c(C)c1 409234686 XEFLXVOVVZXWRP-XDHOZWIPSA-N 394.496 3.958 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3nccs3)C2=O)cc1 1013807 FPAJEVFMBQRJEY-JLHYYAGUSA-N 389.527 3.682 10 40 GHCB O=C1/C(=C\c2ccccc2[N+](=O)[O-])SC(=S)N1c1ccc([N+](=O)[O-])cc1 6926813 KGAUDSHJZCUFLS-NTEUORMPSA-N 387.398 3.909 10 40 GHCB CN1/C(=C\C=C2/SC(=S)N(CCC(=O)O)C2=O)C(C)(C)c2ccccc21 13286167 JVWYTZGULFPUKA-SFGFDRCGSA-N 388.514 3.517 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc(O[C@@H](C)C(=O)O)cc3)S2)cc1 16907113 HBCBESGIZJPHKH-OOIIIRTPSA-N 398.440 3.630 10 40 GHCB CCn1c(/C=C2\C(=O)Nc3ccc(Br)cc32)nc2ccccc2c1=O 17721300 IWNGRNLEIYYYTB-UVTDQMKNSA-N 396.244 3.672 10 40 GHCB CCN(Cc1cc(Br)ccc1O)c1ncncc1Br 89969250 RRZVEYFJHDQSEF-UHFFFAOYSA-N 387.075 3.734 10 40 GHCB COC(=O)c1ccc(N/C=C2\C(=O)N(c3ccc(Cl)c(OC)c3)N=C2C)cc1 408534309 QFYYSIHUQHANNJ-WJDWOHSUSA-N 399.834 3.854 10 40 GHCB COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(O)c(OC)c1 409023342 KNLLAXIZEHOVIB-WQRHYEAKSA-N 393.439 3.895 10 40 GHCB NC(=O)Cn1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)c2ccccc21 409135691 ZPZAXYDSGPKRLL-YVLHZVERSA-N 393.493 3.532 10 40 GHCB CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)Nc1ccc(Cn2cnnc2)cc1 108047045 KJFDLQVPNFJCON-ZHZULCJRSA-N 390.422 3.574 10 40 GHCB C[C@H](NC(=S)Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 65222503 JHRGDKRKCRNHGH-ZDUSSCGKSA-N 377.460 3.849 10 40 GHCB Cc1cc(C(=O)CN2C(=O)CC3(CCCC3)C2=O)c(C)n1-c1ccc(F)cc1 9338715 KEUCSRDBFPVHIQ-UHFFFAOYSA-N 382.435 3.735 10 40 GHCB CCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)cc1 408875878 LWYVPCNJDYAXNU-JXAWBTAJSA-N 378.428 3.704 10 40 GHCB COC(=O)c1cccc(-n2c(C)cc(/C=C3\SC(=S)NC3=O)c2C)c1C 408992323 ABMPKKLGRVRNQZ-SXGWCWSVSA-N 386.498 3.678 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3cccc([N+](=O)[O-])c3)S2)c(OC)c1 35043526 BBGHWGWNJPPUAT-CXUHLZMHSA-N 385.401 3.694 10 40 GHCB CC(=O)Nc1ccc(NC2=NC(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)S2)cc1 35043534 MXYSJUUJXPJBJY-MHWRWJLKSA-N 382.401 3.636 10 40 GHCB CCOC(=O)c1sc2nc([C@@H]3CCN(C(=O)OC(C)(C)C)C3)ccc2c1N 257209533 BQTYGHAFCKEDLZ-LLVKDONJSA-N 391.493 3.780 10 40 GHCB CCCCCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(N(C)C)cc1 5003619 ZSBYJQCDJMCDBL-GOSISDBHSA-N 375.538 3.669 10 40 GHCB COc1cc(N2CCOCC2)c(OC)cc1CN1CCc2sccc2[C@H]1C 19498350 APWFJKWCJUZFIR-OAHLLOKOSA-N 388.533 3.721 10 40 GHCB Cc1cc(C)nc(NS(=O)(=O)c2ccc(/N=N/N3CCCCCC3)cc2)n1 100081502 PMZBWIOIEYADBD-XTQSDGFTSA-N 388.497 3.769 10 40 GHCB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1 4703317 NQTJPXHZUOPMMW-XNTDXEJSSA-N 399.244 3.732 10 40 GHCB COc1cccc(NC(=O)Cn2c(CCC(=O)O)ccc2-c2cccs2)c1 4784042 RIPKZJBHPVJDFJ-UHFFFAOYSA-N 384.457 3.881 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cccn3Cc3ccccc3)C2=O)cc1 5033877 UJYUIVVOBQNISJ-QNGOZBTKSA-N 399.450 3.765 10 40 GHCB Cn1c(-c2ccc(-c3ccccc3)cc2)cnc1SCCN1C(=O)CCC1=O 23139042 KRJRWCAFQRXZAH-UHFFFAOYSA-N 391.496 3.995 10 40 GHCB O=C(O)c1ccc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 33600455 ZRTQMAYZOOIYEU-CHHVJCJISA-N 385.422 3.519 10 40 GHCB COc1ccc(N2CCN(C(=O)CCc3ncc(-c4ccccc4)o3)CC2)cc1 41018866 FRLYBLURWCWODR-UHFFFAOYSA-N 391.471 3.632 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc4nccnc4c3)SC2=S)cc1 54361141 JRIPEOFONMPLHO-YBEGLDIGSA-N 393.449 3.734 10 40 GHCB O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1c1cccc([N+](=O)[O-])c1 59417975 HAFYKZPDJPHJQL-ZSOIEALJSA-N 387.398 3.909 10 40 GHCB CCCN1C(=O)/C(=C/c2cc(Br)c(O)c(OC)c2)SC1=S 208668291 YBUMQXNKTVELNC-XFFZJAGNSA-N 388.308 3.775 10 40 GHCB COC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=S)NC3=O)c2C)c(C)c1 408992727 BHYTVOFRRXFXCT-SXGWCWSVSA-N 386.498 3.678 10 40 GHCB O=C(Cn1cc(/C=C2/SC(=S)NC2=O)c2ccccc21)Nc1ccccc1 1105891 XVQOCRVUSCUGAJ-LICLKQGHSA-N 393.493 3.769 10 40 GHCB Cc1ccc(N2C(=O)/C(=C\c3ccccc3OCC(N)=O)SC2=S)cc1C 9232338 HABQPPBQKYJWKV-LICLKQGHSA-N 398.509 3.573 10 40 GHCB COc1ccc(/C=C2/SC(N3CCN(c4ccc(C)cc4)CC3)=NC2=O)cc1 12378266 OQFPBSNRSDEJHY-HMMYKYKNSA-N 393.512 3.796 10 40 GHCB COc1ccc([C@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)c(F)c1 2966033 KSGUXUSTSJJXOX-LJQANCHMSA-N 393.891 3.658 10 40 GHCB O=C(NCc1cc([N+](=O)[O-])ccc1O)c1cccnc1Sc1ccccc1 12783072 FJLOPMHWDPUWRT-UHFFFAOYSA-N 381.413 3.777 10 40 GHCB Cc1cc(C(=O)CN(C)S(=O)(=O)c2cccs2)c(C)n1-c1ccccc1 13063310 WYZGWDCHVRHKHH-UHFFFAOYSA-N 388.514 3.659 10 40 GHCB CCOc1ccc2c(c1)SC1=NC(=O)/C(=C/c3ccc(C(=O)O)cc3)C(=N)N12 13540803 PCXLOIWUAYIBSB-OVDNTTTISA-N 393.424 3.653 10 40 GHCB Cc1cccc(NC(=O)COc2ccc(/C=C3\SC(=S)NC3=O)cc2)c1 14903964 KJBQUWLJLIQFPX-YBEGLDIGSA-N 384.482 3.501 10 40 GHCB COC(=O)c1cc(-c2ccc(/C=C3\SC(=S)NC3=O)o2)ccc1Cl 16194059 GOETUEVFBJHTIO-QPEQYQDCSA-N 379.846 3.875 10 40 GHCB CN(C)c1ccc(CN2CCOC[C@H]2c2nc(-c3cccc(F)c3)c[nH]2)cc1 96296198 FNULHUUFHFHTJG-NRFANRHFSA-N 380.467 3.855 10 40 GHCB biogenic,in-vitro O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1 408912234 QBSKWICBZUVDSZ-RIYZIHGNSA-N 378.281 3.511 10 40 GHCB CC(=O)Nc1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 409335197 ZINYULZLMGIZNP-CXUHLZMHSA-N 399.453 3.959 10 40 GHCB [N-]=[N+]=N[C@H]1C[C@H](C(=O)O)N(C(=O)OCC2c3ccccc3-c3ccccc32)C1 98091006 HOPXMBBEYJTPNX-KPZWWZAWSA-N 378.388 3.773 10 40 GHCB COc1cc2c(cc1OC)C(=O)N[C@H](c1ccc(N3CCCCCC3)cc1)N2 69098353 UGYWRSPAIVCYNB-OAQYLSRUSA-N 381.476 3.938 10 40 GHCB O=C(NN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)c1ccccc1 34235653 YXFHMCBOGNKSAG-MHWRWJLKSA-N 379.466 3.714 10 40 GHCB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\NC(=S)NCc1ccccc1 101346590 RNBZTJRKRJNIFJ-ATVHPVEESA-N 384.892 3.611 10 40 GHCB CCOc1ccccc1/C=C1/SC(=S)N(CC(=O)O[C@H](C)CC)C1=O 20010472 ZITSVIPPJQDYKM-JXCQQFQQSA-N 379.503 3.628 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)NC1CCCC1 8708959 LPCDITRAYFTNPF-GOSISDBHSA-N 385.533 3.880 10 40 GHCB Cc1[nH]c2ccccc2c1/C=C1\C(=O)N(c2ccc(C(=O)O)cc2)C(=O)N=C1O 34238318 NDCNOZOSQVRTCN-YBEGLDIGSA-N 389.367 3.681 10 40 GHCB COc1ccc2ncc(/C=C/[C@@]34NC(=O)CN3c3ccccc3C4(C)C)cc2c1 2108740 AAHHTLIZFZOYIZ-NFPSEPLVSA-N 385.467 3.881 10 40 GHCB biogenic COc1ccc(N2C(=O)/C(=C/c3ccc(O)c(O)c3)SC2=S)c(OC)c1 5371262 OVTVRCQWCDBXPR-PXNMLYILSA-N 389.454 3.521 10 40 GHCB CCN(CC)c1ccc(CNCCCSc2nnnn2-c2ccccc2)cc1 6869679 ZXGPQFKYZTWQRS-UHFFFAOYSA-N 396.564 3.781 10 40 GHCB O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1cccc(Br)c1 30418961 YOFCAJJYOBHUMN-UHFFFAOYSA-N 395.322 3.528 10 40 GHCB Cn1ccnc1COc1ccc(/C=C2/SC(NC3CCCCC3)=NC2=O)cc1 97152208 DJYXFHCBEFIMBY-QGOAFFKASA-N 396.516 3.892 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 100207927 NYABPNULUCEVTI-LGMDPLHJSA-N 378.384 3.862 10 40 GHCB O=C(c1ccc([N+](=O)[O-])o1)N1N=C(c2ccsc2)C[C@H]1c1ccccc1O 58268756 CQZTVEVDEDDHIS-AWEZNQCLSA-N 383.385 3.946 10 40 GHCB Cc1ccc2c(c1)C(C)(C)[C@]1(/C=C/c3ccccc3[N+](=O)[O-])NC(=O)CCN21 2362828 DBZURUNILWFRFW-RSNBEDGSSA-N 377.444 3.930 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)N=C2O)cc1 32101755 FVPDMQKBGSCKEU-ATVHPVEESA-N 395.371 3.890 10 40 GHCB CC[C@H](Oc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 38754463 PMEZXQCLCJBASJ-FQEVSTJZSA-N 388.895 3.650 10 40 GHCB CCOC(=O)c1ccc(NC(=S)NCCCN2CCc3ccccc32)c(C)c1 225560639 KHPQVCXVYHFXTQ-UHFFFAOYSA-N 397.544 3.911 10 40 GHCB CCc1ccc2c(c1)C(C)(C)[C@]1(/C=C/c3ccc(N(C)C)cc3)NC(=O)CN21 2114054 YYNKLAXNLRKKGI-XIQMRYHBSA-N 375.516 3.952 10 40 GHCB biogenic O=C(NCc1cc([N+](=O)[O-])ccc1O)C1c2ccccc2Oc2ccccc21 36622618 RVFXBDPPEXEIMR-UHFFFAOYSA-N 376.368 3.854 10 40 GHCB CN(C)c1ccc(/C=C/C(=O)NCc2ccc(N3CCCCCC3)nc2)cc1 65475895 WPBWJDKQRMYLOO-GXDHUFHOSA-N 378.520 3.858 10 40 GHCB O=C1/C(=C\c2ccco2)SC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 110422953 BCNZTASVXXHUFZ-VIZOYTHASA-N 388.514 3.728 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(O)cc1 409234946 BEHJZQAQBYVDMP-FYJGNVAPSA-N 387.439 3.893 10 40 GHCB CCOc1ccccc1OCCCC(=O)NCc1ccc2c(c1)CCCN2C 58341513 GZQWSGWDGWNKJY-UHFFFAOYSA-N 382.504 3.943 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1/C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 4723732 SQFQNHXGCQXWSD-IGWPVBGESA-N 398.459 3.834 10 40 GHCB CCOc1ccc(N(C(C)=O)C2=NC(=O)/C(=C\c3ccccc3O)S2)cc1 5900156 KZPQLWOUDZSXFG-LDADJPATSA-N 382.441 3.814 10 40 GHCB COc1ccc(-c2c(C)oc3c(CN4CCCOC4)c(O)ccc3c2=O)cc1 32501396 BZLCAJZSYBLXHF-UHFFFAOYSA-N 381.428 3.662 10 40 GHCB biogenic CCc1cccc(C)c1-n1c(C)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)c1C 408961047 QJDUUURNLAAPIM-UHFFFAOYSA-N 395.528 3.564 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NCc1ccncc1 100163332 YKZPYFZGOYGKLG-RGEXLXHISA-N 379.420 3.556 10 40 GHCB COC(=O)C1=C(C)N(Cc2cccnc2)C(=O)/C1=C/c1c(F)cccc1Cl 408896688 YZHRJJRDECHXGY-OQLLNIDSSA-N 386.810 3.747 10 40 GHCB CN(C)c1ccc(CN2CCCC[C@@H]2c2cc(=O)[nH]c(-c3cccnc3)n2)cc1 19584975 XDPVBOWTZLTYQH-OAQYLSRUSA-N 389.503 3.625 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3c[nH]c4ccccc34)C2=O)cc1Cl 1161885 LNZIMGCXKYTXGF-OVCLIPMQSA-N 379.803 3.796 10 40 GHCB Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1 4747737 SXXIWUAIRYIFME-XMHGGMMESA-N 377.444 3.580 10 40 GHCB COc1ccc(NC(=O)Cn2c(CCC(=O)O)ccc2-c2cccs2)cc1 5000377 QSWHOCJGTSMWNF-UHFFFAOYSA-N 384.457 3.881 10 40 GHCB O=Cc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)O)c3ccccc3)C2=O)cc1 5375027 OASNUWFMEQCZFZ-DDITZMBXSA-N 383.450 3.526 10 40 GHCB CCOC(=O)[C@H](C(C)=O)C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 1597166 VYYVSMSLSURWGL-OAQYLSRUSA-N 382.504 3.719 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/C(=O)N=C(S)N(C4CC4)C3=O)c2C)cc1 1279688 JIYISYNRMFTZKK-WQRHYEAKSA-N 379.485 3.603 10 40 GHCB Cc1cc(C)cc(C2(C(=O)NCc3ccc(N4CCOCC4)cc3)CCC2)c1 56199458 RJPDEVIGHURCHR-UHFFFAOYSA-N 378.516 3.878 10 40 GHCB CC[C@H](Oc1cc(C)ccc1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 20453655 KIGOIQMCOJFZNX-NRFANRHFSA-N 382.504 3.818 10 40 GHCB COCCCN1C(=O)/C(=C\c2ccc(Cl)cc2Cl)C(C(=O)OC)=C1C 59435426 RFCICNBOPRQTMN-ZROIWOOFSA-N 384.259 3.703 10 40 GHCB COC(=O)c1ccc(Cl)c(-c2ccc(/C=C3\SC(=S)NC3=O)o2)c1 408820582 YUYMCKFQZSPLIC-QPEQYQDCSA-N 379.846 3.875 10 40 GHCB Cc1ccc(NC(=O)CCCC[C@H](C)NC[C@H](O)c2ccc(O)c(O)c2)cc1 1588623 JPIVNDIQZWPZMT-KKSFZXQISA-N 386.492 3.617 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 4541597 ZMCFGQNWPLOQDQ-UHFFFAOYSA-N 392.411 3.618 10 40 GHCB COc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc([N+](=O)[O-])c1O 113834994 VFSAKXXVRBFOLU-NTEUORMPSA-N 394.474 3.843 10 40 GHCB CCOc1cc(Cl)cc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)c1 408864910 AZGFLRNOPONUJI-YBEGLDIGSA-N 386.860 3.570 10 40 GHCB C[C@@H]1Cc2cc(/C=C3\SC(=S)N(CCCCCC(=O)O)C3=O)ccc2O1 16810412 FLHPZLAWEWJMOP-COOUDCDJSA-N 391.514 3.856 10 40 GHCB CC(=O)NC1=NC(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)S1 408761095 HTGNTBUBDVUZAB-AUWJEWJLSA-N 391.792 3.615 10 40 GHCB CC(C)C1=NN2C(=N)/C(=C\c3ccc(Br)cc3)C(=O)N=C2S1 32109408 PCUJSIXCHFSLCR-XXHWOJSFSA-N 377.267 3.724 10 40 GHCB Cc1cccnc1-n1c(C)cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c1C 222748133 ZNBWVQXOQHQVLX-MOPGFXCFSA-N 377.517 3.795 10 40 GHCB O=C(O)COc1ccccc1/C=C1/SC(Nc2cccc(Cl)c2)=NC1=O 16910027 RNWXJMDOKYORPY-OVCLIPMQSA-N 388.832 3.886 10 40 GHCB COC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)C(C)=CC(C)(C)N3C)C1=O 208445662 RJAZWXUIRJWYSY-CXUHLZMHSA-N 386.473 3.528 10 40 GHCB Cc1cc(C(=O)COc2cccc([N+](=O)[O-])c2)c(C)n1-c1ccc2c(c1)OCO2 5711299 VCEJBFMJOFEJES-UHFFFAOYSA-N 394.383 3.993 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3c(C)n(C)c4ccccc34)C(=O)NC2=S)cc1 654828 FHZCDUNBOZHNJT-LDADJPATSA-N 389.480 3.626 10 40 GHCB CCc1ccc(/C=C2/C(=N)N3N=C(N4CCC(C)CC4)SC3=NC2=O)cc1 41084650 CATUUSXLIFDFCL-PSPCYXPKSA-N 381.505 3.558 10 40 GHCB CN1C(=O)/C(=C/c2cccc(Oc3nc(Cl)ncc3F)c2)SC1=S 409328495 WLXJIDNKBDKWBI-WDZFZDKYSA-N 381.841 3.892 10 40 GHCB Cc1cccc(NS(=O)(=O)c2cccc3c2C(=O)c2ccccc2C3=O)c1 4289696 MQMMKDFNLDWYIS-UHFFFAOYSA-N 377.421 3.571 10 40 GHCB Oc1cc2c(cc1CN1CCN(Cc3cccc4ccccc34)CC1)OCO2 22786004 QVBWBLIGPVXIAQ-UHFFFAOYSA-N 376.456 3.592 10 40 GHCB COc1ccc([C@H](c2ccc3c(OC)cccc3c2O)N2CCN(C)CC2)cc1 22935327 SHGIENHXAMWUBU-HSZRJFAPSA-N 392.499 3.899 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 27530346 BOJLNYGJIGQGFT-RQZCQDPDSA-N 398.465 3.780 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 408891936 FVSRWEDOJLGBBD-KAMYIIQDSA-N 382.347 3.611 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc1OCC 409086106 YIIGXPNWVJCPHO-RQNDZEIBSA-N 393.530 3.864 10 40 GHCB COc1ccc(N2CCN(C(=O)COc3ccccc3C(C)(C)C)CC2)cc1 7380822 IRGHTNKSHKKLNU-UHFFFAOYSA-N 382.504 3.720 10 40 GHCB COC(=O)c1cc(N/C=C2/C(=O)N(c3ccc(F)cc3)N=C2C)ccc1Cl 101113811 FJPJPZFVAFGLAS-MHWRWJLKSA-N 387.798 3.984 10 40 GHCB Cc1cc2oc(=O)cc(-c3ccccc3)c2c(O)c1CN[C@@H](C(=O)O)C(C)C 11866772 ZKHLJRPPHRLYGR-HXUWFJFHSA-N 381.428 3.673 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=S)N(c3ccccc3Cl)C2=O)cc1 409244532 FBWQGFZGDKFSAO-VCXFDYNHSA-N 398.871 3.736 10 40 GHCB COC(=O)c1cccc(NC(=S)NCCCN2CCc3ccccc32)c1C 225560031 YLHWAEWNIFHXSG-UHFFFAOYSA-N 383.517 3.521 10 40 GHCB O=S(=O)(c1ccc(N2CC=C(c3c[nH]c4ncccc34)CC2)cc1)C(F)F 51621641 HNIHXCSTJNGMBX-UHFFFAOYSA-N 389.427 3.853 10 40 GHCB Cc1cc(CNCCOCCO)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 8403079 HZLZKHSOQLLFKZ-UHFFFAOYSA-N 390.833 3.865 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 35041452 WOTCSRUVFZOVMP-WOJGMQOQSA-N 399.493 3.868 10 40 GHCB O=C1/C(=C/c2cccc([N+](=O)[O-])c2)SC(=S)N1c1cccc([N+](=O)[O-])c1 59417974 HWYXYNYHOXZKPX-ZSOIEALJSA-N 387.398 3.909 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccccc1F 408854685 BHTJSWFFEGQFNR-CSKARUKUSA-N 395.242 3.964 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1ccc(O)cc1 1907835 IFGGXHKQKCQQMC-FOWTUZBSSA-N 384.482 3.622 10 40 GHCB Cc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 4891434 SCDNKBFAOLWFHL-UHFFFAOYSA-N 386.363 3.931 10 40 GHCB O=C1/C(=C/C=C/c2ccccc2[N+](=O)[O-])C(O)=NC(=S)N1c1ccccc1 1197465 YKRRTGZXVNZKSZ-KVDBUQHUSA-N 379.397 3.823 10 40 GHCB CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(N2CCOC2=O)cc1 48299109 DDQJXSNLFHLWFW-UHFFFAOYSA-N 381.476 3.760 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3ccc4nccnc4c3)SC2=S)c1 54361140 MIWPTZOROZRDJT-SXGWCWSVSA-N 393.449 3.734 10 40 GHCB COc1ccc(N(CCC(N)=O)Cc2cc3ccc(OC)cc3nc2Cl)cc1 14703199 KFPPTANZGPLEJO-UHFFFAOYSA-N 399.878 3.787 10 40 GHCB O=C(/C=C/c1ccc(N2CCCCCC2)cc1)N1CCN(c2ccccn2)CC1 12632304 PCNWNVXGGMCZBW-JLHYYAGUSA-N 390.531 3.824 10 40 GHCB COc1ccc(N2CCN(c3nnc(SCc4ccccn4)s3)CC2)cc1 23140013 CJQWFIFPKZPLGE-UHFFFAOYSA-N 399.545 3.561 10 40 GHCB CCN1CCc2cc(/C=C3\C(=O)N(Cc4ccccc4)C(=O)N=C3O)ccc21 1846843 QTUUCIRHIZAKGL-AQTBWJFISA-N 375.428 3.571 10 40 GHCB COc1ccccc1N1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1 53175223 CQVXDHCPTSWSCL-UHFFFAOYSA-N 383.879 3.925 10 40 GHCB CCCN1C(=O)/C(=C/c2cc(Br)cc(Cl)c2OC)NC1=S 409092534 WWHKUZHWIHZPKS-WDZFZDKYSA-N 389.702 3.579 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4cccc(Cl)c4)[nH]n3)CC2)cc1 46455135 PJJKIOQZWVIBPK-UHFFFAOYSA-N 396.878 3.701 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=O)NN(c3cccc(Cl)c3)C2=O)c(OC)c1 23402575 BTFFHRPQBYDBKY-WQRHYEAKSA-N 399.878 3.656 10 40 GHCB Cc1cc(C)cc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)NC2=S)c1 408812965 CFPLUUWSFGNMOF-WOJGMQOQSA-N 389.480 3.626 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/C=C/c1ccco1 409107536 WRNXYDDWPBLIHB-VFVQNCPYSA-N 377.183 3.809 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3cccc(Cl)c3)N=C2C)c([N+](=O)[O-])c1 100535675 PLQJZXNBEODRGC-XNTDXEJSSA-N 386.795 3.975 10 40 GHCB CC(C)(C)c1cn2nc(NCc3ccc(N4CCC(CO)CC4)cc3)sc2n1 52446650 NLTWATPILCQUOQ-UHFFFAOYSA-N 399.564 3.909 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(-c2ccccc2)o1 2222769 XKRCJJKKRRTTHX-SFQUDFHCSA-N 376.343 3.752 10 40 GHCB Cc1ccc2nc(C[C@H]3CN(Cc4ccccc4O)CC[C@H]3CC(=O)O)[nH]c2c1 514288919 LKSFCUNIADOOTK-WMZOPIPTSA-N 393.487 3.732 10 40 GHCB biogenic,in-vitro CC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)c(C)s2)cc1 5392691 QUEAWDDPHBFBLN-UHFFFAOYSA-N 387.486 3.878 10 40 GHCB Cc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1N1CCCC1 19716202 OERZHNPJPIXAOV-LJQANCHMSA-N 393.531 3.923 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)NC[C@@H]1CCCO1 8748260 GOVCROOZZHJTHG-KRWDZBQOSA-N 397.500 3.579 10 40 GHCB CC[C@H](C)c1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 5034470 RVSGHJRMKCMCIP-CPOQMQJTSA-N 391.471 3.933 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)cc1 1774376 YGOHAESPIBTEAU-ZROIWOOFSA-N 386.410 3.699 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(-c2ccccc2)o1 13571712 XKRCJJKKRRTTHX-ATVHPVEESA-N 376.343 3.752 10 40 GHCB CCCn1cc(/C=C2\C(=O)N=C(O)N(Cc3ccccc3)C2=O)c2ccccc21 2375266 FLEUZOSQWCXRON-CPNJWEJPSA-N 387.439 3.918 10 40 GHCB CC(=O)Nc1ccc(NC2=NC(=O)/C(=C/c3cccc([N+](=O)[O-])c3)S2)cc1 5520246 TUGAGACEQKUDDC-YBEGLDIGSA-N 382.401 3.636 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(Cc3ccccc3)C(C)=C2C(=O)OC)c1O 6964920 APIXKAVKDABYGH-AQTBWJFISA-N 393.439 3.664 10 40 GHCB O=C1/C(=C/c2cccc([N+](=O)[O-])c2)SC(=S)N1CCOc1ccccc1 9188783 UCBMLIOIEPJYDM-VBKFSLOCSA-N 386.454 3.875 10 40 GHCB Cc1cc(N2CCCC2)c(F)cc1/C=c1\sc2nc3ccccc3n2c1=O 33540522 BMRLCJGDERTTDV-UNOMPAQXSA-N 379.460 3.505 10 40 GHCB O=C(NCCCSc1nccs1)c1ccc(-c2nc(C3CC3)n[nH]2)cc1 72312766 QNELNVVHOZXRJW-UHFFFAOYSA-N 385.518 3.718 10 40 GHCB Cc1ccc(C)n1N1C(=O)/C(=C\c2cc3ccccc3oc2=O)SC1=S 8558446 BDFLHWYIUOXBCO-MHWRWJLKSA-N 382.466 3.749 10 40 GHCB COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)Nc1ccc(F)cc1 112121755 NKQLTZCDDHKLCI-UNOMPAQXSA-N 385.370 3.617 10 40 GHCB O=C(O)c1cccc(-c2ccc(/C=C3/NC(=O)N(Cc4ccccc4)C3=O)o2)c1 15008983 TWALHXHOOIFRGH-LDADJPATSA-N 388.379 3.738 10 40 GHCB Cc1ccc(S(=O)(=O)N2C(=O)/C(=C\c3ccccc3)SC2=S)cc1 5545474 GMUDXQWGNCRWDG-RVDMUPIBSA-N 375.496 3.585 10 40 GHCB O=C(Cc1ccccc1)NN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S 5551882 KQKRKRJIJUWSKI-GDNBJRDFSA-N 388.901 3.815 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)c2ccc3c(c2)OCO3)cc1 5643757 COCIFLYSPFAOFJ-UHFFFAOYSA-N 377.396 3.863 10 40 GHCB CCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 6747941 FZGVMXGBCYZWDS-JOCHJYFZSA-N 382.504 3.973 10 40 GHCB COc1ccc(N(Cc2ccccc2)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 11606509 PKSTVRKIBJHTDE-UHFFFAOYSA-N 391.427 3.909 10 40 GHCB O=C1N=C(O)/C(=C/c2ccc(O)cc2)C(=O)N1c1cccc(C(F)(F)F)c1 16994650 YNGKDPLQOXRAQT-ZSOIEALJSA-N 376.290 3.918 10 40 GHCB CCOc1ccc(C(=O)O)cc1/C=C1\C(=O)N(c2ccccc2C)C(=O)N=C1O 33417608 QZIIQOQCENUWDR-PTNGSMBKSA-N 394.383 3.599 10 40 GHCB Cc1cc(/C=C2/C(=O)N(C3CCCCC3)C(=O)N=C2O)c(C)n1C[C@H]1CCCO1 59109235 YPYRTFIMKLXAEV-LSCADSNKSA-N 399.491 3.919 10 40 GHCB Cc1ccc(C(=O)NCC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1C 10963020 UGZSKTDUTIXVSU-UHFFFAOYSA-N 393.531 3.682 10 40 GHCB Cc1ccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)NC(=S)N3C)c2C)nc1 222748523 USHSVLMXKDTNDK-PMACEKPBSA-N 377.517 3.795 10 40 GHCB COc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(Cl)c(Cl)c2)C1=O 6166119 SLUMYRNDCAWEKH-FLIBITNWSA-N 391.210 3.668 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 408903048 OJZATTZFXAGKTI-RNEAKCBISA-N 382.391 3.669 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 222836001 YGCWZLXSAIRMER-CQSZACIVSA-N 377.510 3.567 10 40 GHCB COc1cc(N2CCCC2)c(OC)cc1/C=C1\SC(=O)N(C(C)C)C1=O 1006003 QCCOXUGMJVOMNQ-YVLHZVERSA-N 376.478 3.749 10 40 GHCB COc1ccc2c(c1)c(=O)oc1c(C)c(OCC(=O)N3CCC[C@H](C)C3)ccc12 4540358 PPLAJPOKTUCMSU-AWEZNQCLSA-N 395.455 3.901 10 40 GHCB CCOc1cccc(/C=C2\C(=O)N(c3ccccc3)C(C)=C2C(=O)OC)c1O 6964941 DKFAGJVJELOHQE-LGMDPLHJSA-N 379.412 3.668 10 40 GHCB COc1ccc(N2CCN([C@@H](c3cccs3)[C@@H](C)NC(=O)C3CC3)CC2)cc1 23181578 UWNHEZYWERCZFZ-IIBYNOLFSA-N 399.560 3.535 10 40 GHCB Cc1cccc(NC(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)c1C 30675738 UVKIRUDFNOYILI-UHFFFAOYSA-N 377.444 3.901 10 40 GHCB O=C1c2ccccc2C(=O)c2c1oc1c3c(ccc21)OCN(C[C@H]1CCCO1)C3 49563738 WSCPPQUBHLUYHW-CYBMUJFWSA-N 389.407 3.539 10 40 GHCB CCCCCOC(=O)CN1C(=O)/C(=C\c2ccc(OC)cc2)SC1=S 5214250 OBDLMMPACUMZKX-RVDMUPIBSA-N 379.503 3.630 10 40 GHCB CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 5374206 KRLJBJDTZMANLB-QBQSQJOESA-N 386.292 3.514 10 40 GHCB CCCN1CCC2(CC1)Oc1ccccc1[C@@H]1CC(c3cc(O)ccc3O)=NN12 10214226 KRWHOTIMQFGYOZ-FQEVSTJZSA-N 393.487 3.843 10 40 GHCB CCOc1ccc(/C=C2/C(=O)NC(=S)N(c3cccc(C)c3C)C2=O)cc1 15013460 WGKGBVCPRDPGJV-ATVHPVEESA-N 380.469 3.533 10 40 GHCB COc1cccc(N/C(C)=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c1OC 112124236 YHZPFPXBUSYZII-PDGQHHTCSA-N 396.403 3.721 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 408895767 VRXSIVOLPDUVJW-BOPFTXTBSA-N 382.347 3.611 10 40 GHCB CCCC1=NN2C(=N)/C(=C/c3cccn3-c3ccc(OC)cc3)C(=O)N=C2S1 13280947 JBHGPXUCKIAZBU-MWSJVPHRSA-N 393.472 3.905 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\c1cccn1-c1ccccc1 13551991 LBJWOFLODUDDOT-AQTBWJFISA-N 391.814 3.797 10 40 GHCB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NCCc1ccc(F)cc1 18244322 JIXVRCXKJWHHGK-UYRXBGFRSA-N 382.395 3.563 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1ccc(F)cc1 408891881 DNZVQWBCGWFFAX-UNOMPAQXSA-N 381.403 3.707 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(Cl)cc3)C2=O)cc1Cl 408990249 WMCUYJPEUUIYMB-ZSOIEALJSA-N 375.211 3.968 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)cc1 1786553 MGJOLBLDGBXFNU-QRYYFKOISA-N 383.494 3.892 10 40 GHCB COc1ccc(NC(=O)Cn2c(CCC(=O)O)ccc2-c2ccccc2)cc1 5000380 JUOAWQDUJXKCCD-UHFFFAOYSA-N 378.428 3.820 10 40 GHCB CC1(C)OC(=O)C(=Cc2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)C(=O)O1 5415332 GRKHDVDWRMRUFT-UHFFFAOYSA-N 377.736 3.728 10 40 GHCB COc1cccc(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 9422541 HCPVACTUZFMELD-UHFFFAOYSA-N 386.407 3.521 10 40 GHCB O=C1NC(=S)N=C(O)/C1=C\c1ccc2c(c1)CCN2Cc1ccccc1Cl 17208849 PNVVBTXCBFYHNN-UHFFFAOYSA-N 397.887 3.657 10 40 GHCB COC(=O)c1ccc(C)c(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)c1 408813634 DKMGSCBIGMXSSG-YVLHZVERSA-N 384.457 3.855 10 40 GHCB Cc1ccc(COc2cccc(/C=C3\SC(N4CCOCC4)=NC3=O)c2)cc1 13547643 IDRCOZUQLJOZAM-ZHZULCJRSA-N 394.496 3.877 10 40 GHCB Cc1ccc(C(C)(C)O[C@@H]2CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@@H]23)cc1 103115409 HWBQGRFPUCBOTB-YFVAEKQCSA-N 392.451 3.995 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 260795960 NIWUQLOTIJNECK-UONOGXRCSA-N 377.510 3.567 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(Br)c3nsnc23)SC1=S 1776010956 LCJUZMGEZFRMQJ-VMPITWQZSA-N 386.321 3.675 10 40 GHCB CCCOc1ccc2ccccc2c1/C=C1\SC(=S)N(CC(=O)O)C1=O 34902630 JGVQDEHBANIDEY-YBEGLDIGSA-N 387.482 3.914 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1ccccc1OC 408999944 LWVCJLVGGDULNU-UYRXBGFRSA-N 393.439 3.577 10 40 GHCB CC1=NN2C(=N)/C(=C/c3cc(C)n(-c4cccc(F)c4)c3C)C(=O)N=C2S1 33666840 IDNJLCMOZQKWQH-UMDJYDDXSA-N 381.436 3.872 10 40 GHCB CC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)c1 35040245 STPKVTDWWSXIOP-CXUHLZMHSA-N 383.450 3.993 10 40 GHCB O=C1c2ccccc2C(=O)C1c1ccc(CN2C(=O)c3ccccc3C2=O)cc1 105436036 LLTOCFHFBVLSRN-UHFFFAOYSA-N 381.387 3.646 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C\c1ccccc1 409064586 DLFBWYXVRCGVOD-ATVHPVEESA-N 379.412 3.581 10 40 GHCB CCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2CC)C1=O 408874060 ZAMSDKUICHTRFN-VBKFSLOCSA-N 398.846 3.968 10 40 GHCB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(-c2ccccc2Cl)o1 2215319 ZOSROTOQIPMLSC-XNTDXEJSSA-N 396.786 3.855 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1cccc(F)c1 6348281 AHVIZVPTUCRDAL-ZHZULCJRSA-N 395.430 3.750 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc(OC)cc1OC 660187 AQNARJZFYXGEEQ-PDGQHHTCSA-N 379.412 3.581 10 40 GHCB COc1ccccc1-n1c(C)cc(/C=C2/C(=N)N3N=C(C)SC3=NC2=O)c1C 34690181 JHADVHIWNKIZMQ-AHSZANDNSA-N 393.472 3.742 10 40 GHCB O=C1c2ccccc2C(=O)c2c1cccc2S(=O)(=O)Nc1cccc(Cl)c1 4181481 BMDKJUYFZDKUEZ-UHFFFAOYSA-N 397.839 3.916 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(C(C)(C)C)c3C)C2=O)cc1 408963145 AHCYUWAWPUSTAH-LDADJPATSA-N 379.460 3.835 10 40 GHCB CC(C)OC(=O)CN1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2)C1=O 205757790 PXLIYBQSDZHOPY-SFQUDFHCSA-N 388.489 3.665 10 40 GHCB COc1ccc(CC(=O)c2ccc(O)c(CN3CCC(C)CC3)c2O)cc1OC 23135346 KLQYUQMDIHPNTI-UHFFFAOYSA-N 399.487 3.772 10 40 GHCB biogenic O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(=O)c2ccccc2o1 6496416 LBCUUROJNSIYRB-UHFFFAOYSA-N 395.370 3.821 10 40 GHCB Cc1oc2c(CN3CCN(C)CC3)c(O)ccc2c(=O)c1-c1ccc(Cl)cc1 20439627 UXLJUUYMZSLDDZ-UHFFFAOYSA-N 398.890 3.875 10 40 GHCB biogenic CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2)C1=O 4457097 JEWXWNNYVNMTQJ-DLRWLJPMSA-N 388.489 3.665 10 40 GHCB COc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCCC2)cc1 13007666 UHZULVIZUSFVKB-HSZRJFAPSA-N 393.531 3.645 10 40 GHCB O=C(C1=CN(c2cccc(F)c2)c2ccccc2S1(=O)=O)N1CCCCC1 48988471 YBNLFBWGHCAIBY-UHFFFAOYSA-N 386.448 3.605 10 40 GHCB C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc21 208222165 RKIQXARDWMMXQH-UXYFDLPDSA-N 390.530 3.694 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2F)o1 408601601 KSDABLNBJFZRGY-LFIBNONCSA-N 394.333 3.891 10 40 GHCB Cc1cccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)O)C3=O)c2C)c1C 409145101 PYFXRYAMTAGTBI-RQZCQDPDSA-N 384.457 3.832 10 40 GHCB CCCN1C(=O)/C(=C\c2cc(Br)ccc2OC)C(C(=O)OC)=C1C 409205366 HQFGDUOXBLBZPT-UVTDQMKNSA-N 394.265 3.540 10 40 GHCB COc1ccc(CN2C(=O)[C@@H](Cc3ccc(OC)c(C)c3)SC2=S)cc1 8336398 YPFKRKVYTGIMFN-GOSISDBHSA-N 387.526 3.984 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc(C(F)(F)F)cc3)C2=O)c1 408901308 XCTBNVFVTHKHFR-MHWRWJLKSA-N 388.345 3.989 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)C(C(=O)OC)=C2C)cc1 409000053 MHDDXHZOZDUPTG-ZHZULCJRSA-N 393.439 3.971 10 40 GHCB CN1C(=O)/C(=C\c2cc([N+](=O)[O-])ccc2Sc2ccccn2)SC1=S 6273977 KDAPLUHXECUNIF-UKTHLTGXSA-N 389.483 3.972 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c1OC 12625270 LQIIUTOFNVIWSN-KAMYIIQDSA-N 395.502 3.550 10 40 GHCB COc1ccccc1C(=O)NC[C@@H](c1ccc2c(c1)CCN2C)N1CCCCC1 13007750 NBCWDSVAHGXZNW-QFIPXVFZSA-N 393.531 3.645 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc2cc(C)cnc12 25059716 QODLVVTZOJZYEO-UHFFFAOYSA-N 383.517 3.820 10 40 GHCB Cc1ccc(C(=O)N2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)cc1 33444732 HRGLGRQGOOWUMC-XNTDXEJSSA-N 384.438 3.945 10 40 GHCB COc1cc(/C=C2/C(=N)N3C(c4ccc(F)cc4)=CSC3=NC2=O)ccc1O 41083586 WBVGYMHIMFBRAS-FPPDEWAKSA-N 395.415 3.844 10 40 GHCB Cc1ccc(CN2C(=O)N/C(=C/c3cc(C)n(-c4ccncc4)c3C)C2=O)cc1 409249619 UXGIUMLGHWWXIB-FYJGNVAPSA-N 386.455 3.890 10 40 GHCB CC(=O)c1cccc(N2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)c1 2702152 YZHKDIRREBBTSX-NXVVXOECSA-N 380.450 3.617 10 40 GHCB COc1cccc(-n2c(C)cc(/C=C3/C(=N)N4N=C(C)SC4=NC3=O)c2C)c1 41108118 AJLATQCKIYRCIG-GSTYNNIKSA-N 393.472 3.742 10 40 GHCB CCN1C(=O)/C(=C/c2cc(Br)cc(OC)c2OC)SC1=S 409382925 YDYKBLRAWHNHEQ-WDZFZDKYSA-N 388.308 3.687 10 40 GHCB COc1ccccc1NC(=O)Cn1c(CCC(=O)O)ccc1-c1cccs1 4784044 ZFMUWCMTEUUFTQ-UHFFFAOYSA-N 384.457 3.881 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C/c2ccc(N(C)C)cc2)S1 54164389 JOQVSGKKJRQJLO-YVLHZVERSA-N 381.457 3.842 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)NC2=S)c1C 409137097 TXPOTBMIWUWJCA-MHWRWJLKSA-N 375.453 3.616 10 40 GHCB O=C(O)C[C@@H](c1ccccc1)N1C(=O)/C(=C/c2cccc(O)c2)SC1=S 1787852 ZBJMXVOFRVUGRG-HEUOVEHFSA-N 385.466 3.809 10 40 GHCB COc1cccc(OCCOc2cccc(/C=C3\SC(=S)NC3=O)c2)c1 13940186 ANDCOMOYJGXFSD-BOPFTXTBSA-N 387.482 3.642 10 40 GHCB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1cccc(Cl)c1Cl 408891899 FAHQFFBJYBUZKW-CKXDQPNJSA-N 396.270 3.845 10 40 GHCB Cc1cc2c(cc1C=C1C(=O)N(C)C(=O)N(C)C1=O)[C@H](C)CC(C)(C)N2C(C)C 223598851 WJRGJTFCJCHAGN-OAHLLOKOSA-N 397.519 3.929 10 40 GHCB COc1ccccc1NC(=O)CN1C(=O)/C(=C/c2cccs2)SC1=S 1256325 JACILMGOGWRKOA-ZROIWOOFSA-N 390.511 3.597 10 40 GHCB Cc1cc(C(=O)[C@@H](C)OC(=O)C2=COCCO2)c(C)n1-c1ccc(Cl)cc1 3545491 QAOGACSISNJOKR-CQSZACIVSA-N 389.835 3.750 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)Cc2cnn(-c3ccccc3)c2)cc1 32894853 NOOCTLSZBYBMQU-UHFFFAOYSA-N 376.504 3.920 10 40 GHCB CC(C)N1c2ccc(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2[C@@H](C)CC1(C)C 223563463 YZMCKMNCUCPCHG-AWEZNQCLSA-N 399.560 3.786 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1cccc(OC)c1 408989627 UMKBPKZPGYUOKT-UNOMPAQXSA-N 379.412 3.581 10 40 GHCB CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1 1241480 SFCAAAFQLVNFSR-FQEVSTJZSA-N 378.476 3.636 10 40 GHCB COc1cc2c(cc1O)[C@@H](CSC)Cc1cc3c(cc1N(C)CC2)OCO3 1563975 SHZPKHCRSMQQSP-OAHLLOKOSA-N 387.501 3.811 10 40 GHCB COc1cccc(/C=C2\SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)c1 5373624 QQGAEKSROSAUHO-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB CCOC(=O)NCCC(=O)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 48678476 PEWDFMWXNORKML-QFIPXVFZSA-N 392.455 3.887 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 1059590 LTJCAOUYCWAOSI-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB CC(=O)O[C@H](C)c1cc2c(s1)C(=O)c1scc([C@@H](C)OC(C)=O)c1C2=O 1652352 JFEMGTTXNHRUOR-HTQZYQBOSA-N 392.454 3.833 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1nccs1 5370810 OMCANQATVKVWKG-XOHVCTMJSA-N 387.511 3.539 10 40 GHCB Cc1ccc(COc2ccc(/C=C3/SC(N4CCOCC4)=NC3=O)cc2)cc1 5371061 CABJKJRLUJAFOS-XSFVSMFZSA-N 394.496 3.877 10 40 GHCB COc1cc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)cc(OC)c1O 7165914 IULKLAZKUXFUNY-DHDCSXOGSA-N 391.445 3.954 10 40 GHCB CCOc1ccccc1C(=O)NC[C@H](c1ccc2c(c1)CCN2C)N1CCCC1 8963228 HEYLJOHIYCXWLO-JOCHJYFZSA-N 393.531 3.645 10 40 GHCB CC(=O)N(c1cccc(C)c1)c1c(O)cc(O)c2c1C(=O)c1ccccc1C2=O 15085923 XJTZSYKWZHMIJO-UHFFFAOYSA-N 387.391 3.866 10 40 GHCB COCCn1c(-c2ccc(C)cc2)cnc1SCC(=O)Nc1nccs1 44085894 AREHULOVPJIUQV-UHFFFAOYSA-N 388.518 3.692 10 40 GHCB COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C)cn3)c2C)C1=O 409246324 BALQWECUYNYXOB-GZTJUZNOSA-N 385.489 3.870 10 40 GHCB CCN(CC)c1ccc(CNn2c(S)nnc2-c2ccccc2OC)cc1 7365429 GIFPWNGAJHONGZ-UHFFFAOYSA-N 383.521 3.832 10 40 GHCB CCCN1C(=O)/C(=C\c2cc(OC)c(O)cc2Br)SC1=S 4699334 XSAOQUICHZHTQM-WUXMJOGZSA-N 388.308 3.775 10 40 GHCB Cc1nnc(S/C(=C/c2cc(C)n(-c3ccc(N(C)C)cc3)c2C)C(=O)O)[nH]1 4687787 RQWCSITUHFWHBA-WOJGMQOQSA-N 397.504 3.804 10 40 GHCB CCOC(=O)CN1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S 1277079 JJVAUISFQCPVBC-WDZFZDKYSA-N 376.286 3.758 10 40 GHCB O=C(O)COc1cccc(/C=C2/SC(Nc3cccc(Cl)c3)=NC2=O)c1 16909756 SLPUMPUMJODLLM-OVCLIPMQSA-N 388.832 3.886 10 40 GHCB CCOC(=O)[C@H]1CCCN(C2=NC(=O)/C(=C\c3ccc(Cl)cc3)S2)C1 4580515 LLFQUIJEQNOOTM-LERPTODRSA-N 378.881 3.585 10 40 GHCB CC(=O)c1ccc(NC2=NC(=O)/C(=C\c3nc4ccccc4n3C)S2)cc1 5236026 GLKKQBZPBLTWIO-GZTJUZNOSA-N 376.441 3.858 10 40 GHCB Cc1ccc(/C=C2\SC(=S)N(CCC(=O)Nc3ccc(O)cc3)C2=O)cc1 13576681 KYHGCBQIXPPJEM-ATVHPVEESA-N 398.509 3.931 10 40 GHCB COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc(Br)c1O 17242067 IVQPKLDOZSUSJC-ZSOIEALJSA-N 387.233 3.969 10 40 GHCB CSc1ccc(/C=C2/C(=N)N3N=C(N4CCC(C)CC4)SC3=NC2=O)cc1 41084665 XITGZZISMSTPNH-GQECEEOXSA-N 399.545 3.717 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)c1 408868093 MKFNHEDJOCGQGX-MDWZMJQESA-N 391.210 3.668 10 40 GHCB COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1cccc(OC)c1O 409017320 MRUMJVGUYIIFOT-PDGQHHTCSA-N 393.439 3.895 10 40 GHCB CN(C)c1ccc(CN2CCC[C@]3(CC2)CN(c2ccccc2)C(=O)CO3)cc1 1615128466 KEXRYHUYZLWIOS-DEOSSOPVSA-N 393.531 3.541 10 40 GHCB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(-c2cccc(C(=O)O)c2)o1 857519 LAUCFHPLHGZNHA-UHFFFAOYSA-N 382.368 3.789 10 40 GHCB CN(C)c1ccc(CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)cc1 6570614 NQKFTYTUUBVDFD-UHFFFAOYSA-N 392.830 3.903 10 40 GHCB Cc1cccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1C 6747959 QHZKRNBCAAROPO-JOCHJYFZSA-N 396.531 3.956 10 40 GHCB Cc1cc(C2=NN=C(NC[C@@H]3CCCO3)SC2)c(C)n1-c1ccc(F)cc1 7985348 CZZJXSDVDWQZIW-KRWDZBQOSA-N 386.496 3.809 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(C3CCCC3)C(C)=C2C(=O)OC)cc1OC 33595930 ZGKLSDGCMQMJJN-ATVHPVEESA-N 385.460 3.709 10 40 GHCB CC(C)(C)OC(=O)N[C@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)C=[N+]=[N-] 77953797 LCJFXSXAVBSADP-LJQANCHMSA-N 395.459 3.571 10 40 GHCB C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(N2CCOCC2)cc1 113945426 YXDKIRGKKPOJQL-SFHVURJKSA-N 390.483 3.760 10 40 GHCB CN(C)C(=O)c1ccc(NC(=S)NCc2ccc(N3CCCCC3)cc2)cc1 225418637 JRHQHWQQDWZWCP-UHFFFAOYSA-N 396.560 3.865 10 40 GHCB CC(C)C[C@H](NCc1c(O)ccc2c(-c3ccccc3)cc(=O)oc12)C(=O)O 4026330 KKAMOXGUTPOGNY-SFHVURJKSA-N 381.428 3.755 10 40 GHCB biogenic CC1=C(C(=O)O[C@@H]2CC[C@@H](C)[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 4043519 PGIBQQKMAPFGKC-VLBMKZOESA-N 385.508 3.748 10 40 GHCB CN(CC(=O)Nc1ccccc1C(F)(F)F)Cc1cc2c(cc1O)CCC2 6209214 VPEGQDJJWGFMDB-UHFFFAOYSA-N 378.394 3.970 10 40 GHCB COC(=O)c1cccc(NC(=S)NCc2ccc(N3CCCCC3)cc2)c1 225417588 SOILCTRKOZYCNH-UHFFFAOYSA-N 383.517 3.950 10 40 GHCB CCOC(=O)[C@@H]1CCCN(C2=NC(=O)/C(=C\c3ccc(Cl)cc3)S2)C1 4580514 LLFQUIJEQNOOTM-QQFZQELXSA-N 378.881 3.585 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3cccc4nccnc34)SC2=S)c1 13735293 BGJDWLZVDPOAOK-GDNBJRDFSA-N 393.449 3.734 10 40 GHCB CCCCCCOc1c(Cl)cc(C=C2C(=O)NC(=O)NC2=O)cc1Cl 408538402 MHIMFDWLYNKODT-UHFFFAOYSA-N 385.247 3.702 10 40 GHCB O=C(O)C[C@@H]1CCN(Cc2ccccc2O)C[C@@H]1Cc1nc2ccc(F)cc2[nH]1 514289615 WSBFIOPZUANCBY-HOCLYGCPSA-N 397.450 3.563 10 40 GHCB biogenic,in-vitro COC(=O)c1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C)cc1 924732 ZBIPTBSDOCKRFD-UHFFFAOYSA-N 381.457 3.605 10 40 GHCB Cn1cc(/C=C2/C(=O)N(c3cccc(F)c3)C(=S)N=C2O)c2ccccc21 1243491 BZNHVPKYKRIRPH-CXUHLZMHSA-N 379.416 3.989 10 40 GHCB O=C1/C(=C2\SC(=S)N(C3CCCC3)C2=O)SC(=S)N1C1CCCC1 5374820 SQNMWYFRSBOCNC-VAWYXSNFSA-N 398.600 3.804 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\Nc1nc2ccc(Cl)cc2s1 5603847 HFVYFGPSZUCIDK-XFXZXTDPSA-N 398.831 3.529 10 40 GHCB O=C1N=C(O)/C(=C\c2c[nH]c3ccccc23)C(=O)N1CCc1ccc(F)cc1 8994683 SROBZTHPSXUDJE-GZTJUZNOSA-N 377.375 3.852 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3ccc(F)cc3)N3CCCCC3)ccc21 13007720 XJTJWOCXKFVVGI-JOCHJYFZSA-N 381.495 3.775 10 40 GHCB Cc1ccc(C(C)(C)O[C@H]2CC(=O)C[C@@H]3C(=O)c4cccc(O)c4C(=O)[C@H]23)cc1 101168292 HWBQGRFPUCBOTB-CUWPLCDZSA-N 392.451 3.995 10 40 GHCB Cc1cc(/C=C2\NC(=S)N(C3CCCCC3)C2=O)c(C)n1-c1cccnc1 409086300 QHMFZTHGQGFOGI-UNOMPAQXSA-N 380.517 3.879 10 40 GHCB COc1cc(N2CCCC2)ccc1/C=C1/NC(=O)N(Cc2ccccc2F)C1=O 409074507 MILXAPTYHNNZEQ-XDHOZWIPSA-N 395.434 3.527 10 40 GHCB N=C1/C(=C\c2ccc3c(c2)OCO3)C(=O)N=C2SC(C3CCCCC3)=NN12 1174913 SFBDCKHLMNVGPJ-HOMCDIFHSA-N 382.445 3.615 10 40 GHCB CN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)c(Cl)c3)o2)C(=O)NC1=S 5879176 LSTFRUKQMGJIRK-JXMROGBWSA-N 381.240 3.510 10 40 GHCB COc1ccc2ccccc2c1/C=C1/C(=O)NN(c2ccc(Cl)cc2)C1=O 33343653 PYNCSKTWUGLVCT-PDGQHHTCSA-N 378.815 3.963 10 40 GHCB COc1ccc(N2CCN(C(=O)CCn3ccc4ccc(F)cc43)CC2)cc1 13688783 KXVMAOZXMLYESW-UHFFFAOYSA-N 381.451 3.528 10 40 GHCB COC(=O)c1ccc(/C=C2/SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)cc1 35043232 SFQZTDROSAVFNX-GZTJUZNOSA-N 395.440 3.514 10 40 GHCB COC(=O)c1cccc(-c2ccc(C=C3C(=O)OC4(CCCCC4)OC3=O)o2)c1 58865522 NDKTURBPKABQOI-UHFFFAOYSA-N 396.395 3.877 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3ccc(C)cc3)C2=O)cc1 408966582 PHEKLGCVGSWPJI-XSFVSMFZSA-N 385.423 3.761 10 40 GHCB COc1cccc(CN2CC3(CCOCC3)[C@@H]2c2cnn(C(C)(C)C)c2)c1O 585093513 VIAZWJBUPPBDGE-FQEVSTJZSA-N 385.508 3.706 10 40 GHCB O=S(=O)(Nc1nccs1)c1ccc(NCc2cc(Cl)ccc2O)cc1 793992 ZYXOXRVBILGFMQ-UHFFFAOYSA-N 395.893 3.915 10 40 GHCB CCc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c1C 2454461 YYQPNLRVWMRTRM-VGZNWPKRSA-N 377.473 3.906 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C/c1ccccc1F 35043276 KHIVGLJUAYFDMT-QGOAFFKASA-N 385.439 3.757 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc2c(c1)OCO2 59435720 ZFDQMZGYKPEMTE-SXGWCWSVSA-N 397.814 3.946 10 40 GHCB O=C(CN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OC1CCCCC1 1239049 LPQKQWLCHOBYTO-XNTDXEJSSA-N 379.478 3.903 10 40 GHCB Cc1ccc(NC(=O)CSc2ccc(/C=C3\SC(N)=NC3=O)cc2)cc1 15057053 BMOQEDWGOYHGTA-YBEGLDIGSA-N 383.498 3.655 10 40 GHCB COC(=O)c1cc2ccccc2c(CN2CCN(c3ccccc3F)CC2)c1O 16834508 SYZMKAQIDKTKGE-UHFFFAOYSA-N 394.446 3.793 10 40 GHCB Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\Nc3cccc(C)c3C)C2=O)c(C)c1 408535650 UCUCXQCYXOGPQL-GZTJUZNOSA-N 377.444 3.808 10 40 GHCB CCCOc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(OCC)cc3)C2=O)cc1 408896664 HARCQXSCPHXKSN-RGEXLXHISA-N 394.427 3.541 10 40 GHCB COc1ccccc1/C=C1/SC(=S)N([C@@H](C(=O)O)c2ccccc2)C1=O 1452291 LAVUPXNADVCYTE-RBFDBLARSA-N 385.466 3.722 10 40 GHCB COc1ccc(Br)cc1C=C1C(=O)OC2(CCCCC2)OC1=O 58865815 RJZZETZFURHTDV-UHFFFAOYSA-N 381.222 3.602 10 40 GHCB CC1CCN(c2ccc([C@@H](C)NC(=O)[C@H]3COc4ccccc4O3)cc2)CC1 218298879 RMODPWGEDDOMMG-VGOFRKELSA-N 380.488 3.940 10 40 GHCB COC(=O)C1=CN(c2ccc(C)c(C)c2)c2cc(F)c(F)cc2S1(=O)=O 35462700 XZQTUACVLVFJSO-UHFFFAOYSA-N 379.384 3.521 10 40 GHCB CN1CCc2c(sc3c2C(=O)N[C@H](c2cc(Cl)cc(Cl)c2O)N3)C1 20101332 GMPHDVGWIINCED-AWEZNQCLSA-N 384.288 3.603 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3cnc4ccccc4n3)SC2=S)cc1 54361183 ASFIZTONCTXEEV-SXGWCWSVSA-N 393.449 3.734 10 40 GHCB CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c1 408876945 RXDZPRRLPJRDJV-LICLKQGHSA-N 384.819 3.714 10 40 GHCB Cc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)c(C)n1-c1ccc(C(N)=O)cc1 409023985 OSUCBFVYJHAZRL-LICLKQGHSA-N 383.473 3.638 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N3c4ccccc4C[C@H]3C)sc2n1 10644879 IIGSAWHBVGOGTM-CYBMUJFWSA-N 395.484 3.630 10 40 GHCB COc1ccc(-n2c(C)cc([C@H]3NC(N)=Nc4nc5ccccc5n43)c2C)cc1 12571296 LZQFNAZMDIQWTN-FQEVSTJZSA-N 386.459 3.549 10 40 GHCB COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(/C)NCc1ccccc1Cl 17081395 YGCJOVKOBIQKLR-ZHZULCJRSA-N 397.862 3.670 10 40 GHCB COc1ccc(/C=C2/SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)cc1OC 35042557 PNLXGCMOANAONS-RQZCQDPDSA-N 398.440 3.793 10 40 GHCB COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=C2\SC(=O)N(C)C2=O)c1C 408816961 WVUCWGVEHXGURP-PXNMLYILSA-N 387.417 3.677 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCCC3)c(F)c2)C(=O)N1Cc1ccccc1 409240527 QFKINTQDLSFNEZ-XMHGGMMESA-N 379.435 3.909 10 40 GHCB COc1cc(/C=C2\SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)ccc1O 409344300 IUXDZWWDWXDNJL-NVNXTCNLSA-N 388.426 3.715 10 40 GHCB CC(C)c1ccc(N/C=C2/C(=O)NC(=S)N(Cc3ccccc3)C2=O)cc1 2371211 YBGFXCYMUUBDBM-PDGQHHTCSA-N 379.485 3.549 10 40 GHCB O=C1NC(=O)N(C2CCCCCC2)C(=O)/C1=C/Nc1cccc(C(F)(F)F)c1 5050924 JJUXUMQDNJTBOP-RVDMUPIBSA-N 395.381 3.802 10 40 GHCB COc1ccccc1C1(O)CCN(Cc2ccc(N3CCCC3)c(F)c2)CC1 12328329 WATLQBCVNOFVAX-UHFFFAOYSA-N 384.495 3.918 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)c1ccc(Cl)cc1 40940241 GVTRWBIOCWJDRI-NTEUORMPSA-N 390.873 3.592 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCCN2CCc3ccccc32)c1C 225560542 FMGTVGDLNGYZNS-UHFFFAOYSA-N 397.544 3.911 10 40 GHCB Cc1cc(C(=O)NCc2ccc(C(=O)N(C)C)cc2)c(C)n1-c1ccccc1F 42660176 LITGILYEODDQFD-UHFFFAOYSA-N 393.462 3.865 10 40 GHCB COc1cccc(NC(=O)CN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1266479 JTKCTCRTOBRQEE-ZROIWOOFSA-N 390.511 3.597 10 40 GHCB CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2COc3ccccc3O2)cc1 28580649 VWZHQWGVUWGYIW-JOCHJYFZSA-N 392.455 3.714 10 40 GHCB CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C\c1cccc(Cl)c1Cl 408770043 RZZJVSIFXMDKMB-RAXLEYEMSA-N 384.259 3.703 10 40 GHCB Cc1[nH]c2ccccc2c1/C=C1\C(=O)NC(=O)N(CCC2=CCCCC2)C1=O 2289792 CKGVFVBKQTXKRI-QGOAFFKASA-N 377.444 3.829 10 40 GHCB O=C(NC1=NN(c2ccccc2)C(=O)/C1=C1\CCCCCN1)Nc1ccccc1 102229801 RLHHSDOYXJEXMJ-VHEBQXMUSA-N 389.459 3.586 10 40 GHCB COCCN1C(=O)/C(=C\c2cccc(Oc3ccccc3)c2)C(C(=O)OC)=C1C 6348318 CJSHMRGELRTKDE-HKWRFOASSA-N 393.439 3.798 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C/c3c(C)n(C)c4ccccc34)C2=O)c1 4498193 KEYSESGTZPYXQJ-UNOMPAQXSA-N 387.439 3.770 10 40 GHCB COc1ccc(/C=C2\SC(=O)N([C@H](C(=O)O)C(C)C)C2=S)cc1OC 5171676 IETKGPSICQYDQT-MQJVFOOVSA-N 381.475 3.650 10 40 GHCB COc1cc(/C=C2\SC(=S)N(CCc3ccc(O)cc3)C2=O)ccc1O 54360743 CALSETLNPOWBQE-BOPFTXTBSA-N 387.482 3.550 10 40 GHCB COC(=O)[C@@H](C)N1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S 1276935 NTSVWXCYASQJKB-KLDHPSGWSA-N 376.286 3.756 10 40 GHCB CC(=O)O[C@@H](C)c1csc2c1C(=O)c1cc([C@@H](C)OC(C)=O)sc1C2=O 1652354 JFEMGTTXNHRUOR-JGVFFNPUSA-N 392.454 3.833 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)c1 2340654 YJAGKAKQSFHYKI-ZROIWOOFSA-N 381.438 3.667 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(Br)c1 14099556 ZNDFOLCSTWKHKN-UHFFFAOYSA-N 397.338 3.726 10 40 GHCB Cc1ccc(C(C)(C)O[C@@H]2CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@H]23)cc1 101168285 HWBQGRFPUCBOTB-QFUCXCTJSA-N 392.451 3.995 10 40 GHCB O=C1/C(=C\c2cccc(F)c2)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1 408718843 AOZWHNPMTLYRAV-RIYZIHGNSA-N 388.401 3.776 10 40 GHCB CCn1cc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)c2ccccc21 2278963 IGNSBUAPDSWGHL-RVDMUPIBSA-N 393.443 3.632 10 40 GHCB Cc1cc(C(=O)OCC(=O)NCc2ccccc2)c(C)n1-c1ccc(F)cc1 3349682 OBCDZQWTTUGCFG-UHFFFAOYSA-N 380.419 3.706 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1/C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 4723731 SQFQNHXGCQXWSD-KAECEXQPSA-N 398.459 3.834 10 40 GHCB CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1O[C@@H](C)CC 409409940 XXVNSEJGEAESCC-LUJRCDHRSA-N 380.444 3.724 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(OCc2ccccc2)cc1 1455670 OTYYFMZBTVDVOL-RGEXLXHISA-N 380.469 3.568 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)CCC(=O)c3ccccc3)cc2F)C[C@@H](C)O1 48365410 SKLPOZAARUQOMB-CALCHBBNSA-N 398.478 3.719 10 40 GHCB O=C1/C(=C\c2ccc([N+](=O)[O-])o2)SC(=S)N1c1cccc([N+](=O)[O-])c1 113834456 DMFOKSLDULPPGA-YRNVUSSQSA-N 377.359 3.502 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CNc3ccc(OC)cc3)C2=O)cc1 3044321 MTIJBWJDCMVRCE-BOPFTXTBSA-N 386.498 3.975 10 40 GHCB CCOc1cc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)ccc1O 1780684 ZIOOTNADEVWEKM-RVDMUPIBSA-N 395.502 3.637 10 40 GHCB COc1ccccc1COC[C@H](O)CN(Cc1ccco1)Cc1ccccc1O 3394635 AKZURUOWLYNVIC-HXUWFJFHSA-N 397.471 3.574 10 40 GHCB COc1ccc(/C=C2\SC(=S)NC2=O)cc1COc1ccc(F)cc1 15930782 TZOPNSOSZCNGPA-SXGWCWSVSA-N 375.446 3.902 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccnc1 37865608 PNCUEXXAJVGZDW-UVTDQMKNSA-N 389.527 3.763 10 40 GHCB CN1C(=O)/C(=C\c2cc(Cc3ccccc3)cc([N+](=O)[O-])c2O)SC1=S 59417915 GIEFMFUDJVPDHE-XNTDXEJSSA-N 386.454 3.722 10 40 GHCB CC(C)[C@@H]1CC(=O)Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c21 96115761 BTPCABAYRDUCFJ-NSHDSACASA-N 382.368 3.626 10 40 GHCB biogenic COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(C(=O)OC)cc1 408892816 JUCXRJHUXZBANH-UYRXBGFRSA-N 391.423 3.659 10 40 GHCB CN1C(=O)/C(=C/c2cn(Cc3ccc(F)cc3)c3ccccc23)C(O)=NC1=S 59182153 HJGKEEVWQGGOTR-LICLKQGHSA-N 393.443 3.926 10 40 GHCB Cc1c(O)c(CN(C)C)cc2c(-c3cc4ccccc4oc3=O)cc(=O)oc12 2159604 MMOCWRTZXXMUFK-UHFFFAOYSA-N 377.396 3.642 10 40 GHCB biogenic CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1c(F)cccc1Cl 16134433 YQDAXUABSVQCTE-UHFFFAOYSA-N 376.859 3.517 10 40 GHCB O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)c2ccncc12 52446555 CVYQEEKDRHFPQK-UHFFFAOYSA-N 392.459 3.964 10 40 GHCB COc1ccc(C(=O)N2CCN(Cc3cc(C(C)C)c(C)cc3O)CC2)cc1 25475301 VUZKHVPTIZZCKX-UHFFFAOYSA-N 382.504 3.791 10 40 GHCB COc1ccc(SCC(=O)NCc2ccc(N3CCCC3)cc2)cc1OC 20036639 LJLCIYHJCUZLEF-UHFFFAOYSA-N 386.517 3.713 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)c2ccccc12 1177699 RKANHWWVUGDTAJ-QGOAFFKASA-N 378.428 3.643 10 40 GHCB O[C@]1(c2ccccc2)CN(c2ccc(Br)cc2)C2=[N+]1CCCS2 17178366 JPGQJXLJBPAGIL-SFHVURJKSA-N 390.326 3.620 10 40 GHCB CCN1C(=O)N/C(=C/c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 6630176 TYMYXINDSVNAFN-CXUHLZMHSA-N 388.265 3.769 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C\c3ccc4nccnc4c3)SC2=S)c1 13690585 MIWPTZOROZRDJT-CXUHLZMHSA-N 393.449 3.734 10 40 GHCB O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\C=C\c2ccco2)SC1=S 27533577 XUMNCGLQAXIZJU-ZQHJZNAFSA-N 385.466 3.733 10 40 GHCB O=C1NC(=S)N(c2ccccc2Cl)C(=O)/C1=C/c1c[nH]c2ccccc12 4823054 YHHJDNMMEYRZDO-UKTHLTGXSA-N 381.844 3.653 10 40 GHCB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 10907224 PJISWGYYKLERID-MRXNPFEDSA-N 388.895 3.603 10 40 GHCB COc1cc([C@H]2CC(c3c(C)cc4oc(=O)c(C)c(C)c4c3O)=NN2)ccc1O 12296828 UTKWCMYNMXQZJE-CQSZACIVSA-N 394.427 3.577 10 40 GHCB biogenic CCOC(=O)c1cccc(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)c1 408808099 DCZLBYGWGPOOIX-BOPFTXTBSA-N 384.457 3.937 10 40 GHCB CCOC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 408836500 RWMIXJFGFQISOH-AQTBWJFISA-N 384.432 3.990 10 40 GHCB C[C@@H](NC(=S)Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 140018160 JHRGDKRKCRNHGH-CYBMUJFWSA-N 377.460 3.849 10 40 GHCB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 13646980 YYPVNGDHDQBTPZ-GOSISDBHSA-N 396.531 3.904 10 40 GHCB Cc1ccc(COc2cccc(/C=C3/SC(N4CCOCC4)=NC3=O)c2)cc1 5371058 IDRCOZUQLJOZAM-XSFVSMFZSA-N 394.496 3.877 10 40 GHCB COc1ccc(N2CCN([C@H](c3cccs3)[C@H](C)NC(=O)C3CC3)CC2)cc1 23181583 UWNHEZYWERCZFZ-KKSFZXQISA-N 399.560 3.535 10 40 GHCB O=C1/C(=C\c2cccc(Br)c2)SC(=S)N1C[C@H]1CCCO1 1288059 HIROVLNEBLWMHZ-FMNNIJNLSA-N 384.320 3.829 10 40 GHCB COC(=O)c1cccc(-n2c(CCC(=O)O)ccc2-c2ccc(OC)cc2)c1 2621729 MNRILLBYKFMTTO-UHFFFAOYSA-N 379.412 3.957 10 40 GHCB CC(C)c1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)C(=O)NC2=S)cc1 409246536 CNAFXOJMKJYBLQ-UYRXBGFRSA-N 393.512 3.707 10 40 GHCB COC(=O)[C@H](C)N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S 1276929 HBUDRVUVXYXJTQ-SYFUPATCSA-N 376.286 3.756 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c1 408941441 WOXINMONFFTKJO-ATVHPVEESA-N 384.819 3.795 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)O)C3=O)c2C)cc1C 409137651 XQDWPQNHKGMZIX-RQZCQDPDSA-N 384.457 3.832 10 40 GHCB O=C(CN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc(F)c1 6132507 OGWMDOAMSCFISX-MDWZMJQESA-N 378.475 3.727 10 40 GHCB O=C(Nc1ccc(Cl)cc1)c1cnn2c(O)cc(Cc3ccsc3)nc12 100776111 XUMVRADJCCJYCY-UHFFFAOYSA-N 384.848 3.993 10 40 GHCB Cc1cc(C(=O)Nc2ccc(CCO)cc2)c(C)n1-c1ccc2c(c1)OCCO2 126514507 SWGUDYDCMKZAAG-UHFFFAOYSA-N 392.455 3.652 10 40 GHCB O=C1OC(c2ccccc2)OC(=O)C1=Cc1ccc(-c2ccc(C(=O)O)cc2)o1 4655848 IDAABZBVRWBQKZ-UHFFFAOYSA-N 390.347 3.827 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\Nc1ccc(Cl)cc1Cl 5603843 XQLJSYXJGKFYHY-XFXZXTDPSA-N 376.199 3.572 10 40 GHCB COc1ccc(N2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)CC2)cc1 7642934 QHHGWMYMWGABSI-UHFFFAOYSA-N 378.394 3.605 10 40 GHCB CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(Br)cc2)cc1 225880843 QUXFGLIXGVRYRX-UHFFFAOYSA-N 397.338 3.774 10 40 GHCB Cc1cc(F)ccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C)C2)cc1 260801589 GVATYJCAXSFPKL-HNNXBMFYSA-N 376.497 3.849 10 40 GHCB COc1ccc(N2CCN(C[C@@H](O)c3ccc(C(F)(F)F)cc3)CC2)cc1 51092649 VCSNTPALGPDVIM-LJQANCHMSA-N 380.410 3.570 10 40 GHCB CCN1C(=O)/C(=C\c2cn(CC(=O)OC(C)C)c3ccccc23)SC1=S 9235809 FUBQWCOPQNTZRQ-CXUHLZMHSA-N 388.514 3.814 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)cc1 24885569 HLMYKULFJAJPCJ-UHFFFAOYSA-N 383.473 3.718 10 40 GHCB CN(C)c1ccc(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1 65596852 QNDKTMSFDIHVFW-UHFFFAOYSA-N 375.419 3.745 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)c1 974440 VYLVQHCHCKOKFL-CHHVJCJISA-N 385.422 3.519 10 40 GHCB O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/C=C/c1ccco1 980463 XPWBUEHPRHCINX-VFVQNCPYSA-N 393.251 3.974 10 40 GHCB CCc1ccc(-c2noc(CN3CCN(c4ccc(OC)cc4)CC3)n2)cc1 57798729 YBTBEPVAFMZGED-UHFFFAOYSA-N 378.476 3.630 10 40 GHCB CCCCNC(=O)CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S 8911461 GOBGGTGKPCENMK-SDNWHVSQSA-N 382.938 3.848 10 40 GHCB CCc1ccc(N2C(=O)/C(=C\c3ccc(N4CCCCC4)o3)C(=O)N=C2O)cc1 8743693 OMMNPDSPLXLNKE-JXAWBTAJSA-N 393.443 3.703 10 40 GHCB CCCN1C(=O)N/C(=C/c2cc(C)n(-c3cccc(C(=O)OCC)c3)c2C)C1=O 409241375 SBEXTXWAZWJEOO-CPNJWEJPSA-N 395.459 3.574 10 40 GHCB Cc1cc(C(=O)CSc2nncs2)c(C)n1-c1ccc2c(c1)OCCO2 3352526 CUPSBPLZDTXDGH-UHFFFAOYSA-N 387.486 3.692 10 40 GHCB COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccco3)SC2=S)cc1 4745461 PULKOYXUXYDENC-RVDMUPIBSA-N 388.470 3.518 10 40 GHCB COc1ccc(C2=NN(C(C)=O)[C@@H](c3cc(Br)ccc3O)C2)cc1 5044013 AFYOJVLGKVDXRY-QGZVFWFLSA-N 389.249 3.861 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OC)cc2OC)SC1=S 5371363 XTWYRRIJMBWDTD-GRRFOWRYSA-N 395.502 3.548 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CN3CCCCCC3)C2=O)cc1OC 16227140 NFHIHECIVCVESB-ATVHPVEESA-N 392.546 3.739 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OCc4ccc(F)cc4)cc3)C(=N)N2O1 41078310 HUTMLOWPHRDYBD-FNGBSHHDSA-N 377.375 3.855 10 40 GHCB Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)ccc1F 260801505 AKWMRWUOOQIVNC-HNNXBMFYSA-N 376.497 3.849 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/NCCc1ccccc1 102881306 WHNZCPQPKWGOJS-XDJHFCHBSA-N 378.432 3.814 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c1 408870663 UEUUHKUCIUCIMW-OVCLIPMQSA-N 391.210 3.668 10 40 GHCB CN(CCCNC(=O)CSc1ncc(-c2ccccc2)n1C)c1ccccc1 7105683 DHYITPOBIMRVBD-UHFFFAOYSA-N 394.544 3.822 10 40 GHCB COc1cc(C)c(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1C(C)C 408913431 UKRVVYKKMMLGQC-VCHYOVAHSA-N 396.418 3.933 10 40 GHCB CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccn2)c1C 222774216 XCUGYBADPQHZHG-WOJBJXKFSA-N 377.517 3.877 10 40 GHCB Cc1ccc(SCCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 95482550 SVJSTXOLEOBAKA-UHFFFAOYSA-N 383.561 3.545 10 40 GHCB CC1CCN(C(=O)CN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)CC1 5370782 JYQXAOMHVYLKCV-WIXUPIFPSA-N 386.542 3.703 10 40 GHCB Cc1ccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCC2)cc1C 8963336 YYSOUVOUFWZKPX-HSZRJFAPSA-N 377.532 3.863 10 40 GHCB COc1ccc(Br)cc1CN(C)Cc1cc2c(cc1O)OCO2 3546938 WQFIGEFQJWIWHD-UHFFFAOYSA-N 380.238 3.524 10 40 GHCB CCOC(=O)c1ccc(NC(=S)NCCN(C)c2ccc(C)cc2)c(C)c1 225796311 CCQVSUCZXDHFSN-UHFFFAOYSA-N 385.533 3.903 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(OC(C)C)cc3)C2=O)c1C 408812822 MKONGGHFJGIKTH-LDADJPATSA-N 378.428 3.757 10 40 GHCB Cc1cccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C=CSC4=NC3=O)cc2)c1 4690651 UFKDPNIETWJPHT-SABKFZPKSA-N 389.436 3.991 10 40 GHCB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1cccc(Cl)c1Cl 408891900 FAHQFFBJYBUZKW-GFAPJHNFSA-N 396.270 3.845 10 40 GHCB Cc1cccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)Nc3cc(C)on3)c2C)c1 16056053 IQOVGLTVTWXASG-INIZCTEOSA-N 381.432 3.883 10 40 GHCB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)Nc3cccc(Cl)c3)ccc21 5234088 IPDSSCIOAMFMSQ-UHFFFAOYSA-N 397.839 3.916 10 40 GHCB O=S(=O)(Cc1ccc(Cl)cc1)NCc1ccc(N2CCCCC2)cc1 10113267 WXNIHLWWPPOCQC-UHFFFAOYSA-N 378.925 3.950 10 40 GHCB CCOC(=O)c1c(NC(=O)CC2(C(=O)O)CCCC2)sc2c1CCCC2 13255018 KJUJXXCFQBNVMB-UHFFFAOYSA-N 379.478 3.777 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)c3cn(C)c4ccccc34)cc2F)C[C@H](C)O1 65475758 GTRURBXULHNHMT-HOTGVXAUSA-N 395.478 3.861 10 40 GHCB O=C(O)c1cc(NS(=O)(=O)c2cc(Cl)c(Cl)cc2Cl)ccc1O 226855862 FOQBDEGJBJEOOO-UHFFFAOYSA-N 396.635 3.851 10 40 GHCB O=C(O)c1ccc(N/C=C2/SC(=S)N(CCc3ccccc3)C2=O)cc1 9422153 HYORKLALNQEAEK-FOWTUZBSSA-N 384.482 3.741 10 40 GHCB COC(=O)C1=C(C)N(Cc2cccnc2)C(=O)/C1=C\c1ccc(SC)cc1 33613187 AFTZEFMOWANXMG-WQRHYEAKSA-N 380.469 3.676 10 40 GHCB CCN(CC)c1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cc1 1452588 SGJLFPWANRLALC-QINSGFPZSA-N 378.519 3.599 10 40 GHCB C[C@@H](N/C=C1\C(=O)N=C(S)N(CCC2=CCCCC2)C1=O)c1ccccc1 102552122 JCMLTNOVOJIXNP-LWFDYCOSSA-N 383.517 3.766 10 40 GHCB Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)c1 409250297 QKSWNAYYNQGXIG-XYOKQWHBSA-N 376.890 3.850 10 40 GHCB CC1CCN(C2(NC(=O)c3ccc(Cl)cc3)C(=O)c3ccccc3C2=O)CC1 226297549 UNRLJCXZDUHHNW-UHFFFAOYSA-N 396.874 3.577 10 40 GHCB CCCOc1c(Br)cc(/C=C2\SC(=S)NC2=O)cc1OC 15912598 BFRADXOVLZVHPQ-XFFZJAGNSA-N 388.308 3.735 10 40 GHCB CCCCC(=O)OCC(=O)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O 5415970 CSTHFWJWKPVJQV-UHFFFAOYSA-N 399.830 3.787 10 40 GHCB O=C1/C(=C\c2cccnc2)SC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 6970939 HRPDDIZOEMBZFS-FRKPEAEDSA-N 399.541 3.530 10 40 GHCB CCc1cc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1Cl 7256104 STLIYYJDJVMZSL-UHFFFAOYSA-N 388.895 3.639 10 40 GHCB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 857517 XJAFOYFKSLLAQT-UHFFFAOYSA-N 383.356 3.999 10 40 GHCB COc1ccc2ncc(/C=C/[C@]34NC(=O)CN3c3ccccc3C4(C)C)cc2c1 3999928 AAHHTLIZFZOYIZ-LTDXDOBXSA-N 385.467 3.881 10 40 GHCB biogenic O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccs2)SC1=S 6133306 YXNAFKSTVBIXPB-LFGHMXSPSA-N 375.496 3.645 10 40 GHCB O=C(CN1C(=O)c2cccc3cccc1c23)NCc1ccc(N2CCCC2)cc1 13675394 KKWUDAAESNZRLL-UHFFFAOYSA-N 385.467 3.717 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C/c2cccc([N+](=O)[O-])c2)S1 20265130 TWCMQDRVQNHNBI-NVNXTCNLSA-N 383.385 3.684 10 40 GHCB COc1ccc(N2CCOCC2)c(NC(=O)COc2cc(C)ccc2C(C)C)c1 20528654 DVJHFMHGPOZSLN-UHFFFAOYSA-N 398.503 3.981 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1cccc(C(F)(F)F)c1 39995686 XCFWOHVFRSCCGS-UHFFFAOYSA-N 392.421 3.743 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)NC2CCN(Cc3ccccn3)CC2)cc1 53990753 GOTPPDXWMVRMFB-UHFFFAOYSA-N 388.515 3.884 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@H]1[C@@H](c2ccccn2)N=C2S[C@@H](C)CN21 222597064 YKFXZAXSVNLPJE-DQLDELGASA-N 394.544 3.816 10 40 GHCB O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(Cl)cc1Cl 408911818 DNQYQESBQALYCG-AWNIVKPZSA-N 379.174 3.799 10 40 GHCB N=C1Nc2nc3ccccc3n2[C@@H](c2cc(Cl)cc(Br)c2O)N1 575442886 DEECMNORASODAB-ZDUSSCGKSA-N 392.644 3.655 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)cc1Cl 4682276 ATNCNVASFPJZIE-DGGAMASNSA-N 399.834 3.579 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2cccc(Cl)c2)C1=O 408868809 OXYDKBNMOOSFQK-UKTHLTGXSA-N 375.211 3.968 10 40 GHCB CC(=O)N1CCC2(CC1)Oc1ccccc1[C@@H]1CC(c3cc(C)ccc3O)=NN12 10214039 GQJDMGAFFOIWIE-FQEVSTJZSA-N 391.471 3.583 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 101141980 YSDORKWRXDYONX-MHWRWJLKSA-N 395.375 3.838 10 40 GHCB O=C1N=C(O)/C(=C\c2cccn2Cc2ccccc2F)C(=O)N1Cc1ccco1 13896914 IRZWBSFVDXWTFQ-GZTJUZNOSA-N 393.374 3.771 10 40 GHCB CCN1c2cc(C)c(C=C3C(=O)N(C)C(=S)N(C)C3=O)cc2[C@@H](C)CC1(C)C 113792250 NAWSKXJYDYCSOI-AWEZNQCLSA-N 399.560 3.706 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)cc1 1510999 IAPKMUYRQWMAFB-GHRIWEEISA-N 398.509 3.925 10 40 GHCB CC(C)c1ccc(S(=O)(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc1 5652994 KKZUJEVEEMNEDS-GFCCVEGCSA-N 392.546 3.896 10 40 GHCB Cc1cc(C(=O)COC(=O)c2cn3ccccc3n2)c(C)n1-c1ccc(F)cc1 4404988 YYYAWLJLFAPQGU-UHFFFAOYSA-N 391.402 3.921 10 40 GHCB COCCCN1C(=O)S/C(=C/c2ccc(N3CCCCC3)cc2OC)C1=O 409234096 LUPNQIIDDVGEMH-QGOAFFKASA-N 390.505 3.758 10 40 GHCB CN1CCN(c2ccc(CNc3ccc(C(=O)NC(C)(C)C)cc3)cc2F)CC1 1256460999 SISNHISOCRFEAF-UHFFFAOYSA-N 398.526 3.718 10 40 GHCB CCC(C)(C)[C@H]1CCc2c(sc(NC(=O)CCC(=O)O)c2C(=O)OC)C1 2747119 MZPJOUHEFLOPGD-NSHDSACASA-N 381.494 3.879 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(O)cc3O)c2C)cc1 6534613 KMJLJIUOISIIGY-UHFFFAOYSA-N 395.411 3.554 10 40 GHCB Cc1cc(C)cc(N2C(=O)/C(=C\c3ccc(N4CCCC4)o3)C(=O)N=C2S)c1 8739930 CXZLDKARDIAXAY-ATVHPVEESA-N 395.484 3.739 10 40 GHCB COc1ccc(N2CCN(C3=NC(=O)/C(=C/c4cccc(C)c4)S3)CC2)cc1 7499887 IZRJHQCOLVURCE-HKWRFOASSA-N 393.512 3.796 10 40 GHCB Oc1cc2c(cc1[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)OCO2 19358636 AWQPMEGCCWPTRI-GOSISDBHSA-N 381.350 3.561 10 40 GHCB Cc1cc(C)c(C)c(O[C@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 22511466 GTCUNPAKPLYREO-LJQANCHMSA-N 382.504 3.532 10 40 GHCB O=C1/C(=C/c2ccc(Br)cc2)SC(=S)N1CN1CCCC1 27830633 FLVWBIFESXOOBP-LCYFTJDESA-N 383.336 3.704 10 40 GHCB O=C(COc1ccc(Cl)cc1)NCc1ccc(N2CCSCC2)cc1 48368371 XPPHRRMKWQEANA-UHFFFAOYSA-N 376.909 3.588 10 40 GHCB Cc1cc(/C=C2\C(=O)N=C(S)N(C3CC3)C2=O)c(C)n1-c1ccc(Cl)cc1 103120228 NRXGZNZGEMVFAZ-LICLKQGHSA-N 399.903 3.948 10 40 GHCB COc1ccc(F)cc1S(=O)(=O)Nc1ccccc1C(=O)c1ccccc1 223694426 ZOAMRVSMDXQTFS-UHFFFAOYSA-N 385.416 3.866 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C/c3ccc(N(C)C)cc3)N(C)C2=S)cc1 409031107 IUZOWMGPOHMLDA-RGEXLXHISA-N 381.501 3.756 10 40 GHCB COc1cc(Br)cc([C@@H]2Nc3ccccc3C(=O)N2C2CC2)c1O 7886340 TYSDTEMBWOVZTR-QGZVFWFLSA-N 389.249 3.892 10 40 GHCB Cn1c(-c2ccccc2)cnc1SCC(=O)Nc1cccc2nsnc12 19105094 YUJCEBXUOUOSDI-UHFFFAOYSA-N 381.486 3.823 10 40 GHCB O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1c1cccc(F)c1 59417989 WJFXRZQOCAFDDF-VGOFMYFVSA-N 376.390 3.845 10 40 GHCB COc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O 408808946 GNSDJXGRCDCUNW-XYOKQWHBSA-N 391.210 3.668 10 40 GHCB O=C(/C=C/c1ccc(N2CCCCCC2)cc1)N1CCN(c2ccncc2)CC1 8122672 FMNQQULDQHTAFT-JXMROGBWSA-N 390.531 3.824 10 40 GHCB CC(/C=C1\SC(=S)N(CCCN2CCOCC2)C1=O)=C\c1ccccc1 13787368 ZGJZHZGPPWESHV-BEQKSFQUSA-N 388.558 3.556 10 40 GHCB CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1 53916313 WDPJGDQSFGUPJL-MRXNPFEDSA-N 381.501 3.877 10 40 GHCB O=C(NN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)c1cccs1 409348857 SWAGXSVZRYMUGX-RIYZIHGNSA-N 385.495 3.776 10 40 GHCB O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1cccc(O)c1 3066921 ORKYHLMEAPLQSG-LFIBNONCSA-N 384.482 3.622 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccco2)C(=O)/C1=C/c1c(F)cccc1Cl 408794298 ISSPUWYIMCYKSR-NTEUORMPSA-N 375.783 3.945 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 408894642 SAMDFINCNUHHTC-PDGQHHTCSA-N 377.396 3.570 10 40 GHCB COc1cc(/C=C2/C(=O)N(C(=O)c3ccccc3)N=C2C)cc(Cl)c1OC 408945875 XQTWXWWTJIWWCS-OQLLNIDSSA-N 384.819 3.799 10 40 GHCB CC[C@H](C)N1C(=O)/C(=C\c2ccc(Br)cc2)C(C(=O)OC)=C1C 409017086 WJVRUNRQKSKSTH-SAIXKJTDSA-N 378.266 3.920 10 40 GHCB CC(=O)NC1=NN(c2ccccc2)C(=O)[C@@H]1/N=N/c1cccc(C(F)(F)F)c1 101469843 REOJGFICRHLHSD-XGBCSFPLSA-N 389.337 3.654 10 40 GHCB Cc1cc(/C=C2\C(=N)N3N=CSC3=NC2=O)c(C)n1-c1ccccc1Cl 5477768 BRDSVHSPOSZAPW-HOMCDIFHSA-N 383.864 3.997 10 40 GHCB COc1ccc(N2CCN(Cc3cc(=O)oc4cc5c(cc34)CCC5)CC2)cc1 54105923 DXHZVHPPJPNPKY-UHFFFAOYSA-N 390.483 3.613 10 40 GHCB biogenic CC(C)(C)NC(=O)CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S 8911460 KGCGOFMXJNGYPI-JLHYYAGUSA-N 382.938 3.846 10 40 GHCB Cc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 6886900 ZZJZWOGDPCVWHN-UHFFFAOYSA-N 399.402 3.566 10 40 GHCB COC(=O)c1c(NC(=O)CC2(C(=O)O)CCCCCC2)sc2c1CCC2 13249709 NKUZITNHDJFSJR-UHFFFAOYSA-N 379.478 3.777 10 40 GHCB Cc1c(-c2ccc(Cl)cc2)c(=O)oc2c(CN3CCOCC3)c(O)ccc12 20605051 JGBMTWYWBCNSBS-UHFFFAOYSA-N 385.847 3.960 10 40 GHCB biogenic Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Br)cc3)C2=O)cc1C 59336681 FXVLSMVSJLSPNX-MHWRWJLKSA-N 399.244 3.732 10 40 GHCB O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(N2CCOC2=O)cc1 84403178 LOXJGYNVUTVIQP-UHFFFAOYSA-N 379.460 3.564 10 40 GHCB Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 222835944 YGCWZLXSAIRMER-AWEZNQCLSA-N 377.510 3.567 10 40 GHCB COc1ccc(N2COc3ccc4c5c(c(=O)oc4c3C2)CCC5)c(OC)c1 5345324 CJDUZDFJOHELSM-UHFFFAOYSA-N 379.412 3.655 10 40 GHCB Cc1cc(NC(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)no1 8725592 DMNWINSXJMCIRT-INIZCTEOSA-N 398.488 3.756 10 40 GHCB Cc1ccc(-c2ccc(/C=C3/C(=O)NN(c4ccccc4)C3=O)o2)cc1[N+](=O)[O-] 15008751 NXJQNKIWOBBRPO-ATVHPVEESA-N 389.367 3.625 10 40 GHCB COc1ccc(N(Cc2ccccc2)Cc2nn3c(=O)cc(C)nc3s2)cc1 22990386 YHCSAYHDUYWLCO-UHFFFAOYSA-N 392.484 3.675 10 40 GHCB COc1ccc(N2CCN([C@@H](C)C(=O)c3c[nH]c4ccccc34)C[C@H]2C)cc1 61947425 QBWWYEMWPYCDIA-SJORKVTESA-N 377.488 3.958 10 40 GHCB CCOc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1Br 4501857 KKEDMIZUGZZCDI-UHFFFAOYSA-N 381.222 3.602 10 40 GHCB COc1ccc(C2=NN(c3ccccc3)C(=O)/C2=C(/C)NCc2cccnc2)cc1 9059952 VWVOYOVOEHRAAP-XLNRJJMWSA-N 398.466 3.905 10 40 GHCB COc1cc(OC)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@H]1CCC[C@@](C)(O3)O1 13374851 UOWSTUZKQCORDT-MCMMXHMISA-N 396.395 3.535 10 40 GHCB endogenous,in-man CC1=NN(c2cccc(C)c2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 408529842 ICVQNDNURBWWFI-YVLHZVERSA-N 381.348 3.530 10 40 GHCB COc1ccc(C2=C/C(=C3/SC(=S)NC3=O)c3ccccc3O2)cc1OC 2340831 RMSMMRWANZZFPW-AQTBWJFISA-N 397.477 3.996 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(Br)cc1O 3864236 AWPAEDONTXBWED-RIYZIHGNSA-N 387.233 3.969 10 40 GHCB CCN1C(=O)/C(=C\c2cc(OC)c(OC)cc2Br)SC1=S 5926478 YEHVQTKYNVUELF-WUXMJOGZSA-N 388.308 3.687 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3cccc(C)c3)C(=O)N=C2O)c(OC)c1OC 9332129 LOFKCNDPUVIMFL-PTNGSMBKSA-N 396.399 3.528 10 40 GHCB O=C(O)C[C@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 12032243 ZXRRAMSVKQBQDA-VGVSSDJJSA-N 385.466 3.809 10 40 GHCB CN1CCc2cc([C@@H](CNC(=O)c3cccc(F)c3)N3CCCCC3)ccc21 13007729 VIGNEPMGRLNPNP-JOCHJYFZSA-N 381.495 3.775 10 40 GHCB CC(C)COc1ccc(/C=C2/C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1 15012822 AMWOPXHDAFYJLC-WQRHYEAKSA-N 398.459 3.692 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cccc(C(F)(F)F)c3)C2=O)c1 408782881 KYYYLILWFYSDEF-MHWRWJLKSA-N 388.345 3.989 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1Cl 408797607 GTKASBYSHXIUAM-NTEUORMPSA-N 384.819 3.632 10 40 GHCB Cc1oc2c(CN3CCC[C@@H]3C(=O)O)c(O)ccc2c(=O)c1Oc1ccccc1 4025669 HCLIJTCRAIZVIZ-QGZVFWFLSA-N 395.411 3.648 10 40 GHCB biogenic COC(=O)c1sc2nc(C(F)(F)F)c(C(=O)c3cccs3)cc2c1N 13653903 CAMMEHMNUXGENR-UHFFFAOYSA-N 386.376 3.976 10 40 GHCB COc1ccc(CCC(=O)NCc2ccc(N3CCCCC3)cc2)cc1OC 216395987 YMWXYNXSTZVFDH-UHFFFAOYSA-N 382.504 3.943 10 40 GHCB CCOC(=O)[C@H]1CCCN(C2=NC(=O)/C(=C/c3ccc(Cl)cc3)S2)C1 1068616 LLFQUIJEQNOOTM-OJNRTJSBSA-N 378.881 3.585 10 40 GHCB CCN1C(=O)C(=Cc2ccc(-c3ccc(F)cc3F)o2)C(=O)N(CC)C1=S 1406869 GJEMEZFCRGYJBE-UHFFFAOYSA-N 390.411 3.604 10 40 GHCB COc1ccc(-c2ccc(/C=C3\SC(=S)N([C@H](C)C(=O)O)C3=O)o2)cc1 5032391 ORTUCGOLAGIHNM-XBDQXEDDSA-N 389.454 3.630 10 40 GHCB COC(=O)c1ccc(/C=C2\SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)cc1 5372911 SFQZTDROSAVFNX-BOPFTXTBSA-N 395.440 3.514 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)O)[C@H](C)CC)C2=O)cc1 5373647 CHJJPBZLESNBNE-HVTJSOBYSA-N 379.503 3.786 10 40 GHCB CN(C1=NC(=O)/C(=C/c2c[nH]c3ccccc23)S1)c1ccccc1C(=O)O 5374513 CWHXZFUIORQRHT-YVLHZVERSA-N 377.425 3.973 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cc(C)ccc2C)C1=O 408806467 DZDOQTRQYLCYSC-GHRIWEEISA-N 378.428 3.759 10 40 GHCB COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2\SC(=O)N(C)C2=O)c1C 408820877 ABSCAGFBAQDIPS-PXNMLYILSA-N 387.417 3.677 10 40 GHCB O=C(c1ccc([N+](=O)[O-])o1)N1N=C(c2cccs2)C[C@H]1c1ccccc1O 4487161 YQTHNUMLGQDRLV-ZDUSSCGKSA-N 383.385 3.946 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1cccc(OC)c1 408891884 DREBVFWFMIFRCC-MOSHPQCFSA-N 393.439 3.577 10 40 GHCB COc1cccc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)c1OC 2253036 LQIIUTOFNVIWSN-SDNWHVSQSA-N 395.502 3.550 10 40 GHCB COc1ccc([C@]2(O)CN(c3cccc(C)c3C)C3=[N+]2CCCS3)c(F)c1 4086763 ZECBRKOKGPNOTB-OAQYLSRUSA-N 387.500 3.622 10 40 GHCB CC1=C(C(=O)O[C@@H]2CCC[C@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 5002900 AMOMSDKTONIICD-BOFPYLFWSA-N 387.549 3.667 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cccc(O)c3)c2C)cc1 6329550 SFBMIIHHZBEBNC-UHFFFAOYSA-N 379.412 3.848 10 40 GHCB COC(=O)C1=CN(c2cc(C)cc(C)c2)c2cc(F)c(F)cc2S1(=O)=O 35462698 FPMFMKYKIOIILP-UHFFFAOYSA-N 379.384 3.521 10 40 GHCB COc1ccc(-c2c[nH]c([C@@H]3COCCN3Cc3ccc(N(C)C)cc3)n2)cc1 67898799 OWEJUACJPHTKHQ-QFIPXVFZSA-N 392.503 3.725 10 40 GHCB biogenic,in-vitro COCCN1C(=O)S/C(=C\c2cc(C)n(-c3cccc(OC)c3)c2C)C1=O 409148353 PJRYWJZFCVGCAX-WQRHYEAKSA-N 386.473 3.785 10 40 GHCB COc1cccc(C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007761 TWYSSHXLZIFHOG-QHCPKHFHSA-N 393.531 3.645 10 40 GHCB CCOc1cc(/C=C2\SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)ccc1O 20227043 WXEIMIYTWMKYBV-MFOYZWKCSA-N 398.440 3.880 10 40 GHCB Cc1cc2c(cc1/C=C1\C(=O)NC(=S)N(C)C1=O)[C@@H](C)CC(C)(C)N2C(C)C 223587074 DXBHFNMKAQTNGX-FBJMNJBLSA-N 399.560 3.752 10 40 GHCB CCCOCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1OC 224417890 XVWFBARVNDOKHV-UHFFFAOYSA-N 398.503 3.593 10 40 GHCB CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/c1ccc2c(c1)OCO2 100163351 FBAYGSFZMKQHFB-MHWRWJLKSA-N 379.372 3.910 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 4688401 FFIGGBBHFAPHJZ-STZFKDTASA-N 390.483 3.934 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)C(C(=O)OC)=C2C)cc1 408768825 KPDKCTISPDWYQB-ZHZULCJRSA-N 393.439 3.971 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3cccc(O)c3)C(C(=O)OC)=C2C)cc1 408891710 BUBIOHDOZCDKJT-UYRXBGFRSA-N 379.412 3.668 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1C(=O)O 408998300 PVIYNLMZSAKWOL-PDGQHHTCSA-N 377.396 3.570 10 40 GHCB O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(Cl)ccn1 84350113 BVSPBYRSLNSROR-UHFFFAOYSA-N 399.800 3.520 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C\c1ccccc1F 5372956 KHIVGLJUAYFDMT-AQTBWJFISA-N 385.439 3.757 10 40 GHCB COCCn1c(-c2ccc(OC)cc2)cnc1SCC(=O)Nc1ccccc1 44085863 HKQAXMJTMGSNRR-UHFFFAOYSA-N 397.500 3.936 10 40 GHCB CCc1cccc(CC)c1N/C=C1/C(=O)NC(=S)N(c2ccccc2)C1=O 6198374 NWEAWEOIEXVYHL-LGMDPLHJSA-N 379.485 3.555 10 40 GHCB Cc1c(C)c2ccc(O)c(CN(C)C[C@H]3CCCN4CCCC[C@H]34)c2oc1=O 1565519804 HRDURUSTQFCTOI-YLJYHZDGSA-N 384.520 3.812 10 40 GHCB biogenic CCN1C(=O)N/C(=C/c2cc(C)n(-c3ccccc3Br)c2C)C1=O 4472488 AXKFJJUAQNIUNN-XNTDXEJSSA-N 388.265 3.769 10 40 GHCB O=C(Cc1ccccc1)NN1C(=O)/C(=C/c2cccc(Cl)c2)SC1=S 5551875 LXMOSPYKLCSGII-GDNBJRDFSA-N 388.901 3.815 10 40 GHCB Cc1ccccc1OCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 6747937 DBOUJQPVDFSXEE-OAQYLSRUSA-N 382.504 3.648 10 40 GHCB Cc1ccc(O)c(CN2CCC(c3cc(O)nc(-c4ccccn4)n3)CC2)c1 72392862 QFRMFWNIJCKFQF-UHFFFAOYSA-N 376.460 3.638 10 40 GHCB CC(=O)Nc1ccc(N/C=C2\C(=O)N(C3CCCCCC3)C(=O)N=C2O)cc1 103127354 PQARNAAXDQNNOG-ATVHPVEESA-N 384.436 3.582 10 40 GHCB Cc1c2c(cc3c4c(c(=O)oc13)CCC4)CN(c1ccc3c(c1)OCCO3)CO2 2118901 CPZKUIWFVJVJGA-UHFFFAOYSA-N 391.423 3.718 10 40 GHCB biogenic COc1ccccc1/C=C1\SC(=S)N(NC(=O)Nc2ccccc2)C1=O 3091895 HARCLPSYAIRFKV-PTNGSMBKSA-N 385.470 3.633 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)on3)CC2)cc1 11915669 DYLCJHCIRBLNSX-UHFFFAOYSA-N 397.862 3.966 10 40 GHCB Cn1cc(/C=C2\C(=O)N(c3cccc(F)c3)C(=S)N=C2O)c2ccccc21 17138224 BZNHVPKYKRIRPH-SXGWCWSVSA-N 379.416 3.989 10 40 GHCB COc1ccc(S(=O)(=O)Nc2nc(-c3cccc(OC)c3)cs2)cc1 28248525 ZPNKRBDFYFWEIM-UHFFFAOYSA-N 376.459 3.628 10 40 GHCB COc1ccc([C@@H]2CC(c3cc(Br)ccc3O)=NN2C(C)=O)cc1 97104969 PWARDDMHUPFRJP-KRWDZBQOSA-N 389.249 3.861 10 40 GHCB CC[C@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 222975868 KCBYKYCESRORSU-QFIPXVFZSA-N 395.547 3.529 10 40 GHCB COc1cc(/C=C2/SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCC(=O)O 16915422 LBQYEJWIMQOGFX-LICLKQGHSA-N 398.440 3.549 10 40 GHCB Oc1ccc(-c2nc3ccccn3c2Nc2ccc3c(c2)OCCO3)cc1O 35606419 FUIRFQQDHSRRGC-UHFFFAOYSA-N 375.384 3.927 10 40 GHCB CNC(=O)c1ccc(/C=C/C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 36396027 REGZAZYXAOXQTF-XNTDXEJSSA-N 391.515 3.708 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)Nc1cccc(C(=O)N2CCCC2)c1 40104793 HQTHGIPFVBOGCD-UHFFFAOYSA-N 380.492 3.653 10 40 GHCB C[C@H](NC(=S)Nc1c(F)cccc1F)c1ccc(N2CCOCC2)cc1 225838730 LWOCQOFFDRCMFZ-ZDUSSCGKSA-N 377.460 3.849 10 40 GHCB COC(=O)[C@@H](C)N1C(=O)/C(=C/c2c(OC)ccc3ccccc23)SC1=S 1239093 KXUUDEFDQPUWLX-FFCYNSPCSA-N 387.482 3.611 10 40 GHCB CC1=C(C(=O)Nc2cc(C)cc(C)c2)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1 4189215 URPKTGWJEJGRBO-FQEVSTJZSA-N 394.544 3.801 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)Nc3ccc4c(c3)OCO4)n2C)cc1 7423555 HMGVUFSDVJIDHM-UHFFFAOYSA-N 397.456 3.555 10 40 GHCB Cc1cc(/C=C/C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1C1CC1 8191829 WNPJZSJGRYBKGL-IZZDOVSWSA-N 393.531 3.948 10 40 GHCB COc1cccc(/C=C2\C(=O)NC(=S)N(c3cccc4ccccc34)C2=O)c1 8210242 BWOBAWCMEQGQIA-QGOAFFKASA-N 388.448 3.680 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(F)cc3)s2)SC1=S 14177079 KKJAWNQPCBISRG-NTUHNPAUSA-N 379.459 3.840 10 40 GHCB Cc1c(Cl)cccc1N1C(=O)NC(=O)/C(=C\c2cc(Cl)ccc2O)C1=O 408885755 AFOOBBHOAACCNB-XYOKQWHBSA-N 391.210 3.674 10 40 GHCB CCOC(=O)CSC1=NC(=O)/C(=C/c2ccc(Br)cc2)S1 819691 AFOSBQWWWZRDGY-XFFZJAGNSA-N 386.292 3.716 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 1417230 USAHODNQAJJJIC-RQZCQDPDSA-N 384.482 3.887 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C/c2ccc(C(F)(F)F)cc2)SC1=S 2209520 QGVJPYKOIXGERW-FLIBITNWSA-N 375.393 3.771 10 40 GHCB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc2c(c1)Cc1ccccc1-2 6229378 GHVNKFXAWRHKMP-BKUYFWCQSA-N 380.403 3.924 10 40 GHCB COc1ccc(N/C=C2/C(=O)N(c3ccc(C)c(C)c3)C(=O)N=C2O)c(OC)c1 102593269 LVCMGQLDNCPYJE-LFIBNONCSA-N 395.415 3.740 10 40 GHCB CN(C)c1ccc(CNC(=O)Cc2csc3nc(-c4ccccc4)cn23)cc1 12628989 ZFEXPILHEOYQIH-UHFFFAOYSA-N 390.512 3.988 10 40 GHCB CCOC(=O)c1cc(Br)cc(Br)c1/N=N\N(C)C 104188068 XHJSQIPQGRIXKF-PFONDFGASA-N 379.052 3.949 10 40 GHCB CC[C@H](C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)C=[N+]=[N-] 96330803 IUZBIAPAMJMEKV-QKKBWIMNSA-N 377.444 3.810 10 40 GHCB CC(C)(C)c1ccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)cc1 96935903 ZHSBRVKFPTUJLO-SAPNQHFASA-N 390.574 3.518 10 40 GHCB COc1cccc(C(=O)NC[C@H](c2ccc3c(c2)CCN3C)N2CCCCC2)c1 13007760 TWYSSHXLZIFHOG-HSZRJFAPSA-N 393.531 3.645 10 40 GHCB Nc1nc(N)c(/N=N/c2ccc(S(N)(=O)=O)cc2)cc1/N=N/c1ccccc1 17426581 BBTGLPAPGOMLPD-BQASJOSNSA-N 396.436 3.724 10 40 GHCB C#CCOc1c(Cl)cc(/C=C2\SC(=S)N(CC)C2=O)cc1OCC 6274665 AYCNUFDEZSIZTR-UVTDQMKNSA-N 381.906 3.972 10 40 GHCB C[C@@H](NC(=S)Nc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 225838751 XVMJBSWFMBLWPZ-CYBMUJFWSA-N 377.460 3.849 10 40 GHCB COc1ccccc1[C@H]1CC(c2c(C)cc3oc(=O)c4c(c3c2O)CCC4)=NN1 12391697 YCRHEGJJXXKDCE-MRXNPFEDSA-N 390.439 3.743 10 40 GHCB CC(=O)c1ccc(N2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)cc1 5371690 CIKLHMIZOIIGKK-YBEGLDIGSA-N 383.450 3.993 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(Cl)c3)C2=O)cc1Cl 408991265 ZOVSAQXBXGCVLT-ZSOIEALJSA-N 375.211 3.968 10 40 GHCB CCOc1ccccc1NC(=S)N[C@@H](C)c1ccc(N2CCOCC2)cc1 225838017 DIIUCCGJBAJHHE-INIZCTEOSA-N 385.533 3.970 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 1309840 IOWAKKKKQVUXGY-JXAWBTAJSA-N 392.411 3.510 10 40 GHCB Cc1cc(C(=O)NC[C@H]2COc3ccccc3O2)c(C)n1-c1ccccc1F 58391562 WWSRDKHYJJROAD-INIZCTEOSA-N 380.419 3.803 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)ccc1O 13343114 ZIOOTNADEVWEKM-PTNGSMBKSA-N 395.502 3.637 10 40 GHCB COC(=O)c1ccccc1NC(=O)CSc1nc2cc(Cl)ccc2[nH]1 6618183 KBGPMARXCYWDPO-UHFFFAOYSA-N 375.837 3.734 10 40 GHCB COc1ccc(-c2nnc([C@@H](C)N3CCN(c4ccc(OC)cc4)CC3)o2)cc1 57845275 OZHNBAACQBFICA-MRXNPFEDSA-N 394.475 3.637 10 40 GHCB O=C1NC(=S)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C/Nc1ccccc1 5660516 DPEDCRWXVQTBQF-NTEUORMPSA-N 392.267 3.737 10 40 GHCB COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cccc4ccccc34)CC2)cc1 13709136 XFXDFZMYPBEZQG-GOSISDBHSA-N 390.483 3.965 10 40 GHCB CC[C@H]1CN(Cc2ccc(OC)cc2O)CC[C@H]1CC(=O)NCc1ccccc1 5414404 KZCVZUGUGPNOHD-PMACEKPBSA-N 396.531 3.955 10 40 GHCB biogenic,in-vitro O=C(CCN1C(=O)/C(=C/c2ccccc2)SC1=S)Oc1ccccc1O 9764050 IGFZDBQZRAOTSC-VBKFSLOCSA-N 385.466 3.589 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@H](C(=O)NC3CC3)c3ccccc3)sc2n1 10645211 LYPIWNKTUHQIGR-KRWDZBQOSA-N 395.484 3.672 10 40 GHCB O=C1Nc2ccccc2S[C@@H]1[C@@H]1SC(=S)N(Cc2ccccc2)C1=O 1567433 UVLNNIKGDNAHSD-CABCVRRESA-N 386.523 3.529 10 40 GHCB O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C/c2cccc(F)c2)SC1=S 1774301 YOXUOPFXFNNIAV-CNYBTUBUSA-N 387.457 3.723 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 4082063 LJFNUDGBTCIGAF-UHFFFAOYSA-N 393.487 3.825 10 40 GHCB CCOc1ccc(-n2c(C)cc(C(=O)CSc3nnc(N)s3)c2C)cc1 5405054 XXHILZMNQPHYRY-UHFFFAOYSA-N 388.518 3.902 10 40 GHCB COc1ccccc1/C=C1/SC(N2CCN(c3ccccc3C)CC2)=NC1=O 15401568 CPNHNMWZEBXCHF-HMMYKYKNSA-N 393.512 3.796 10 40 GHCB Cc1cc(C(=O)CSc2nnc(N)s2)c(C)n1-c1ccc2c(c1)CCC2 7148670 MEKBHSYNEJOSCT-UHFFFAOYSA-N 384.530 3.992 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/Nc3ccc4c(c3)CCC4)C(=O)NC2=S)cc1C 9111056 YENZZDDMEZBLEB-XDHOZWIPSA-N 391.496 3.536 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S)N1CCCCC1 13801680 MDXBHZHVOMUWCA-QINSGFPZSA-N 394.949 3.944 10 40 GHCB CCOc1ccc([C@@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)cc1 17307539 SGHFRVFVJAVDIR-FQEVSTJZSA-N 389.928 3.909 10 40 GHCB COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1C 65795965 QPOOFBFISGSHQJ-UHFFFAOYSA-N 388.533 3.781 10 40 GHCB COc1ccc(N/C=C2\C(=O)N(c3ccc(C)c(C)c3)N=C2C)c([N+](=O)[O-])c1 100929772 UWLFBZWGUYYAER-BOPFTXTBSA-N 380.404 3.939 10 40 GHCB Cn1cc(/C=C2/SC(Nc3ccccc3C(=O)O)=NC2=O)c2ccccc21 20226941 MZWWMCQXGDZJBU-LICLKQGHSA-N 377.425 3.959 10 40 GHCB Cc1ccc(/C=C2\SC(N3CCN(Cc4ccccc4)CC3)=NC2=O)cc1 19842366 HBQKYULPFINXJD-HKWRFOASSA-N 377.513 3.783 10 40 GHCB Cc1ccc(Cl)cc1N1C(=O)NC(=O)/C(=C\c2ccc(Cl)cc2)C1=O 409209455 BSKHELFIRRWEED-RIYZIHGNSA-N 375.211 3.968 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(CC)cc2)C1=O 408807001 CLKOPNZLFNOYRC-NBVRZTHBSA-N 378.428 3.704 10 40 GHCB CCOc1cccc(/C=C2\SC(=S)N(NC(=O)c3cccs3)C2=O)c1 409347780 RGXMXQWEZDUDSX-UVTDQMKNSA-N 390.511 3.693 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccccc1I 39975992 QIEDBZFVCUGPFO-UHFFFAOYSA-N 394.256 3.629 10 40 GHCB CN(CCCNC(=S)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1 225748540 VTWOXDZYAKQRBH-UHFFFAOYSA-N 382.533 3.626 10 40 GHCB CCN(CCNC(=S)Nc1cccc(N2CCCC2=O)c1)c1ccc(C)cc1 225794332 XKVYCWXBMAFOGJ-UHFFFAOYSA-N 396.560 3.935 10 40 GHCB CCN1C(=O)c2cccc3c(S(=O)(=O)Nc4ccc(O)cc4C)ccc1c23 19923874 IUBXHLYJWALLRO-UHFFFAOYSA-N 382.441 3.635 10 40 GHCB COc1ccc(N2CCN(C3=NC(=O)/C(=C/c4ccc(C)cc4)S3)CC2)cc1 1443597 BFTYXXHSVZPRHA-HKWRFOASSA-N 393.512 3.796 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=S)N(c3ccccc3)C2=O)cc1Cl 408769102 NWSZCFZMYFRCQO-GXDHUFHOSA-N 386.860 3.570 10 40 GHCB C[C@H](NC(=O)c1ccc2c(c1)ncn2C1CC1)c1ccc(N2CCOCC2)cc1 19714335 KGXHVNQPZCWKHL-INIZCTEOSA-N 390.487 3.699 10 40 GHCB CN1C(=O)/C(=C/c2ccc(C(=O)OCCc3ccccc3)cc2)SC1=S 5374674 XMGYNQYMFQRXJZ-LGMDPLHJSA-N 383.494 3.917 10 40 GHCB CCCN1CCC2(CC1)Oc1ccccc1[C@H]1CC(c3cc(O)ccc3O)=NN12 10214228 KRWHOTIMQFGYOZ-HXUWFJFHSA-N 393.487 3.843 10 40 GHCB CCOc1ccc(/C=C2/SC(=S)N(NC(=O)Cc3ccccc3)C2=O)cc1 35041443 BAVBGPUKFWRTKW-SFQUDFHCSA-N 398.509 3.560 10 40 GHCB O=C1/C(=C\NOCc2c(Cl)cccc2Cl)C=NN1c1cccc(Cl)n1 100403051 QCKWGEMRDYZMCH-NTMALXAHSA-N 397.649 3.980 10 40 GHCB Cc1cccc(NC2=NC(=O)/C(=C/c3cn(CC(N)=O)c4ccccc34)S2)c1 6814803 VCRJFJWOLWBKEL-ZDLGFXPLSA-N 390.468 3.517 10 40 GHCB COc1ccc(C(=O)Oc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2)cc1 409348947 TZJKYZUWHNCUHI-WJDWOHSUSA-N 385.466 3.745 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3cc(C)ccc3C)C(=O)N=C2O)ccc1O 38165439 QFUPNLSFUXDCCI-GDNBJRDFSA-N 380.400 3.914 10 40 GHCB Cc1cc(N2CCOCC2)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2S[C@@H](C)CN21 222597001 YKFXZAXSVNLPJE-ZLGUVYLKSA-N 394.544 3.816 10 40 GHCB Cc1c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc(Cl)c(O)c1Cl 5921439 AONPOSRFIGVAIM-UHFFFAOYSA-N 377.205 3.716 10 40 GHCB CC(C)CCN1C(=O)/C(=C\N2CCN(Cc3ccccc3)CC2)SC1=S 20648284 NKTZCUQBVGRJRW-OBGWFSINSA-N 389.590 3.552 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1cc(OC)ccc1OC 6654840 BWNQWVHUIGWKKS-VBKFSLOCSA-N 397.402 3.720 10 40 GHCB O=C1NC(=O)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/C=C/c1ccco1 2297674 WWBUUQGJPFLCAN-BOAPOFAJSA-N 376.290 3.521 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc(O[C@H](C)C(=O)O)cc3)S2)cc1 16907115 HBCBESGIZJPHKH-PBSOMRJOSA-N 398.440 3.630 10 40 GHCB CCCc1cc2c(-c3ccccc3)cc(=O)oc2c(CN2CCN(C)CC2)c1O 19908970 CAGDMNJGCTYLMC-UHFFFAOYSA-N 392.499 3.866 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 4663404 VWCCQQJQLJCFST-LDADJPATSA-N 395.528 3.648 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(OC(F)(F)F)cc1 16134682 HQPKNWMLQCTBTQ-UHFFFAOYSA-N 394.393 3.694 10 40 GHCB Cc1cc(/C=C2\C(=O)N(C3CC3)C(=S)N=C2O)c(C)n1-c1ccc(F)cc1 17208411 SVRUXEPDJZHGFT-YVLHZVERSA-N 383.448 3.863 10 40 GHCB CCOc1cc(/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)cc(Cl)c1O 38172130 BYILYGDHFQYYAJ-WUXMJOGZSA-N 390.779 3.540 10 40 GHCB O=C(O)Cc1ccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)cc1 5235965 NJYNJBIGQGJMLJ-GDNBJRDFSA-N 395.465 3.596 10 40 GHCB CC(=O)c1cccc(N2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)c1 5371693 STPKVTDWWSXIOP-SXGWCWSVSA-N 383.450 3.993 10 40 GHCB O=C(O)CSc1cc(NS(=O)(=O)c2ccccc2)c2ccccc2c1O 645676 WOOMMHUHOYPAOS-UHFFFAOYSA-N 389.454 3.523 10 40 GHCB CCOC(=O)c1oc2ccccc2c1CN1CCN(c2ccc(OC)cc2)CC1 7489365 YMXUGVYWIGZRPN-UHFFFAOYSA-N 394.471 3.940 10 40 GHCB O=C1N=C(O)/C(=C\c2ccc(Br)o2)C(=O)N1c1ccc(F)cc1 8771686 FQZZJCRPLDMOKP-YRNVUSSQSA-N 379.141 3.688 10 40 GHCB Cc1nc(COc2ccc(/C=C3/SC(NC4CCCCC4)=NC3=O)cc2)no1 84281384 VMLKMVWMJORPPK-GZTJUZNOSA-N 398.488 3.850 10 40 GHCB O=C(CN1C(=O)S/C(=C/c2ccc(O)c(O)c2)C1=O)c1ccc(Cl)cc1 409316516 YRAUYYWVVHFVJT-LZYBPNLTSA-N 389.816 3.670 10 40 GHCB CCN1C(=O)/C(=C/c2ccc(Sc3ccc(Cl)cc3)o2)C(=O)NC1=S 409392545 QJGFBGQNYRYRRR-UKTHLTGXSA-N 392.889 3.731 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccc(C=O)cc3)SC2=S)cc1 5375083 DHEKYJPATSLJDR-YVLHZVERSA-N 382.466 3.863 10 40 GHCB O=C1Nc2ccccc2S[C@@H]1[C@H]1SC(=S)N(Cc2ccccc2)C1=O 1567432 UVLNNIKGDNAHSD-HUUCEWRRSA-N 386.523 3.529 10 40 GHCB COC(=O)c1ccc(/C=C2\SC(Nc3cc(C(=O)O)ccc3C)=NC2=O)cc1 54164370 FIRPCKHPKTUGOF-SXGWCWSVSA-N 396.424 3.562 10 40 GHCB COc1ccc(N2CCCN(C(=O)COc3ccc(C(C)C)cc3)CC2)cc1 84625161 BZOGQFSABVBRKC-UHFFFAOYSA-N 382.504 3.936 10 40 GHCB CN(C)c1ccc(CN2CC3(CCN(C(=O)Cc4ccc(Cl)cc4)C3)C2)cc1 96070751 QTIZAKXFNGXJDJ-UHFFFAOYSA-N 397.950 3.683 10 40 GHCB CC1(C)OC(=O)C(=Cc2ccc(-c3ccccc3Br)o2)C(=O)O1 96193197 JAAMGKFBMDPKIM-UHFFFAOYSA-N 377.190 3.929 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c1 408878716 AMPDHUQYSURLQO-CXUHLZMHSA-N 384.819 3.632 10 40 GHCB COC(=O)[C@@H](C)N1C(=O)S/C(=C\c2cc(C)n(-c3ccccc3)c2C)C1=O 409104016 YDADNHURTNITAF-RQNDZEIBSA-N 384.457 3.692 10 40 GHCB COCCn1c(C)cc(/C=C2/C(=O)N(c3ccc(C)c(C)c3)C(=S)N2C)c1C 409130079 IFVGMUIZZNNHLD-MOSHPQCFSA-N 397.544 3.973 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3ccc4c(c3)n(C)c(=O)n4C)SC2=S)c1 409343097 FXVHQRJOEUVWAA-BOPFTXTBSA-N 395.509 3.591 10 40 GHCB N=C1/C(=C/c2ccc(O)cc2)C(=O)N=C2SN=C(SCc3ccccc3)N12 4616734 POKNPOQYLJFYGB-YERBQUFUSA-N 394.481 3.902 10 40 GHCB Cc1ccccc1-n1cccc1/C=C1\C(=O)NC(=O)N(C2CCCCC2)C1=O 4747742 ZQDGMUDZLHLWTN-NBVRZTHBSA-N 377.444 3.580 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=O)NN(c3ccc(C)c(Cl)c3)C2=O)cc1 5127999 XYNPIESOLSTTDZ-PDGQHHTCSA-N 383.879 3.956 10 40 GHCB Cc1csc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)SC2=S)n1 5544122 BQWPUXFPHDBVCT-XYOKQWHBSA-N 393.515 3.665 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C/c3ccc(OCC#N)c(OC)c3)S2)cc1 9973172 XHLVEMUEAIHYGL-PDGQHHTCSA-N 395.440 3.689 10 40 GHCB Cc1ccc(-n2c(C)cc(C(=O)OCC(=O)Nc3ccnn3C(C)C)c2C)cc1 14903822 POUJQIBIADGANG-UHFFFAOYSA-N 394.475 3.975 10 40 GHCB CC(C)(Oc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 54285128 YQMFMIPJKXWAJC-UHFFFAOYSA-N 388.895 3.650 10 40 GHCB CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccn2)c1C 222774149 XCUGYBADPQHZHG-VQTJNVASSA-N 377.517 3.877 10 40 GHCB O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1c1ccc2c(c1)OCO2 1416617 SGIUWTRYBWUMJV-VIZOYTHASA-N 386.410 3.729 10 40 GHCB COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\c1ccccc1F 6395086 CQFFVPVQWMEORG-WJDWOHSUSA-N 382.347 3.611 10 40 GHCB CC(C)N1C(=O)NC(=O)/C(=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)C1=O 9323932 BFFXSYQSXOUFDI-ZROIWOOFSA-N 392.333 3.836 10 40 GHCB O=C(CCN1C(=O)/C(=C/c2ccccc2)SC1=S)Oc1cccc(O)c1 9764055 VHQZONMLPQJVCD-WJDWOHSUSA-N 385.466 3.589 10 40 GHCB Cc1ccc(OCc2nc(CC(=O)NCc3ccc(N(C)C)cc3)cs2)cc1 12554567 RHPXNSBFNKBCDZ-UHFFFAOYSA-N 395.528 3.955 10 40 GHCB CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)cc1 223694957 JZUFUTCRRYLJCP-QGZVFWFLSA-N 388.533 3.800 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)S2)c(OC)c1 5551416 XSSDQRRMGVADIE-SXGWCWSVSA-N 385.401 3.694 10 40 GHCB COc1ccc(/N=N/c2c(N)n[nH]c2NC(=S)NC(=O)c2ccccc2)cc1 5639787 CVUNCCVIHMLWIN-GHVJWSGMSA-N 395.448 3.543 10 40 GHCB O=C(Nc1ccccc1)c1cnn2c(O)cc(Cc3c[nH]c4ccccc34)nc12 19372994 CTVPFLAPOUEGKK-UHFFFAOYSA-N 383.411 3.759 10 40 GHCB CCn1c(S[C@@H](C)C(=O)Nc2ccc(N)cc2)nnc1-c1cccc(C)c1 930596 WDTACZLWBPRHHN-AWEZNQCLSA-N 381.505 3.975 10 40 GHCB COC(=O)COc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc1 409347500 QADHRXWDOKWCRH-GZTJUZNOSA-N 399.493 3.953 10 40 GHCB CCN1CCN(Cc2c(O)ccc3cc(-c4ccc(Cl)cc4)c(=O)oc23)CC1 20605107 WPLMWXVNWMUXQH-UHFFFAOYSA-N 398.890 3.957 10 40 GHCB biogenic CCN1CCN(Cc2c(O)ccc3c(=O)c(-c4ccc(Cl)cc4)coc23)CC1 20392882 HFHNTYALTIMBJB-UHFFFAOYSA-N 398.890 3.957 10 40 GHCB biogenic O=C(CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)N1CCCCC1 2287817 MDXBHZHVOMUWCA-NTCAYCPXSA-N 394.949 3.944 10 40 GHCB O=C1N=C(O)/C(=C\NN2CCCCCC2)C(=O)N1c1cccc2ccccc12 2406268 QNNLFQLGDDQWCN-SAPNQHFASA-N 378.432 3.527 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N4CCCC4)c(C)c3)C2=O)cc1 4703296 YFFGSWXBTKQLTD-XMHGGMMESA-N 389.455 3.570 10 40 GHCB COc1ccc(N2CCN(C(=O)CSC/C=C/c3ccccc3)CC2)cc1 7058696 YFZNSNSSZHQBJB-VMPITWQZSA-N 382.529 3.790 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccnc1SC(F)F 10907376 QCUZXXRMZMEGMM-UHFFFAOYSA-N 393.459 3.505 10 40 GHCB COc1ccc([C@H](c2ccc3c(OC)cccc3c2O)N2CCOCC2)cc1 13656365 WYADEYJOPGIMNZ-JOCHJYFZSA-N 379.456 3.984 10 40 GHCB Cc1cc(C(=O)NCCc2cccs2)c(C)n1-c1ccc2c(c1)OCCO2 28435078 LIPXHQXBSNQBQP-UHFFFAOYSA-N 382.485 3.899 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C\Nc2cccc3ccccc23)C1=O 408534845 RLYGNOZABFHQEO-NBVRZTHBSA-N 385.423 3.981 10 40 GHCB O=C(O)CCN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 9188433 JEQNWFPZLMSWHW-ATVHPVEESA-N 399.493 3.942 10 40 GHCB CCOc1cc(/C=C2/C(=O)NC(=O)N=C2O)ccc1OCc1ccc(C)cc1 27532433 NMWMCICEYSCGNY-UHFFFAOYSA-N 380.400 3.562 10 40 GHCB CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C/Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 100507682 KLAKDXNHACAHTO-LICLKQGHSA-N 395.375 3.838 10 40 GHCB COCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)C1=O 409139538 BHBSOZGSRPIKBE-LDADJPATSA-N 386.473 3.785 10 40 GHCB O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(Br)cc1 725518 OZTRYSPPKYVFKP-RIYZIHGNSA-N 377.625 3.564 10 40 GHCB COc1ccccc1CCNC(=O)c1nc(-c2ccc(-n3cccc3)cc2)no1 4623118 APEALTZVIOGQLC-UHFFFAOYSA-N 388.427 3.508 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)N[C@H]1c1ccc(N(C)C)cc1 6570062 DYVMPPCPEBUWBK-FQEVSTJZSA-N 379.460 3.861 10 40 GHCB Cc1cc(CCNc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)n1-c1ccccc1 9156222 ZSNUCCCRZLEQPP-UHFFFAOYSA-N 378.432 3.756 10 40 GHCB CCOc1ccc(/C=C2\SC(Nc3ccccc3C(=O)O)=NC2=O)cc1OC 20226925 SANFOIZJBOHSDC-BOPFTXTBSA-N 398.440 3.875 10 40 GHCB CC1=CN2C(=N)/C(=C/c3ccc(-c4cccc(C(=O)O)c4)o3)C(=O)N=C2S1 20325215 OUJLNTLCPMNTPV-CLFJUMGRSA-N 379.397 3.812 10 40 GHCB CCCCCC1=NN2C(=N)/C(=C/c3coc4ccccc4c3=O)C(=O)N=C2S1 41083008 JCROODVGXHFNRV-CTLFBJNRSA-N 394.456 3.992 10 40 GHCB CCOc1ccc(-n2c(C)cc(/C=C3/C(=O)N(C)C(=S)N=C3O)c2C)cc1 59182202 YKSFMCSUXHQTFC-GZTJUZNOSA-N 383.473 3.590 10 40 GHCB CCOCCCN/C(C)=C1\C(=O)N(c2ccc(OC)cc2)N=C1c1ccccc1 112123426 HBCPGJMWUJFVRW-FXBPSFAMSA-N 393.487 3.736 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/NC(=O)N(Cc4ccccc4)C3=O)c2C)nc1 409239296 CYNNZWWENBXBTG-UDWIEESQSA-N 386.455 3.890 10 40 GHCB CC(C)(C)OC(=O)N1[C@H]([C@@H](O)c2cccnc2)CC[C@@H]1Cc1ccc(N)cc1 1547139874 QWSDDZWLEHRRIV-AABGKKOBSA-N 383.492 3.708 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(NC(=O)Nc3ccccc3)C2=O)cc1 3091893 VKVJCPLBXBKFBJ-PTNGSMBKSA-N 385.470 3.633 10 40 GHCB CN(C)c1ccc(CNC(=O)Cc2csc(COc3ccc(F)cc3)n2)cc1 11000987 OQIFFOWXYBPZGM-UHFFFAOYSA-N 399.491 3.786 10 40 GHCB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(C(C)C)c3C)C2=O)c1 408966741 QFSRQHNUOPBNGI-YBFXNURJSA-N 379.460 3.969 10 40 GHCB COc1ccc(/C=C2\SC(N3CCN(c4ccccc4C)CC3)=NC2=O)cc1 4811765 FYSDEEINTYRUTB-HKWRFOASSA-N 393.512 3.796 10 40 GHCB CC(=O)N(C(C)=O)c1c(Cl)cc2c(c1Cl)C(=O)c1ccccc1C2=O 111939218 ADRUPUNBBPUTJU-UHFFFAOYSA-N 376.195 3.668 10 40 GHCB COc1ccc(N2CCN(CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)cc1 54225192 OHLYNTHNRABQBV-UHFFFAOYSA-N 394.302 3.763 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c1C 409234035 XZASXKGUSFRUGQ-XNTDXEJSSA-N 385.851 3.753 10 40 GHCB Cc1ccccc1C1=NN2C(=N)/C(=C\c3ccc(N(C)C)cc3)C(=O)N=C2S1 32109557 PUVWDPMBJQGQBX-ACUDIFQKSA-N 389.484 3.728 10 40 GHCB CCOc1ccccc1CCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 48355120 WRHIVEJCXKNAKS-GOSISDBHSA-N 382.504 3.732 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccc(OC)cc1OC 797858 NNNRLTWDTYVNSQ-WJDWOHSUSA-N 397.402 3.720 10 40 GHCB O=C1C(=Cc2ccc(O)cc2)C(=O)N(c2ccccc2)C(=O)N1c1ccccc1 910911 UJXRCYGAQFOTEV-UHFFFAOYSA-N 384.391 3.976 10 40 GHCB CCCOc1ccc(N2CC[C@H](N(Cc3ccc4c(c3)OCO4)C(C)=O)C2)cc1 4561178 LJCGOZDPJAOKCE-FQEVSTJZSA-N 396.487 3.832 10 40 GHCB COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccc2c(c1)OCO2 4672700 FUSQRDHCDLAFKV-DZBQEORWSA-N 391.423 3.849 10 40 GHCB COc1ccc(-n2c(/C=C/c3ccc(O)c(O)c3)nc3ccccc3c2=O)cc1 4863171 HTIXQBYFKXIBJR-NTUHNPAUSA-N 386.407 3.976 10 40 GHCB COc1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C)C2)cc1 223713487 BEGXZZSTWNTATL-OAHLLOKOSA-N 392.496 3.549 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1O 5374170 PMNDYASYYXMQDV-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnc(-c2ccsc2)s1 95958560 KXHLNCKLDVSFSC-UHFFFAOYSA-N 399.541 3.980 10 40 GHCB O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2)o1 409392975 OMPITSLTRWBVGU-LFIBNONCSA-N 393.786 3.661 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)cc1OC 58982308 LMMYOOUOZBAAPX-ZROIWOOFSA-N 386.404 3.515 10 40 GHCB COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)cc([N+](=O)[O-])c1OC(C)=O 4738847 INCORLWHCZKNPF-LZYBPNLTSA-N 395.367 3.818 10 40 GHCB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3c(O)ccc4ccccc34)C2=O)c1C 408891322 OOGASIFRCSEHRN-LDADJPATSA-N 386.407 3.829 10 40 GHCB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1 408796041 CTYZNXBRFZNBBT-RVDMUPIBSA-N 384.819 3.714 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)c3ccc(F)c(F)c3)N3CCCC3)ccc21 13008248 HCEFOGUTZVATCD-JOCHJYFZSA-N 399.485 3.914 10 40 GHCB Cn1cccc1/C=C1/SC(=S)N(NC(=O)c2ccc(C(C)(C)C)cc2)C1=O 5552655 JYNHOMJHVWNYPB-FOWTUZBSSA-N 399.541 3.869 10 40 GHCB COC(=O)c1ccccc1NC(=O)CSc1ncc(-c2ccccc2)n1C 924726 MLASIDXOVHYGJK-UHFFFAOYSA-N 381.457 3.605 10 40 GHCB CC(C)C(=O)O[C@H](C)C(=O)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O 7814563 KPOHDXZSDHEAOV-LLVKDONJSA-N 399.830 3.642 10 40 GHCB CN1C(=O)/C(=C/c2ccc(Sc3ccc(Cl)cc3)s2)C(=O)NC1=S 409022126 FMNKPYZKHBYBEC-XYOKQWHBSA-N 394.930 3.809 10 40 GHCB COc1cccc(C(=O)Oc2cccc3c2C(=O)c2ccccc2C3=O)c1OC 4659161 VJSGSVNPZASACU-UHFFFAOYSA-N 388.375 3.698 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc(OCC(N)=O)cc3)SC2=S)cc1C 409201623 NCGYYCZNPIZKCL-YVLHZVERSA-N 398.509 3.573 10 40 GHCB COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3cc(C)ccn3)c2C)C1=O 409233303 FJHPGYOULNKMJS-SFQUDFHCSA-N 385.489 3.870 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3cccn3CCOc3ccc(C)c(C)c3)C(=N)N2O1 41078252 SACPACQSXOMRGR-RPDORSEYSA-N 390.443 3.634 10 40 GHCB O=C(O)C[C@@H](c1ccccc1)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 6061949 ZBJMXVOFRVUGRG-BMANGOCTSA-N 385.466 3.809 10 40 GHCB CCOC(=O)c1cc(Br)cc(Br)c1/N=N/N(C)O 17060505 KPZAXRATKGQUAI-BUHFOSPRSA-N 381.024 3.708 10 40 GHCB O=S(=O)(c1ccccc1)N1N=C(c2ccccc2)C[C@@H]1c1ccccc1O 4248183 FVFWVAXNHNTNGO-HXUWFJFHSA-N 378.453 3.932 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)c3ccccc3F)N3CCCCC3)ccc21 13007710 WANJVHDOKOQNHW-QFIPXVFZSA-N 381.495 3.775 10 40 GHCB Nc1ccc2c(O)c(/N=N\c3ccc([N+](=O)[O-])cc3)c(S(=O)(=O)O)cc2c1 104366710 PEMFTJYWFHQQFA-HNENSFHCSA-N 388.361 3.698 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)SC(=S)N1c1cccc([N+](=O)[O-])c1 59417973 PFSCPJVZNGWZMZ-ZSOIEALJSA-N 387.398 3.909 10 40 GHCB CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O 408802080 CSLNFGSCJAHORB-QGOAFFKASA-N 378.428 3.759 10 40 GHCB O=C(O)COc1cccc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)c1 16399515 XVDTWXMTENSYSD-GDNBJRDFSA-N 377.487 3.684 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccccc3F)C(C)=C2C(=O)OC)ccc1O 408893979 PKUQDPCLENJVOL-PTNGSMBKSA-N 397.402 3.807 10 40 GHCB COc1ccc(NC2=NC(=O)/C(=C\c3ccc4c(c3)OCO4)S2)c(OC)c1 35648006 LUAKQYDWUNHGLF-CAOOACKPSA-N 384.413 3.515 10 40 GHCB CN(CCNC(=S)Nc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1 225572322 BPTBSEMXZNERMF-UHFFFAOYSA-N 396.560 3.736 10 40 GHCB CC(C)N1CCC2(CC1)N=C(c1ccccc1O)C[C@H](c1ccccc1O)N2 80324868 ZJYVMECYMISWOH-LJQANCHMSA-N 379.504 3.822 10 40 GHCB COc1ccc(Br)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 32722612 OOKCMAQSTHJOOZ-UHFFFAOYSA-N 377.282 3.796 10 40 GHCB COc1ccc(N2CCN(C(=O)CCC(=O)c3cc(C)sc3C)CC2)cc1 3439507 DFWIXYXJHAAACV-UHFFFAOYSA-N 386.517 3.685 10 40 GHCB O=C(O)CN1C(=O)/C(=C\c2ccc(OCCc3ccccc3)cc2)SC1=S 4723483 NHLPUJOIZWQBTM-SFQUDFHCSA-N 399.493 3.594 10 40 GHCB CN1CCN(c2ccc(CNC(=O)CSc3ccc(Cl)cc3)cc2)CC1 216927995 RQPMWHRKQQHDSB-UHFFFAOYSA-N 389.952 3.500 10 40 GHCB CCn1cc(/C=C2\C(=O)NC(=S)N(c3cccc(F)c3)C2=O)c2ccccc21 4711352 UGZTYOLWEYGNBE-LICLKQGHSA-N 393.443 3.632 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3c(O)ccc4ccccc34)C2=O)cc1 408880366 JNUHYISBWGGLGY-CPNJWEJPSA-N 386.407 3.774 10 40 GHCB CCCCN1CCc2cc(/C=C3/C(=O)N=C(S)N([C@H](C)CC)C3=O)ccc21 254860660 QOCDRKFXCIVXOI-CPZHOGDASA-N 385.533 3.686 10 40 GHCB Cc1cc(C(=O)OCC(=O)NCc2cccs2)c(C)n1-c1ccc(F)cc1 5689426 GZBBAOSROCFGJI-UHFFFAOYSA-N 386.448 3.768 10 40 GHCB CC[C@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217028340 RHMAMRXHFSLOHS-QFIPXVFZSA-N 395.547 3.529 10 40 GHCB CCOC(=O)C1=C(C)N=C(SCC(C)C)N[C@H]1c1ccc(N(C)C)cc1 408989034 JKMSIYLIVOGUSR-SFHVURJKSA-N 375.538 3.979 10 40 GHCB CC(C)c1ccc(/C=C2\SC(=S)N(NC(=O)c3ccncc3)C2=O)cc1 1449331 SAAPBCCVGRFCDF-WJDWOHSUSA-N 383.498 3.751 10 40 GHCB Cc1cc2c(n1-c1cccc(S(=O)(=O)N3CCCCCC3)c1)CCCC2=O 9186014 PVIDSBMRZOAFQC-UHFFFAOYSA-N 386.517 3.869 10 40 GHCB CCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCC)c(OC)c2)SC1=S 5373712 IARHMPSMLVQMIE-DYTQJMLRSA-N 395.502 3.548 10 40 GHCB CC[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 22514209 SUFKYWUYHSLUHQ-HXUWFJFHSA-N 388.895 3.855 10 40 GHCB O=C1NC(=S)N=C(O)/C1=C\c1ccc(SCc2ccc(Cl)cc2)o1 20324484 MDFXWADVZXILOE-UHFFFAOYSA-N 378.862 3.980 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3ccc(C)c(C)c3)C(=O)N=C2O)cc1C(=O)O 33323855 DFAYYATWTQTYMT-YBEGLDIGSA-N 394.383 3.517 10 40 GHCB CC(C)(C)NC(=O)CCCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1239337 OLVAAQFQOLHCEU-KAMYIIQDSA-N 380.510 3.722 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)c1cccs1 1412535 DRISUHCIBKPHCX-XYOKQWHBSA-N 380.903 3.948 10 40 GHCB Oc1cc2c(cc1CN1CCN(c3ccc(C(F)(F)F)cn3)CC1)CCC2 23732283 UUEHGOHILGMISK-UHFFFAOYSA-N 377.410 3.617 10 40 GHCB O=C1/C(=C/c2nc3ccccc3[nH]2)SC(=S)N1c1ccc2c(c1)OCO2 2214134 VBQJIXVNGOIMCX-NVNXTCNLSA-N 381.438 3.697 10 40 GHCB COc1ccc(N(C)CCNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1 224992525 BOYFLHOQMBVURH-UHFFFAOYSA-N 376.884 3.759 10 40 GHCB Cc1cccc(O)c1NC(=O)c1ccc(/C=C2/SC(=S)N(C)C2=O)cc1 5374801 VMZBFLMWEDKDGS-XNTDXEJSSA-N 384.482 3.784 10 40 GHCB CCOc1ccccc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 6747965 SKURDGRHALRMIB-HXUWFJFHSA-N 382.504 3.973 10 40 GHCB CCc1ccc(O[C@@H](CC)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 222878153 LQIBRPYAZCBLBW-QFIPXVFZSA-N 382.504 3.764 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(C3CCCCC3)C(C)=C2C(=O)OC)ccc1O 408892105 GDLNWSUSKUOIID-ATVHPVEESA-N 385.460 3.796 10 40 GHCB CCC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CCC(=O)O)c2C(=O)OC)C1 2747120 MZPJOUHEFLOPGD-LLVKDONJSA-N 381.494 3.879 10 40 GHCB CCn1cc(/C=C2\C(=O)N=C(O)N(c3ccc(OC)cc3)C2=O)c2ccccc21 5031604 NLCOXTHZTZQHRI-LDADJPATSA-N 389.411 3.541 10 40 GHCB COc1ccc(OC)c(NS(=O)(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 6416153 FLBHJTOGOKNRMO-UHFFFAOYSA-N 386.473 3.912 10 40 GHCB CN1CCCc2cc([C@@H](CNC(=O)Cc3cccs3)N3CCCC3)ccc21 13008215 UBSHGFSCJFMFEK-OAQYLSRUSA-N 383.561 3.626 10 40 GHCB CC/C(Nc1ccc(OC)cc1)=C1\C(=O)N(c2ccccc2)N=C1CC(=O)OC 19894231 JGHMNQJURHIIEG-DYTRJAOYSA-N 393.443 3.737 10 40 GHCB CCN1c2cc(C)c(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc2[C@@H](C)CC1(C)C 113790442 AMOPHHONDKLJQP-AWEZNQCLSA-N 383.492 3.541 10 40 GHCB Cc1ccc(C)c(N2C(=O)NC(=O)/C(=C\Nc3ccc(F)c(Cl)c3)C2=O)c1 408526814 CLURLMWXJZNWJZ-UKTHLTGXSA-N 387.798 3.675 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C\c1ccc(O)cc1 409021999 HLDNPOKXNAKAIH-YBEGLDIGSA-N 399.830 3.931 10 40 GHCB CN1C(=O)/C(=C/c2ccc(-c3cccc(Cl)c3Cl)o2)C(=O)NC1=S 5879178 LWASNMNDPOZEPH-JXMROGBWSA-N 381.240 3.510 10 40 GHCB COc1ccc(N2CCN(C(=S)c3ccc(Br)cc3)CC2)cc1 9188031 NLPOVNYKRDCHJK-UHFFFAOYSA-N 391.334 3.955 10 40 GHCB COc1cc(Cl)cc(/C=C2\C(=O)NN(c3ccccc3)C2=O)c1OC(C)C 33696057 DZKOYKTUOQIMRP-MHWRWJLKSA-N 386.835 3.597 10 40 GHCB Cc1cc(C(=O)NCc2ccn(-c3ccc(F)cc3)n2)c(C)n1-c1ccccn1 135170235 KOYLOOOTANBPJL-UHFFFAOYSA-N 389.434 3.744 10 40 GHCB O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)SC(=S)N1c1ccccc1[N+](=O)[O-] 4648859 IUPDDVFWTOSRKE-NTEUORMPSA-N 387.398 3.909 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)cc1O 5346895 IJVLARPSLUBHPM-APSNUPSMSA-N 396.449 3.978 10 40 GHCB CN(C)c1ccc([C@@H](c2nnnn2C(C)(C)C)N2CCc3ccccc3C2)cc1 20120990 AAFZDYDDZPHGMB-NRFANRHFSA-N 390.535 3.642 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C\c3cccc(F)c3)SC2=S)ccc1O 35648701 NUBJGFWGXCOSMQ-VGOFMYFVSA-N 375.402 3.635 10 40 GHCB CN(C)c1ccc(CN2CCC(c3cc(O)nc(-c4cccnc4)n3)CC2)cc1 72392755 KJGFPLKUPQTCFV-UHFFFAOYSA-N 389.503 3.690 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(O)c(OC)c1 408770195 UNIQNDBEEVYQPX-BOPFTXTBSA-N 379.412 3.586 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(Cl)nc4ccccc34)CC2)cc1 6578375 UBRXDGNZYKWBCO-UHFFFAOYSA-N 381.863 3.859 10 40 GHCB COc1cc(Cl)c(C[C@H]2SC(=S)N(Cc3ccco3)C2=O)cc1OC 8106916 XZBQHWNWZZCVDP-OAHLLOKOSA-N 397.905 3.922 10 40 GHCB CCCC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1cccc(OC)c1O 36617190 DVVJMJVYPODEEZ-FOWTUZBSSA-N 380.400 3.685 10 40 GHCB CC[C@@H](Oc1ccccc1Cl)C(=O)N1CCN(c2ccc(OC)cc2)CC1 44948594 SMHGBDPXNZLMDX-LJQANCHMSA-N 388.895 3.855 10 40 GHCB CC(=O)N(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1 223273802 MWQJVWPRTTZZMW-UHFFFAOYSA-N 387.486 3.594 10 40 GHCB CCOc1cccc(NC(=S)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 225838924 HIDYHUMCXHOGKI-MRXNPFEDSA-N 385.533 3.970 10 40 GHCB COC(=O)c1cccc(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)c1C 408814966 QVFFSRJIOLLLLA-YVLHZVERSA-N 384.457 3.855 10 40 GHCB Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3COc4ccccc4O3)c2C)c1 3350867 XWNIYVABCVESLV-IBGZPJMESA-N 376.456 3.972 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 4688398 OKSPVAFSMDOUPH-PGMHBOJBSA-N 390.483 3.668 10 40 GHCB COc1cc([N+](=O)[O-])cc(/C=C2/SC(Nc3ccc(F)cc3)=NC2=O)c1O 6905960 QMXAPCRRKBXBND-VGOFMYFVSA-N 389.364 3.531 10 40 GHCB CCN1C(=O)/C(=C/c2cc(C)n(-c3c(C)cc(C)cc3C)c2C)C(=O)NC1=S 409389944 BBMYWKKYBYAZOU-WOJGMQOQSA-N 395.528 3.666 10 40 GHCB Cc1cc(C(=S)N2CCOCC2)c(C)n1-c1ccc(Br)cc1 5658786 YNGFYYQAWNIWDL-UHFFFAOYSA-N 379.323 3.864 10 40 GHCB CCN1CCC[C@H]1CNC(=S)N(Cc1ccccc1O)c1ccc(F)cc1 32909057 UCIDFUFQHOMRNC-IBGZPJMESA-N 387.524 3.897 10 40 GHCB COc1ccc(N2CCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)cc1 5636617 YUPWXMWRRSNRKZ-UHFFFAOYSA-N 392.253 3.693 10 40 GHCB COc1cc2c(cc1NCC(=O)NC(=O)NC1CCCC1)oc1ccccc12 11619341 AMJJKVLFRACKHE-UHFFFAOYSA-N 381.432 3.775 10 40 GHCB COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cccc(F)c3)n2)c1 16096775 FAFXJZZTSFUPFF-UHFFFAOYSA-N 394.449 3.767 10 40 GHCB CC[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1 44883753 JAVMTQABYOGJHV-LJQANCHMSA-N 388.895 3.650 10 40 GHCB CC1=CSC2=NC(=O)/C(=C\c3cccn3-c3cccc([N+](=O)[O-])c3)C(=N)N12 49652927 YMFSOIRQDWDBTJ-QBIJJOOHSA-N 379.401 3.552 10 40 GHCB CC(C)n1[nH]c(=O)c2c(-c3ccc(O)cc3)c3oc4c(O)c(O)ccc4c3nc21 85877155 HTOGRZFKGFYYFM-UHFFFAOYSA-N 391.383 3.989 10 40 GHCB biogenic CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1OCC 408816126 RBMIKPHTBXWCHH-GHRIWEEISA-N 394.427 3.541 10 40 GHCB C[C@H](c1ccccc1O)N(C)C(=O)c1ccc(F)cc1I 89909750 QAGCQGWHTAZGQD-SNVBAGLBSA-N 399.203 3.969 10 40 GHCB O=C1C(=Cc2ccccc2O)C(=O)N(c2ccccc2)C(=O)N1c1ccccc1 5377549 OBXOSWKQVUKDOQ-UHFFFAOYSA-N 384.391 3.976 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3cccnc3)C2=O)cc1Cl 15013734 ATNCNVASFPJZIE-ZENNRRHLSA-N 399.834 3.579 10 40 GHCB CCCC[C@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 3263964 DEBCVGZOAATFKW-QFIPXVFZSA-N 381.476 3.778 10 40 GHCB COc1ccc(N2CCN(C(=O)NCc3cccc(C(F)(F)F)c3)CC2)cc1 12564677 IYGXMXHYYNHCAC-UHFFFAOYSA-N 393.409 3.746 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)cc1 9190100 LLTQBKCGPCSFGI-MFOYZWKCSA-N 385.466 3.825 10 40 GHCB COc1cccc(COC[C@@H](O)CN(Cc2ccco2)Cc2ccccc2O)c1 6082956 HZWXLMBCCIPKQM-FQEVSTJZSA-N 397.471 3.574 10 40 GHCB Cc1ccc(/C=C2\SC(N3CCN(c4ccccc4F)CC3)=NC2=O)cc1 13749600 CFUAYWFRLSUFPC-RGEXLXHISA-N 381.476 3.927 10 40 GHCB C[C@@H](NS(=O)(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1 4474205 RAWDRXZQNMAABG-CQSZACIVSA-N 391.448 3.502 10 40 GHCB CCCCCC1=NN2C(=N)/C(=C/c3ccc(O)c(OCC)c3)C(=O)N=C2S1 41083155 GECGUGQRTXYNOF-TZJGTLJJSA-N 386.477 3.990 10 40 GHCB COc1ccc(-c2ccc(/C=C3\SC(=S)N([C@@H](C)C(=O)O)C3=O)o2)cc1 5032389 ORTUCGOLAGIHNM-QNKACBJSSA-N 389.454 3.630 10 40 GHCB O=C(NN1C(=O)/C(=C\c2cccc(F)c2)SC1=S)c1ccc(F)cc1 1257916 UPYAFJAAGLQDTK-NTEUORMPSA-N 376.409 3.511 10 40 GHCB O=C(CN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc(F)cc1 1266350 PIPCBZHWCYUHRE-MDWZMJQESA-N 378.475 3.727 10 40 GHCB CCOc1ccc(/C=C2/C(=O)N(CCc3ccc(F)cc3)C(=O)N=C2O)cc1 8995264 KUSRNXBGTZNERI-QGOAFFKASA-N 382.391 3.769 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)N(C(C)C)C(C)=C2C(=O)OC)cc1OCC 33666344 AWMKBQZRDZWWRN-ATVHPVEESA-N 387.476 3.955 10 40 GHCB COc1cc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)ccc1OCc1ccccc1 41078335 OLDFVHDTCNBHOR-FCBPJKEOSA-N 389.411 3.725 10 40 GHCB CCc1ccc2oc(=O)cc(CN3CCN(c4ccc(OC)cc4)CC3)c2c1 54105903 ZVQWAGPQGVOYFL-UHFFFAOYSA-N 378.472 3.686 10 40 GHCB biogenic CCOc1ccccc1/C=C1\C(=O)N(c2cccc(OC)c2)C(C)=C1C(=O)OC 59959190 KHBBVSXCMOEQHV-UYRXBGFRSA-N 393.439 3.971 10 40 GHCB COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1OC 223645145 JHEXSHFXYJDIOP-UHFFFAOYSA-N 397.452 3.736 10 40 GHCB Cc1ccc(C(=O)N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 408719665 OWRQYAWSGJLNSE-XNTDXEJSSA-N 384.438 3.945 10 40 GHCB CCOc1ccc(N2C[C@](O)(c3ccc(Cl)cc3)[N+]3=C2SCCC3)cc1 2965977 RUMUBFWTEUGKIO-FQEVSTJZSA-N 389.928 3.909 10 40 GHCB O=C(CSc1nnc(-c2ccco2)c(-c2ccco2)n1)NC1CCCCC1 933450 YVZWPOMGMLJJRI-UHFFFAOYSA-N 384.461 3.933 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3ccccc3Cl)C(=O)N=C2O)ccc1O 38179766 CEDSYPZJOAMCEL-XFXZXTDPSA-N 386.791 3.951 10 40 GHCB CCOc1cc(/C=C2\SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)ccc1O 5373055 BNRBZKLYMOEYEK-WQRHYEAKSA-N 397.456 3.832 10 40 GHCB CN(C)c1ccc(/C=C2\SC(=O)N(CNc3cccc([N+](=O)[O-])c3)C2=O)cc1 34690795 NOWZYYYUKARTHZ-YVLHZVERSA-N 398.444 3.767 10 40 GHCB CSc1ccc(-c2c3c(nc4nc(N)nc(N)c24)-c2ccccc2C3=O)cc1 10339135 CQXFTGAEVHJRLX-UHFFFAOYSA-N 385.452 3.790 10 40 GHCB CN1C(=O)C(=Cc2ccc(Sc3ccc(Cl)cc3)s2)C(=O)N(C)C1=O 4545295 ZXZQGXYTPWMFDG-UHFFFAOYSA-N 392.889 3.987 10 40 GHCB CC(C)N1CCCc2cc(CNC(=O)CCc3nc4ccccc4[nH]3)ccc21 19660714 CSYWITNSKAFELY-UHFFFAOYSA-N 376.504 3.973 10 40 GHCB C[C@@H](NC(=O)c1ccccc1CN1CCCC1)c1ccc(N2CCOCC2)cc1 19662422 HPJYEPZKOJXTFY-LJQANCHMSA-N 393.531 3.610 10 40 GHCB COc1cc(/C=C2/SC(N3CCCCCC3)=NC2=O)cc(OC)c1OC 1066790 OHVAIHPVLHIYLX-FOWTUZBSSA-N 376.478 3.559 10 40 GHCB COc1ccc([C@@]2(O)CN(c3ccc(Cl)cc3)C3=[N+]2CCCS3)c(F)c1 2966030 KSGUXUSTSJJXOX-IBGZPJMESA-N 393.891 3.658 10 40 GHCB CCCCOc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 5097867 QSQORAKFPTUFHM-QFIPXVFZSA-N 383.536 3.964 10 40 GHCB CN(CC(=O)NC(C)(C)C)Cc1c(O)ccc2cc(Br)ccc12 8147863 HIXHFPYGKMTBTG-UHFFFAOYSA-N 379.298 3.654 10 40 GHCB COC(=O)c1ccc(Cl)c(NC(=S)NCCCN(C)c2ccccc2)c1 225748301 HYIVLVCDFNNYJS-UHFFFAOYSA-N 391.924 3.940 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1 408897439 JHEUIINQPJRVIH-DQPIFXJKSA-N 378.428 3.839 10 40 GHCB COc1ccccc1OCCOc1ccccc1/C=C1\SC(=S)NC1=O 5203344 XGTKDRWNDKCGEB-ATVHPVEESA-N 387.482 3.642 10 40 GHCB Cc1cc(C(=O)Nc2ccc(N3CCOCC3)nc2)c(C)n1-c1ccccc1 22994685 FRICQBNLMHQJNZ-UHFFFAOYSA-N 376.460 3.578 10 40 GHCB CCc1ccc(O[C@H](CC)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 113969645 UYWDLTFTWUJIDH-JOCHJYFZSA-N 382.504 3.559 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)c1 409242158 NBJBMLGZMSBBFZ-XNTDXEJSSA-N 384.819 3.632 10 40 GHCB COC(=O)c1[nH]c2ccccc2c1/C=C1/SC(=S)N(Cc2ccco2)C1=O 13693152 DBSIDOHDYRIESF-OQLLNIDSSA-N 398.465 3.949 10 40 GHCB CCOC(=O)c1csc(=O)n1CC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 95945753 KHBRYLJZPXXWOQ-UHFFFAOYSA-N 398.484 3.685 10 40 GHCB CN1C(=O)C(=Cc2ccc(Sc3ccc(Cl)cc3)cc2)C(=O)N(C)C1=O 409108074 VJNJBEIVULHWBE-UHFFFAOYSA-N 386.860 3.925 10 40 GHCB CCC1=NN2C(=N)/C(=C\c3ccc(-c4ccc(C(=O)O)cc4)o3)C(=O)N=C2S1 5857341 MTHVSMCZGXHTMW-ILUQACKLSA-N 394.412 3.674 10 40 GHCB O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C\c1c(Cl)cccc1Cl 5900236 FXXKXSRCRFXSDN-LCYFTJDESA-N 375.211 3.655 10 40 GHCB Cc1cc2oc(=O)c(C)c(C)c2c(O)c1C1=NN[C@H](c2ccc(N(C)C)cc2)C1 13683563 KJLMXSPHPDUEJQ-KRWDZBQOSA-N 391.471 3.929 10 40 GHCB Cc1cc(N2CCCC2)c(F)cc1/C=C1\NC(=O)N(Cc2ccc(F)cc2)C1=O 34865514 IHSMDDFUKSTGSK-UNOMPAQXSA-N 397.425 3.966 10 40 GHCB CC1=NN(c2ccc(C)c(Cl)c2)C(=O)/C1=C\Nc1ccc2nc(O)[nH]c2c1 408527804 GMHZPAWYLQGNLG-ZROIWOOFSA-N 381.823 3.949 10 40 GHCB COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccc(O)c(OC)c1 409074613 VXRJEPAEXFTZDP-AQTBWJFISA-N 397.471 3.964 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 1211326 FHIYHGBICRFANO-DHZHZOJOSA-N 386.292 3.515 10 40 GHCB COc1cccc(N2C(=O)N=C(O)/C(=C\c3cn(C)c4ccccc34)C2=O)c1 1445457 DFTBLBLATSUWBL-LICLKQGHSA-N 375.384 3.694 10 40 GHCB biogenic CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OC(C)C 408817919 WPBHFHIASBDSFJ-SFQUDFHCSA-N 394.427 3.539 10 40 GHCB Cc1cccc(-n2ccnc2SCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 7121640 WIIZMSUVFIMAJA-UHFFFAOYSA-N 394.544 3.997 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)O)C3=O)c2C)c(C)c1 409131000 JCVFOSVWPVAUPG-RQZCQDPDSA-N 384.457 3.832 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3ccccc3)C2=O)cc1 16684078 DLZCZMBXPYOWBF-ATVHPVEESA-N 398.509 3.925 10 40 GHCB CCN(CC)Cc1c(O)ccc2cc(-c3nc4ccccc4n3C)c(=O)oc12 941143 BZAPTYGRFBHIIO-UHFFFAOYSA-N 377.444 3.894 10 40 GHCB biogenic COc1ccccc1NC(=O)[C@@H](/N=N/c1ccc(Cl)cc1[N+](=O)[O-])C(C)=O 100049894 QPHCXDDGQQLPIM-BZROSYFNSA-N 390.783 3.937 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)cc3Cl)C2=O)cc1 4704560 LQQZJSSQTYPPRT-RIYZIHGNSA-N 375.211 3.968 10 40 GHCB COc1ccc(OC)c(/C=C2\C(=O)N=C(O)N(c3ccc(C(C)C)cc3)C2=O)c1 8768252 REOWMUIREMRCOU-LDADJPATSA-N 394.427 3.698 10 40 GHCB CCCCOc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(OC)cc3)C2=O)cc1 408899726 QBOLGYZGLCBXGP-RGEXLXHISA-N 394.427 3.541 10 40 GHCB CCOC(=O)c1cc(NC(=S)NCCN(C)c2ccccc2)ccc1Cl 225571847 NDFVKRHWDYZOJH-UHFFFAOYSA-N 391.924 3.940 10 40 GHCB O=[N+]([O-])c1ccc(-c2c(-c3ccc(O)c(O)c3O)n[nH]c2C(F)(F)F)cc1 4994957 SYXZFDGFXLDTIC-UHFFFAOYSA-N 381.266 3.788 10 40 GHCB O=C1/C(=C\c2nc3ccccc3[nH]2)C(O)=NC(=S)N1c1cccc(Cl)c1 6813988 LSQIYZSLFRTAJM-XFXZXTDPSA-N 382.832 3.888 10 40 GHCB COc1ccc(OC)c(NC(=O)CSc2nc3cc(F)c(F)cc3[nH]2)c1 25053642 JNNBRRQBGWVFAN-UHFFFAOYSA-N 379.388 3.589 10 40 GHCB CCN(CC)c1ccc(CNC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 224837927 HSYUJSOJAPAIDY-UHFFFAOYSA-N 387.483 3.963 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C(=O)OC)cc2)C(=O)/C1=C\c1ccc(C)cc1 8371616 JIOVFTCPBSXXFT-UYRXBGFRSA-N 391.423 3.659 10 40 GHCB O=C(O)CCCN1C(=O)/C(=C/c2ccccc2Br)SC1=S 13547884 FINNRVWTSJEZMM-FLIBITNWSA-N 386.292 3.515 10 40 GHCB Cc1cccc(CC(=O)NC[C@H](c2ccc3c(c2)CCCN3C)N2CCCC2)c1 16838240 VVGVKVMTDSTPQD-XMMPIXPASA-N 391.559 3.873 10 40 GHCB COc1ccc(-n2nnnc2/C=C\Nc2ccccc2C(=O)c2ccccc2)cc1 101699937 GWOHEBLWGBICRF-NXVVXOECSA-N 397.438 3.985 10 40 GHCB aggregator O=C1C(=Cc2ccncc2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 408813851 FRMBKFPDRPJHML-UHFFFAOYSA-N 385.448 3.830 10 40 GHCB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c2ccccc12 408914164 ODLHFHKFDRUUCZ-WOJGMQOQSA-N 390.370 3.654 10 40 GHCB CN(C)c1ccc([C@H]2SCCN2C(=O)c2cc3ccccc3oc2=O)cc1 863327 KTXUPCOVVXPAAI-HXUWFJFHSA-N 380.469 3.747 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)Nc3ccccc3F)sc2n1 10645071 PALJTTICUJKJIW-NSHDSACASA-N 387.436 3.818 10 40 GHCB CN1CCCc2cc([C@H](CNC(=O)NCc3cccs3)N3CCCC3)ccc21 36705364 XQLUEPIXQFMVTR-NRFANRHFSA-N 398.576 3.767 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3ccc(N4CCCC4)o3)C(O)=NC2=S)cc1 59138538 QLFYIKHQFOGGEE-FOWTUZBSSA-N 397.456 3.560 10 40 GHCB C[C@@H]1CCCN(c2ccc([C@@H](C)NC(=O)[C@@H]3COc4ccccc4O3)cc2)C1 218298997 SLGMRTWJAMPASR-YVHKJVDXSA-N 380.488 3.940 10 40 GHCB Cc1cc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)ccc1N1CCCC1 409081896 LHMMOYBIEBMSNZ-UWCCDQBKSA-N 388.558 3.975 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1 974453 INJJOSSFKRLYRY-NVNXTCNLSA-N 385.422 3.519 10 40 GHCB COC(=O)c1[nH]c2ccccc2c1/N=N/N1CCN(c2ccccc2F)CC1 2262717 ADNMEAVQGGXBJC-WCWDXBQESA-N 381.411 3.915 10 40 GHCB COc1ccc(OC)c(-n2c(-c3ccc(S(C)(=O)=O)cc3)cc(C=O)c2C)c1 2383800 IBBLJZKNUODJQI-UHFFFAOYSA-N 399.468 3.686 10 40 GHCB Cc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(Cl)c(Cl)c1O 4173222 TWFZKGOHEKCRSO-UHFFFAOYSA-N 377.205 3.716 10 40 GHCB CCCCC(OC)(OC)c1nn(C)c2c3c(ccc12)C(=O)c1ccccc1C3=O 6273200 APRIKWIKEWIBTP-UHFFFAOYSA-N 392.455 3.985 10 40 GHCB Cc1cc(C(=O)NC[C@@H]2COc3ccccc3O2)c(C)n1-c1ccccc1F 58391561 WWSRDKHYJJROAD-MRXNPFEDSA-N 380.419 3.803 10 40 GHCB O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)SC(=S)N1C(=O)c1ccc(F)cc1 408720058 WSRRZZBPHVTNOL-NTEUORMPSA-N 388.401 3.776 10 40 GHCB CN1C(=O)/C(=C/c2cn(CC(=O)NC3CCCC3)c3ccccc23)SC1=S 409137530 VSGMRGLDUGMSKJ-YVLHZVERSA-N 399.541 3.531 10 40 GHCB COC(=O)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 1238458 NADLFIMNINNNNG-BOPFTXTBSA-N 399.493 3.640 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])o2)C(O)=NC(=S)N1c1ccc(Cl)cc1 1301541 ARYRBCNUKOYMQZ-YRNVUSSQSA-N 377.765 3.513 10 40 GHCB CC(=O)Oc1ccc(/C=C2/C(=N)N3C(c4ccccc4)=CSC3=NC2=O)cc1 2355948 MIPLRRWGQFRABF-ZJNHSXOMSA-N 389.436 3.916 10 40 GHCB N=C1/C(=C/c2cccc3ccccc23)C(=O)N=C2SC(c3cccnc3)=NN12 5164601 BWVZVLSGLFOZLC-JMCWYTMQSA-N 383.436 3.902 10 40 GHCB COc1cc(/C=C2\C(=O)N(c3ccc(C)c(Cl)c3)C(=O)N=C2O)ccc1O 8856478 KCEOZAHBADHPPD-QPEQYQDCSA-N 386.791 3.869 10 40 GHCB O=C1/C(=C/c2ccc(Br)cc2)SC(=S)N1C[C@H]1CCCO1 9188343 OJZYZRWABNIPSQ-YFBAIUBQSA-N 384.320 3.829 10 40 GHCB COc1ccc(N2CCN(Cc3cc(=O)oc4c(C)c(C)ccc34)CC2)cc1 54105859 BSXHXAPFWQXXOP-UHFFFAOYSA-N 378.472 3.741 10 40 GHCB biogenic COc1cc2c(cc1O)[C@@H](c1ccc(O)c(O)c1)[C@@H]1COC(C)(C)OC[C@H]1C2 1077996503 GACLBPGDLVRRRN-IUSZMWJPSA-N 386.444 3.515 10 40 GHCB biogenic CCOC(=O)c1c2c(n3ccc(-c4ccncc4)cc13)C(=O)c1ccccc1C2=O 2694688 HVEMSFNROHUWOD-UHFFFAOYSA-N 396.402 3.953 10 40 GHCB O=C(NCc1ccc(N2CCCC2)cc1)NCc1ccc(N2CCCC2)cc1 31091122 WTKWGJXOJTVUSE-UHFFFAOYSA-N 378.520 3.886 10 40 GHCB CC[C@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1 44883750 JAVMTQABYOGJHV-IBGZPJMESA-N 388.895 3.650 10 40 GHCB CC(C)c1ccc(N/C=C2\C(=O)N=C(S)N(Cc3ccccc3)C2=O)cc1 103129037 YBGFXCYMUUBDBM-LDADJPATSA-N 379.485 3.961 10 40 GHCB CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc([N+](=O)[O-])o1 409034009 GUGYJETXALCAJX-QPJJXVBHSA-N 387.220 3.689 10 40 GHCB CCc1nnc(S/C(=C\c2ccc(N(CC)CC)cc2OC)C(=O)O)o1 7342692 LSIQSVSTUKYPET-GDNBJRDFSA-N 377.466 3.705 10 40 GHCB CCc1ccc(NC2=NC(=O)/C(=C/c3cc([N+](=O)[O-])cc(OC)c3O)S2)cc1 208526681 PKYVKLCGDTUYNR-SXGWCWSVSA-N 399.428 3.954 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc(OC)c1O 408975606 BDXNJSWUIMRVLD-WJDWOHSUSA-N 399.830 3.931 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(O)cc2)C(=O)N(c2ccc(Cl)cc2)C1=S 409008944 AOWBKHMLKAUXNG-LFIBNONCSA-N 386.860 3.609 10 40 GHCB CCOc1ccc2ccccc2c1/C=C1/C(=O)NC(=O)N(C2CCCC2)C1=O 409196517 ONPFPWFOFALAGZ-AQTBWJFISA-N 378.428 3.643 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccccc1C(=O)O 408797612 SQGZLKYTDDADAM-PDGQHHTCSA-N 377.396 3.570 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc(O)c(OC)c1 409058463 OXAYBTNRQAMXJC-UVTDQMKNSA-N 399.830 3.931 10 40 GHCB CCc1cccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccccc32)c1 35527522 YXIPHVCBWZXRCA-UHFFFAOYSA-N 382.485 3.638 10 40 GHCB Cc1ccc(-c2csc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1 31903717 LRTUMLPHLBYCSW-UHFFFAOYSA-N 375.431 3.828 10 40 GHCB CCC(=O)N[C@@H](C)[C@@H](c1cccs1)N1CCN(c2ccc(OC)cc2)CC1 23181507 VVQIVVCYGKKCRM-KKSFZXQISA-N 387.549 3.535 10 40 GHCB O=C1OC2(CCCCC2)OC(=O)C1=CNc1nc(-c2cccs2)cs1 23127173 CWZOPSNIZNSNTR-UHFFFAOYSA-N 376.459 3.928 10 40 GHCB CC(C)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 1201319 CEGXUDVZSOYDNV-CPNJWEJPSA-N 377.444 3.542 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C/c1ccc(OCc2ccccc2)cc1 1455669 OTYYFMZBTVDVOL-XMHGGMMESA-N 380.469 3.568 10 40 GHCB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 4147435 HDJWMXMGIIJWFQ-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB CC(C)c1ccccc1O[C@@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1 19933548 LMQXPBIBERZYFG-SFHVURJKSA-N 382.504 3.730 10 40 GHCB COc1ccc(OC)c(CNC2(c3ccccc3)C(=O)c3ccccc3C2=O)c1 20575071 ZVGWJACMIKKSPC-UHFFFAOYSA-N 387.435 3.768 10 40 GHCB Cc1cccc(N2NC(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1 4815213 DYJWJPKSPDBIID-LDADJPATSA-N 389.367 3.625 10 40 GHCB CCCCNC(=O)CCN1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S 5596631 TYDGPITYCXUZFR-SSZFMOIBSA-N 392.546 3.593 10 40 GHCB Cc1nc(SCC(=O)N(C)Cc2ccc(N(C)C)cc2)n(CC(C)C)c1C 7030001 XVJCFFFSLPLCDX-UHFFFAOYSA-N 388.581 3.973 10 40 GHCB Cc1ccc(C(=O)Oc2ccccc2/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1 33584803 YWEUGVBINFXIPG-HMMYKYKNSA-N 398.418 3.676 10 40 GHCB CCOC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1Cl 408586072 KWFUWEUWEMEXAP-DHDCSXOGSA-N 392.839 3.967 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)sc2c1CCCCC2 2486398 OKQSNZTXVSFHIS-CHWSQXEVSA-N 391.489 3.799 10 40 GHCB CC1=CC2=NC(=O)/C(=C/c3ccc(OCCOc4ccccc4)cc3)C(=N)N2O1 41078464 SIRKQKRHQBOUCC-QLDKJHNESA-N 389.411 3.595 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C(=O)OC)cc2)C(=O)/C1=C\c1cccc(C)c1 107607057 QEWXQSZMFGYEQR-UYRXBGFRSA-N 391.423 3.659 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccc(Br)c2)C1=O 408871273 ZADKLZYRMLGMLG-PTNGSMBKSA-N 399.244 3.678 10 40 GHCB COC(=O)c1ccc(/C=C2\SC(Nc3ccc(OC)cc3OC)=NC2=O)cc1 5372923 KFEJNQLCRRIGCF-YVLHZVERSA-N 398.440 3.573 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)S1 20265149 XJBSOKCNTZKSLN-NVNXTCNLSA-N 383.385 3.684 10 40 GHCB O=C1NC(=O)C(=C/C=C/c2ccc(-c3cc(Cl)ccc3Cl)o2)C(=O)N1 4536197 FMAFXJUEXNHKBM-OWOJBTEDSA-N 377.183 3.559 10 40 GHCB Cc1ccc(C(=O)N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 5745376 PMSRKKJIEFGPQF-CXUHLZMHSA-N 383.450 3.765 10 40 GHCB COc1cc(/C=C2\SC(=S)N(CCOc3ccccc3)C2=O)ccc1O 9188771 WAWFSZMWUJEVCR-ATVHPVEESA-N 387.482 3.681 10 40 GHCB CC(C)CCN(C)c1ccc(/C=C2/C(=O)NN(c3ccc(F)cc3)C2=O)cc1 13800282 LCXBESUVNGDHSN-ZHZULCJRSA-N 381.451 3.769 10 40 GHCB Cc1cc(C)c(C)c(O[C@@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 22511472 GTCUNPAKPLYREO-IBGZPJMESA-N 382.504 3.532 10 40 GHCB CCCOC(=O)CN1C(=O)/C(=C/c2ccc(OCCC)cc2)SC1=S 1809346 JRDCYQWXPRBVRK-PTNGSMBKSA-N 379.503 3.630 10 40 GHCB CC(/C=C1\SC(=S)N(CC(=O)Nc2cccnc2)C1=O)=C\c1ccccc1 4140163 UJYUORPOXWBWRS-RLGXRJJKSA-N 395.509 3.868 10 40 GHCB COc1cccc(OC)c1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 5527496 XYEGKWAUWWATMS-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)NC3CCCC3)c2C)cc1 16047171 SCBLTGNLUCXFHK-MRXNPFEDSA-N 384.476 3.707 10 40 GHCB COc1ccc(CN2C(=O)/C(=C\c3ccc(O)c(OC)c3)SC2=S)cc1 16216734 QVANVNUKFGCYDS-LICLKQGHSA-N 387.482 3.811 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(c3cccc(OC)c3)C(C)=C2C(=O)OC)cc1 32109283 LPSJWNCLAIJHPR-MOSHPQCFSA-N 393.439 3.971 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4Cl)[nH]n3)CC2)cc1 46455136 UEZJAUGXTIABOE-UHFFFAOYSA-N 396.878 3.701 10 40 GHCB O=C(Nc1cccc(-c2nnco2)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 47487499 UXKBJXPUYNIZLR-GOSISDBHSA-N 394.431 3.655 10 40 GHCB CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCC(=O)N2CCCC2)cc1 100507510 NRTRCBSHYYCHQV-GHVJWSGMSA-N 380.448 3.947 10 40 GHCB O=C(O)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(F)c1)N2 103020652 DNWUTOQEGRTHMD-WWMYMODYSA-N 380.419 3.857 10 40 GHCB CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217027313 SJGYMUCWPAZYNE-HSZRJFAPSA-N 395.547 3.529 10 40 GHCB Cc1cccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)NC2=S)c1C 409135257 UBFSDNGVOCAWGM-SFQUDFHCSA-N 394.496 3.922 10 40 GHCB C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 1281937 IGVIBAJPLLIKGO-GPLLRDDGSA-N 399.493 3.940 10 40 GHCB CCC(CC)C1=NN2C(=N)/C(=C\c3ccc(OC)c(OC)c3)C(=O)N=C2S1 5576548 MJKBEOFKHHXVSN-ILUQACKLSA-N 386.477 3.759 10 40 GHCB CCc1ccc(NC2=NC(=O)/C(=C/c3ccccc3OCC(=O)O)S2)cc1 5794726 AXUGHYBTRLROBW-BOPFTXTBSA-N 382.441 3.795 10 40 GHCB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C\c1ccc(-c2cccc(Cl)c2)o1 13660039 GMMISOORLXTWLH-YBEGLDIGSA-N 396.786 3.855 10 40 GHCB CN(C)c1ccc(/C=C2/SC(=S)N(C(=O)c3ccccc3F)C2=O)cc1 107951465 OLHLADWXCSXCGJ-LFIBNONCSA-N 386.473 3.933 10 40 GHCB O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl 408919191 UPGOOSNCBIBTGP-QPEQYQDCSA-N 395.242 3.964 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(Br)cc1 10906790 DHDVGNIWOTWWOK-UHFFFAOYSA-N 389.293 3.558 10 40 GHCB CCN(C)c1ccc(/C=C2/C(=O)NN(c3cc(Cl)cc(Cl)c3)C2=O)cc1 17150073 BWMCEQSCHBLFLB-IUXPMGMMSA-N 390.270 3.911 10 40 GHCB Cc1oc2c(CNCCCC(=O)O)c(O)ccc2c(=O)c1-c1ccc(F)cc1 20111158 GVVAINFSXNMLNU-UHFFFAOYSA-N 385.391 3.568 10 40 GHCB biogenic Cc1cccc(N2C(=O)/C(=C/c3c(C)[nH]c4ccccc34)C(=O)NC2=S)c1 2285627 IKNFPCPNQKNXFT-GZTJUZNOSA-N 375.453 3.616 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O 408903653 VKWHDNCWBDJNAF-LVLBFHFTSA-N 382.391 3.669 10 40 GHCB O=C(O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCCO4)SC2=S)c1 4746623 GAGKMKXHFZVMHV-CXUHLZMHSA-N 399.449 3.562 10 40 GHCB CN(C)c1cc(Nc2ccc(F)cc2)c2c(c1N)C(=O)c1ccccc1C2=O 5482724 PUZYLIYDHPZCOG-UHFFFAOYSA-N 375.403 3.993 10 40 GHCB CN1CCc2cc([C@H](CNC(=O)CCc3ccccc3)N3CCCCC3)ccc21 13007736 NDUQMWFUUHVYRR-DEOSSOPVSA-N 391.559 3.955 10 40 GHCB CCOc1cc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2O)ccc1O 59135785 MKISPSABGCRBLC-FMIVXFBMSA-N 386.404 3.602 10 40 GHCB COc1ccccc1NC(=O)COC(=O)c1cccc(-n2c(C)ccc2C)c1 408645272 JPSOICZFMFASJP-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)N=C2C)c([N+](=O)[O-])cc1OC 832804 IUOPNJCYHATIPY-CXUHLZMHSA-N 381.388 3.727 10 40 GHCB CCCN1C(=O)/C(=C/C=C2/Sc3ccccc3N2CCO)SC1=S 1024902 KMUWDJKTOHKZTA-UFSWOOAPSA-N 378.544 3.587 10 40 GHCB CCN(CC)c1ccc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)c(OC)c1 3659068 KEHDRMJKQQPYRU-XDHOZWIPSA-N 397.450 3.773 10 40 GHCB CCCC1=NN2C(=N)/C(=C/c3ccc(Br)cc3)C(=O)N=C2S1 4508880 MHIUXDBGGMTISY-ZWGDPFMXSA-N 377.267 3.868 10 40 GHCB COc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC 4872008 AQPGTJYEZZHVFC-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB biogenic COc1cc(/C=C2\SC(Nc3ccc(F)cc3)=NC2=O)ccc1OCC#N 8238662 NYMSRHNUIUOBTO-BOPFTXTBSA-N 383.404 3.819 10 40 GHCB CC(C)CCN1C(=O)/C(=C\N2CCN(c3ccccc3)CC2)SC1=S 9421965 OAAMMSMEJYIZAM-SAPNQHFASA-N 375.563 3.556 10 40 GHCB Cc1cc(-c2csc(NC(C)C)n2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 13070746 ZUFPSGKMPKJGJK-UHFFFAOYSA-N 390.534 3.685 10 40 GHCB CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(CCC(=O)O)C1=O 13343513 VRQDQAOHZIBDSQ-WJDWOHSUSA-N 387.482 3.914 10 40 GHCB COc1ccc(N(C)CCNC(=S)Nc2ccc(OC)c3ncccc23)cc1 225799634 AMMVCYVSRLJQNG-UHFFFAOYSA-N 396.516 3.675 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCc2nc3ccsc3c(=O)[nH]2)cc1 5174320 QROFUFROOUTCAT-UHFFFAOYSA-N 379.441 3.749 10 40 GHCB Cc1cc(C(=O)CSc2nccn2C)c(C)n1-c1ccc2c(c1)OCCO2 12525146 BNPKMFHEICMLAK-UHFFFAOYSA-N 383.473 3.574 10 40 GHCB O=C(O)CCN1C(=O)/C(=C\c2ccc(-c3cccc(F)c3)o2)SC1=S 32624164 VXSPURBWGICMFJ-NTEUORMPSA-N 377.418 3.762 10 40 GHCB COc1ccc(N2CCN(CC(=O)c3c[nH]c4ccc(C)cc34)C[C@H]2C)cc1 35844235 ZEIMRPMNCPVADE-QGZVFWFLSA-N 377.488 3.878 10 40 GHCB O=C(Nc1ccc2c(c1)OCCCO2)N(Cc1ccccc1O)C[C@H]1CCCO1 58166805 MZDNXXUFHZKGBG-GOSISDBHSA-N 398.459 3.767 10 40 GHCB COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 409024271 PAPSYUYQTYWKGY-UNOMPAQXSA-N 391.423 3.879 10 40 GHCB Cc1ccc(CN2C(=O)N/C(=C/c3ccc(N4CCCC4)cc3F)C2=O)cc1 409240863 QHGOTJFLVOLYKD-UDWIEESQSA-N 379.435 3.827 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccccn2)SC1=S)c1cccc2ccccc12 4746666 MQDMIYTVMABUSF-SFQUDFHCSA-N 391.477 3.781 10 40 GHCB CC1(C)[C@H]2CC[C@H]1[C@@H](O[C@@H]1CC(=O)C[C@H]3C(=O)c4cccc(O)c4C(=O)[C@H]13)C2 101168366 NLLZPZMJMSXUEY-BVRWXKPPSA-N 382.456 3.576 10 40 GHCB Cn1ccc(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cc1=O 53709519 KDKZSWNKIRLLRW-SFHVURJKSA-N 381.501 3.720 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)SC1=S 5032407 MUFFOAIRBWYSLL-JNNKLVPLSA-N 377.418 3.760 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408894400 QICMBRRRLMEWTP-PDGQHHTCSA-N 393.439 3.889 10 40 GHCB CCN1C(=O)/C(=C/c2ccc(Br)c3nsnc23)SC1=S 1776010957 LCJUZMGEZFRMQJ-YVMONPNESA-N 386.321 3.675 10 40 GHCB O=C(Cc1cccc2ccccc12)NN1C(=O)/C(=C/c2ccco2)SC1=S 33681625 HVTVORNDIBNDEU-ATVHPVEESA-N 394.477 3.908 10 40 GHCB COC(=O)C1=CN(c2ccc(C)c(Cl)c2)c2ccc(F)cc2S1(=O)=O 64979254 KLRLHHKYNASWEG-UHFFFAOYSA-N 381.812 3.727 10 40 GHCB Cc1cc(/C=C2\C(=O)NN(c3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 6275730 REHAPVUIEOZXIG-DEDYPNTBSA-N 375.403 3.695 10 40 GHCB CCOc1ccc(N2C(=O)/C(=C\c3c(C)[nH]c4ccccc34)C(=O)N=C2O)cc1 9042265 ACYVXGDSJIXKHT-PDGQHHTCSA-N 389.411 3.746 10 40 GHCB COc1cc(Br)cc(/C=C2\SC(=S)N(C(C)C)C2=O)c1O 36617129 CASZOAZKZUKSNE-WZUFQYTHSA-N 388.308 3.773 10 40 GHCB Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)c(C)n1-c1ccc(F)cc1 8726009 OKXIHPFMZMVQTC-UHFFFAOYSA-N 394.233 3.980 10 40 GHCB COc1cccc(/C=C2\SC(N3CCN(c4ccccc4F)CC3)=NC2=O)c1 9189260 KWSNFFGZWAOQDZ-RGEXLXHISA-N 397.475 3.627 10 40 GHCB CN(C)c1ccc(CNC(=O)[C@H]2CCn3c(C(=O)c4ccccc4)ccc32)cc1 51364608 DNGOOOZTIXJDAX-FQEVSTJZSA-N 387.483 3.589 10 40 GHCB O=C1/C(=C\C=C\c2ccccc2[N+](=O)[O-])C(O)=NC(=S)N1c1ccc(F)cc1 16448948 FEEYXBKGLKOBTP-VLVOFSMPSA-N 397.387 3.962 10 40 GHCB CC[C@H](C)c1ccccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 20807209 DRMNDTDVQFZCHW-PZJWPPBQSA-N 398.547 3.771 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C(C)=O)c2)C(=O)/C1=C\c1ccc(F)cc1 4681331 UYTBHYXWJFQDFD-ODLFYWEKSA-N 379.387 3.906 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2cc(OC)ccc2OC)SC1=S 5371393 QPKBHMSFKKBDLP-NWFCWYBLSA-N 395.502 3.548 10 40 GHCB CC[C@@H](C)Oc1cccc(C(=O)Nc2cc(OC)ccc2N2CCOCC2)c1 7496940 KLUYBKJMIHUHCZ-MRXNPFEDSA-N 384.476 3.961 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)on3)CC2)cc1 27580181 RIGCZWUTDHFKJU-UHFFFAOYSA-N 391.471 3.929 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1Cl 408987986 QAWAHJDCQMPKKH-AUWJEWJLSA-N 399.790 3.531 10 40 GHCB COc1cc(N2CCCC2)ccc1/C=C1/NC(=O)N(Cc2ccc(C)cc2)C1=O 409245234 PKOVOIDMBVKPJV-DEDYPNTBSA-N 391.471 3.697 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 1238457 KDHQPBOMSXIRRL-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)cc1OCC 4145271 QBFFZLBCKAKVKX-AHFBHCKLSA-N 390.505 3.564 10 40 GHCB CCN1C(=O)C(=Cc2ccc3c(c2)[C@@H](C)CC(C)(C)N3C)C(=O)N(CC)C1=S 113775760 FXKNDGDJWSDFJV-AWEZNQCLSA-N 399.560 3.788 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1 408817918 WOXIKJLMKFJHHA-CPNJWEJPSA-N 378.428 3.759 10 40 GHCB COC(=O)[C@H](C)N1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S 1276933 NTSVWXCYASQJKB-KSRYWAHESA-N 376.286 3.756 10 40 GHCB Cc1cc(C(=O)OCC(=O)N2CCc3ccccc3C2)c(C)n1-c1ccccc1 3224076 ZOZSTCOXNNMLLZ-UHFFFAOYSA-N 388.467 3.836 10 40 GHCB COc1ccc([C@H]2CCCCCN2CC(=O)NCc2ccc(N(C)C)cc2)cc1 9468406 OIJGLIJTJIWHRP-HSZRJFAPSA-N 395.547 3.995 10 40 GHCB CCc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(OC)c(OC)c3)C2=O)cc1 41108864 JKRRMZUHYKSPTO-WJDWOHSUSA-N 380.400 3.773 10 40 GHCB CCOC(=O)c1cccc(NC(=S)NCCN(C)c2ccc(C)cc2)c1C 225796249 BRWPSCWVUXVUMB-UHFFFAOYSA-N 385.533 3.903 10 40 GHCB CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCOCC1 1340082 YDVSWBCUPFYYOK-UHFFFAOYSA-N 393.940 3.810 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=O)N=C(O)N(c3ccc(Cl)cc3)C2=O)o1 17056866 KGTJSWPVNAODTO-PTNGSMBKSA-N 387.823 3.650 10 40 GHCB CC[C@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(N2CCOCC2)cc1 20110445 LSTZKXDPEARXTM-NRFANRHFSA-N 382.504 3.614 10 40 GHCB O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)N1CCCCC1 39704719 NMIGTDJTVRXJFZ-GOSISDBHSA-N 385.533 3.834 10 40 GHCB O=C(/C=C/c1cnccn1)N(Cc1cccs1)c1ccc2c(c1)OCCO2 95365056 MFIUHUJPWJCSDJ-ZZXKWVIFSA-N 379.441 3.556 10 40 GHCB Cc1cc(/C=C2\SC(=O)NC2=O)c(C)n1-c1ccc(Cl)c(C(=O)O)c1 96475660 DXTUXIZELWWQPC-NSIKDUERSA-N 376.821 3.770 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cccc4ccccc34)CC2)c([N+](=O)[O-])c1 107910646 VQYDPBPSWGRXSK-UHFFFAOYSA-N 391.427 3.719 10 40 GHCB COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)C(C)C)cc1F 58311170 WWNYQSGOOZSAJT-HNNXBMFYSA-N 399.466 3.813 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cccc(OC)c1O 408892338 IEKAZGXUKAPEJL-LGMDPLHJSA-N 379.412 3.668 10 40 GHCB CCOc1ccccc1/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O 1766421 PQYWGMWQZITRDB-NTCAYCPXSA-N 379.503 3.932 10 40 GHCB Cc1cccc(CN2C(=O)N/C(=C/c3cc(C)n(-c4ccccn4)c3C)C2=O)c1 4661126 OYBFKXJCLJHRCG-DEDYPNTBSA-N 386.455 3.890 10 40 GHCB CC1=NN2C(=N)/C(=C\c3cc(C)n(Cc4ccccc4)c3C)C(=O)N=C2S1 5576309 AHNHRJXODLAYIN-RPKGUNMRSA-N 377.473 3.792 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(N3CCCCCC3)o2)C1=O 6083650 JLCFNJIEZHVBIQ-VKAVYKQESA-N 393.443 3.635 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 15013135 SQFQNHXGCQXWSD-VLURKWGBSA-N 398.459 3.834 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)N3CCCCC3)C2=O)cc1 16661689 QHFDDWAJOMCIDA-SAPNQHFASA-N 388.558 3.989 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)NC(C)C)n2Cc2ccco2)cc1 44086179 GYJWEVDYVPLOTP-UHFFFAOYSA-N 385.489 3.817 10 40 GHCB Cc1cc(C(=O)NCCCc2nnc3n2CCCC3)c(C)n1-c1ccccc1F 95451066 WWDYPBWFQIFYJD-UHFFFAOYSA-N 395.482 3.524 10 40 GHCB Cc1cc(/C=C2\NC(=O)N(Cc3ccc(F)cc3)C2=O)c(C)n1-c1ccccn1 96515494 DDDMCWPEDVTOJT-UNOMPAQXSA-N 390.418 3.721 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccccc1OC 408893945 OTNCALNIHIMWBD-AQTBWJFISA-N 379.412 3.581 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3cccc(Cl)c3)C2=O)c1C 409101697 QOBCTNAWVFFCFC-CXUHLZMHSA-N 387.892 3.610 10 40 GHCB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1c(Cl)cccc1Cl 409203673 XBNNVWWEXUOAMY-XYOKQWHBSA-N 379.174 3.799 10 40 GHCB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)cc1Cl 409389152 ANCHMWRKBSNESF-JXCQQFQQSA-N 399.834 3.579 10 40 GHCB Cc1ccc(N2C(=O)N=C(O)/C(=C\C=C\c3ccccc3[N+](=O)[O-])C2=O)cc1 1192716 DUKFVQOOMKTADZ-ANSBUGDOSA-N 377.356 3.966 10 40 GHCB CC(C)(C)N1C(=O)/C(=C2/C(=O)Nc3ccc(Br)cc32)SC1=S 5552095 XXILIYLHWZSZND-KHPPLWFESA-N 397.319 3.771 10 40 GHCB CC[C@@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 58756684 YFMBXUPZVDQXSW-QFIPXVFZSA-N 394.563 3.731 10 40 GHCB Cn1cc(/C=C2/C(=O)NC(=O)N(CCC3=CCCCC3)C2=O)c2ccccc21 4817112 DOEWZTFSLBZFSM-AQTBWJFISA-N 377.444 3.531 10 40 GHCB Cc1ccc2c(c1)C(C)(C)[C@@]1(/C=C/c3ccccc3[N+](=O)[O-])NC(=O)CCN21 5201002 DBZURUNILWFRFW-YUAYGMJFSA-N 377.444 3.930 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(-c3ccc(F)cc3)o2)SC1=S 5423532 VFWZCEBSMLJBQZ-PFMRQGHBSA-N 377.418 3.760 10 40 GHCB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN(C)Cc1ccc(N(C)C)cc1 7361635 PTYLBPTZYHRVOR-UHFFFAOYSA-N 391.519 3.626 10 40 GHCB COc1cccc([C@@H]2CC(c3cccs3)=NN2C(=O)CN2CCCCC2)c1O 8774949 OCZHFKUHICNPSV-KRWDZBQOSA-N 399.516 3.626 10 40 GHCB CC(=O)N(C)C1CCC2(CC1)CN(Cc1ccccc1O)Cc1ccccc1O2 19016364 JHNDAAVBTPAYJW-UHFFFAOYSA-N 394.515 3.947 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(C)n1C1CCCC1 408779285 UGPNJDBQUMHQRH-CPNJWEJPSA-N 377.444 3.886 10 40 GHCB CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccccc2OC(C)C)C1=O 408885355 ZVINOCNHZKWIIH-LGMDPLHJSA-N 378.428 3.703 10 40 GHCB O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1c1ccc2c(c1)OCCO2 3325538 DWEYKNWBJSXKRV-CAOOACKPSA-N 399.449 3.592 10 40 GHCB O=C(CCCn1cncn1)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 48364050 YFIVXNDJJMONHM-HSZRJFAPSA-N 386.455 3.823 10 40 GHCB Cc1cc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)c(C)n1-c1ccccn1 4663170 DDDMCWPEDVTOJT-XDHOZWIPSA-N 390.418 3.721 10 40 GHCB Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2n1 84083345 DIAZJXQJDFLBOA-UHFFFAOYSA-N 393.462 3.573 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(SC)c2)C(=O)/C1=C\c1ccc(O)cc1 409385163 HUPMSFFOUMVDAN-WQRHYEAKSA-N 381.453 3.991 10 40 GHCB CC(C)CCN1C(=O)/C(=C/N2CCN(Cc3ccccc3)CC2)SC1=S 30819356 NKTZCUQBVGRJRW-SDXDJHTJSA-N 389.590 3.552 10 40 GHCB CCCC1=NN(c2ccccc2)C(=O)/C1=C(/C)NCc1ccc2c(c1)OCO2 103918109 ZCDNYTMNQRYHBK-QNGOZBTKSA-N 377.444 3.982 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C(C)=O)c2)C(=O)/C1=C\c1cccc(F)c1 409381995 JPJCEVRTGAEPNU-ODLFYWEKSA-N 379.387 3.906 10 40 GHCB Oc1ccc(Br)cc1CN1CCN(CCCc2ccccc2)CC1 19361421 QCJWDPXCVPIOCV-UHFFFAOYSA-N 389.337 3.905 10 40 GHCB O=C1c2ccccc2C(=O)c2c(NC(=O)c3cc4ccccc4oc3=O)cccc21 5704897 YMYHLPITHDTPRY-UHFFFAOYSA-N 395.370 3.821 10 40 GHCB CCOc1ccc(-c2cnc(NCc3cccc(OC)c3O)n2CCOC)cc1 4679313 NJVVUORWGQEFJR-UHFFFAOYSA-N 397.475 3.922 10 40 GHCB COc1cc(Cl)cc([C@@H]2N=C(O)c3c(sc4c3CCN(C)C4)N2)c1O 6727375 IXKWSERIIGTBEM-OAHLLOKOSA-N 379.869 3.533 10 40 GHCB CCCN1C(=O)/C(=C\c2ccc(OC)c(C)c2)C(=O)N(c2ccccc2)C1=S 409023576 ZBKZPWVXRXCVOJ-NBVRZTHBSA-N 394.496 3.957 10 40 GHCB O=C(O)c1cc(N2C(=O)/C(=C/c3cccc(F)c3)SC2=S)ccc1O 5374157 NUBJGFWGXCOSMQ-AUWJEWJLSA-N 375.402 3.635 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 59435670 SFSCCKBQKBOMMH-PDGQHHTCSA-N 393.439 3.577 10 40 GHCB CCOc1cccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)c1 408876872 OMZPURSTQDVXGJ-MHWRWJLKSA-N 384.819 3.714 10 40 GHCB O=C(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 223643383 LANAFBKTVFHWOW-UHFFFAOYSA-N 382.397 3.627 10 40 GHCB COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1cccc(OC)c1O 408891549 ADPMFQPOJHALGG-RVAQLADHSA-N 393.439 3.835 10 40 GHCB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(c2cccc(F)c2)C1=O 409017274 LYGSAJRUTUOFDM-HNEYUBDGSA-N 398.459 3.834 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)sc2c1CCCCC2 2486400 OKQSNZTXVSFHIS-STQMWFEESA-N 391.489 3.799 10 40 GHCB O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1c1ccc([N+](=O)[O-])cc1 5172469 KIOCLPDBZDWHPK-NVNXTCNLSA-N 386.410 3.729 10 40 GHCB COc1cc(/C=C2/SC(Nc3cccc(C)c3)=NC2=O)ccc1OCC(=O)O 16915417 IKNXSMXFYRBJHP-LICLKQGHSA-N 398.440 3.549 10 40 GHCB COc1ccc(C2=C/C(=C\c3cc(OC)c(OC)c(OC)c3)C(=O)O2)cc1OC 33922182 GZYPYNDTBBPYPD-OVCLIPMQSA-N 398.411 3.711 10 40 GHCB CC[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 38754465 PMEZXQCLCJBASJ-HXUWFJFHSA-N 388.895 3.650 10 40 GHCB COc1cccc(NC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 11562552 ISOHVSVVNKPYHV-NRFANRHFSA-N 383.492 3.974 10 40 GHCB COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NC1CCCCCC1 17079092 BSARUDBYBUVHBG-ZHZULCJRSA-N 387.455 3.678 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)sc2n1 10644897 KDVKQCRAACCTRS-LEWSCRJBSA-N 389.521 3.593 10 40 GHCB CC[C@H](C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 32765338 QHZWPBHQFHPATF-QHCPKHFHSA-N 395.547 3.517 10 40 GHCB O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2F)SC1=S 5374132 SYUMGYJBXUIHIZ-DFSFMLJYSA-N 387.457 3.723 10 40 GHCB Cc1ccccc1C1=NN2C(=N)/C(=C/c3cccc([N+](=O)[O-])c3)C(=O)N=C2S1 41108085 XKVURWFUYGGKJT-YERBQUFUSA-N 391.412 3.571 10 40 GHCB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)Nc1cc([N+](=O)[O-])ccc1C 112123620 YHQGTNNNQDOYIL-PDGQHHTCSA-N 395.375 3.920 10 40 GHCB O=C(O)CCOc1ccc(/C=C2\SC(Nc3ccccc3F)=NC2=O)cc1 210418798 HVIGBFQRXQLPOM-WJDWOHSUSA-N 386.404 3.762 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(OC)cc1OC 408891879 DNNOPAHYUUJWJA-WQRHYEAKSA-N 397.402 3.720 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)cc1C 408967434 RIRHUFXSANZEFA-MDWZMJQESA-N 376.890 3.850 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=S)N(c3cccc(C)c3C)C2=O)cc1 409138275 ZJTYXIJCEYLBTN-FFEFAENFSA-N 392.480 3.700 10 40 GHCB Cc1ccc(N/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl 2084009 LDXQJMVOLDCGAV-ZROIWOOFSA-N 390.226 3.881 10 40 GHCB COc1ccc(N(C)Cc2cn3cc(Br)ccc3n2)cc1OC 58296547 WFRZRPXEUONAAW-UHFFFAOYSA-N 376.254 3.750 10 40 GHCB Cc1ccccc1N1C(=O)C(=CNC2CC2)C(=O)N(c2ccccc2C)C1=S 5447746 MMCFXJKWFHNKIR-UHFFFAOYSA-N 391.496 3.604 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(C)C)cc3)C2=O)cc1 408784876 URTPJMATQKVUDJ-XDHOZWIPSA-N 378.428 3.696 10 40 GHCB O=C1NC(=O)C(=Cc2c(Cc3ccccc3Cl)ccc3ccccc23)C(=O)N1 408885227 XZERPKRCPIGPNH-UHFFFAOYSA-N 390.826 3.833 10 40 GHCB COc1ccc(-c2coc3c(CN4CCCC4)c(O)ccc3c2=O)cc1OC 20411434 TZXDLAGDEKDERO-UHFFFAOYSA-N 381.428 3.779 10 40 GHCB biogenic COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 59435675 VUJBOEVQHODSSK-ZHZULCJRSA-N 376.456 3.625 10 40 GHCB COc1cc(OC)c(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)c(OC)c1 1192754 HZMLTXQOYUIQMT-LFIBNONCSA-N 396.399 3.528 10 40 GHCB COc1cccc(Nc2cc(N(C)C)c(N)c3c2C(=O)c2ccccc2C3=O)c1 5482819 VTWMCIPVUNXRCD-UHFFFAOYSA-N 387.439 3.862 10 40 GHCB Cc1ccc(Cn2cccc2/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)cc1 8767611 FXGKMRKANULZKV-XDHOZWIPSA-N 389.411 3.940 10 40 GHCB Cc1ccc(C(=O)O)cc1NC1=NC(=O)/C(=C\c2cccc([N+](=O)[O-])c2)S1 35043517 TWCMQDRVQNHNBI-OVCLIPMQSA-N 383.385 3.684 10 40 GHCB Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)c(I)c1 225034257 GKJVSEVXHDURCV-UHFFFAOYSA-N 394.256 3.596 10 40 GHCB COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1cc(OC)ccc1OC 408767273 FKAVWOUGACNJLY-AQTBWJFISA-N 385.460 3.709 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1cccc(OC)c1O 59959152 XUKQZOHESDFFKR-YBEGLDIGSA-N 399.830 3.931 10 40 GHCB CCCOc1c(Cl)cc(/C=C2\SC(NC(C)=O)=NC2=O)cc1OCC 409026352 MLRMEGMQJBJRAI-ZROIWOOFSA-N 382.869 3.634 10 40 GHCB O=C1S/C(=C\c2ccc(N3CCOCC3)c(F)c2)C(=O)N1Cc1ccccc1 409134323 OEWXNHQBRGMOQO-UYRXBGFRSA-N 398.459 3.899 10 40 GHCB Oc1cc2c(cc1[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)OCO2 19358635 AWQPMEGCCWPTRI-SFHVURJKSA-N 381.350 3.561 10 40 GHCB COC(=O)c1ccc(NC(=O)CSc2ncc(-c3ccc(F)cc3)n2C)cc1 924795 MMWVXYBTSWIPLP-UHFFFAOYSA-N 399.447 3.744 10 40 GHCB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1ccc(OCc2ccccc2)c(OC)c1 409024446 YLLAKSPWQMLLRD-PDGQHHTCSA-N 393.439 3.577 10 40 GHCB COc1ccc(C2=NN(C(C)=O)[C@H](c3cc(Br)ccc3O)C2)cc1 5044012 AFYOJVLGKVDXRY-KRWDZBQOSA-N 389.249 3.861 10 40 GHCB CCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCC)c(OC)c2)SC1=S 5373707 IARHMPSMLVQMIE-GQVHDAKQSA-N 395.502 3.548 10 40 GHCB Cc1ccc(NC(=O)CCCC[C@@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)cc1 1588624 JPIVNDIQZWPZMT-IIBYNOLFSA-N 386.492 3.617 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(N2CCCCC2)o1 4704532 GOIPAJDVCSPIHE-VBKFSLOCSA-N 399.834 3.590 10 40 GHCB CCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(OCC)c(OC)c2)SC1=S 33656243 IARHMPSMLVQMIE-XBUHWIKASA-N 395.502 3.548 10 40 GHCB CCOC(=O)c1sc2nc([C@H]3CCN(C(=O)OC(C)(C)C)C3)ccc2c1N 257209534 BQTYGHAFCKEDLZ-NSHDSACASA-N 391.493 3.780 10 40 GHCB COc1cc(/C=C2/SC(=S)N(c3cccc(C(=O)O)c3)C2=O)ccc1O 1235933 MZAQEGZNQJSDIL-OVCLIPMQSA-N 387.438 3.505 10 40 GHCB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 100044299 QZNVSTWGPWBZAO-ZDLGFXPLSA-N 395.375 3.838 10 40 GHCB O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(Br)cc1 694617 IJSNECNIBOMXHU-NTEUORMPSA-N 377.625 3.564 10 40 GHCB O=C1NN(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(Cl)cc1 59475180 RWXCOFRIOVUJLK-NTEUORMPSA-N 377.625 3.564 10 40 GHCB COC(=O)CCN1C(=O)/C(=C\c2c(OC)ccc3ccccc23)SC1=S 28048171 BRPIQZCIUADDEW-LFIBNONCSA-N 387.482 3.613 10 40 GHCB CC(C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 408801664 VDTHCOWOVRYQTA-LFIBNONCSA-N 384.819 3.794 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1ccc(OC)cc1 660139 QGSSEIONKQFUSL-UNOMPAQXSA-N 379.412 3.581 10 40 GHCB COc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(C)SC4=NC3=O)c2C)cc1 5487252 GYPUFIATGBWBLK-RPKGUNMRSA-N 393.472 3.742 10 40 GHCB O=C(NN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S)c1ccccc1O 1236352 VYYXMVUCNRDQPE-ZROIWOOFSA-N 390.873 3.592 10 40 GHCB COC(=O)c1ccc(CN2C(=O)S/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 4193882 AZPMIESRZCAZFG-PDGQHHTCSA-N 396.468 3.776 10 40 GHCB Cc1cccc(Cn2cccc(C(=O)N(C)[C@@H](C)c3ccccc3O)c2=O)c1 97019211 XEIYWAJOOFPLQA-KRWDZBQOSA-N 376.456 3.744 10 40 GHCB CCOc1ccc(-c2csc(NNS(=O)(=O)c3ccc(C)cc3)n2)cc1 1414975 DBLUAYFIJWZYEH-UHFFFAOYSA-N 389.502 3.823 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(CC(=O)Nc3cccc(C)c3)C2=O)cc1 4839233 HNRUSHRJUFPPBK-GZTJUZNOSA-N 398.509 3.844 10 40 GHCB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1ccc(O)cc1 5370770 QBLNVDKTVRICLO-GUSDSWBTSA-N 396.493 3.788 10 40 GHCB CN(C)c1ccc(CN2CCCC[C@H]2c2cc(=O)[nH]c(-c3cccnc3)n2)cc1 19584977 XDPVBOWTZLTYQH-NRFANRHFSA-N 389.503 3.625 10 40 GHCB O=C1S/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)N1Cc1ccccc1F 33645599 MIUHQMHQFPCGFF-UYRXBGFRSA-N 398.459 3.899 10 40 GHCB CCOc1cc(/C=C2\C(=O)N(c3cccc(Cl)c3)C(=O)N=C2O)ccc1O 38170208 YQCTXAYFNHEEQR-ZSOIEALJSA-N 386.791 3.951 10 40 GHCB CCCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc1OC 108047825 TYXGBDPOCBZSQP-LGMDPLHJSA-N 394.427 3.541 10 40 GHCB CCOC(=O)c1ccc(NC(=S)NCCN(C)c2ccccc2)cc1Cl 225571888 BZHDHMGEQUBZGS-UHFFFAOYSA-N 391.924 3.940 10 40 GHCB CN1CCCc2cc(/C=C/C(=O)NC(C)(C)c3noc(C(C)(C)C)n3)ccc21 61199246 GZUOVRAAFXCYNS-ZRDIBKRKSA-N 382.508 3.814 10 40 GHCB Cc1cc(N(Cc2ccccc2O)C[C@@H]2CCCO2)nc(-c2ccccn2)n1 95446144 IZRIGEKDPCQQOV-SFHVURJKSA-N 376.460 3.738 10 40 GHCB CCCC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1O 101549810 PGSOPJXUVOQBNW-RVDMUPIBSA-N 395.371 3.585 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccc(OC)cc1 100208214 NEWWCGFDSXSDLS-ZHZULCJRSA-N 393.439 3.971 10 40 GHCB O=C(O)COc1ccccc1/C=C1/SC(Nc2ccc(Cl)cc2)=NC1=O 20429138 CEKGKGGKKVFPLV-OQLLNIDSSA-N 388.832 3.886 10 40 GHCB CCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)O)C3=O)c2C)cc1 409129492 JZDKWTJCXCMXJG-LICLKQGHSA-N 384.457 3.777 10 40 GHCB O=C(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 38934374 WJGKGSMSRIJCAT-UHFFFAOYSA-N 382.397 3.627 10 40 GHCB O=C1CCCN1c1ccc(NC(=S)NCCCN2CCc3ccccc32)cc1 225560685 CVSHPJFGSSVTMK-UHFFFAOYSA-N 394.544 3.553 10 40 GHCB Cc1nonc1/N=N/N(Cc1cccc(Br)c1)c1nonc1C 4481887 UYFNYMDGVLLWPG-HMMYKYKNSA-N 378.190 3.537 10 40 GHCB COc1ccc(NC(=S)NCCCN2CCCc3ccccc32)c(OC)c1 225745213 ROTZUPXYSJUXJC-UHFFFAOYSA-N 385.533 3.833 10 40 GHCB Cc1cccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1 408966246 ODPIOHRXEIKAIM-CPNJWEJPSA-N 389.386 3.591 10 40 GHCB Cc1ccc(/C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)cc1 1786548 MGJOLBLDGBXFNU-WLSWZUKCSA-N 383.494 3.892 10 40 GHCB Cn1cc(/C=C2/C(=O)N(CCc3ccc(F)cc3)C(=O)N=C2O)c2ccccc21 2287478 LSOQJRLDRFPCRI-LDADJPATSA-N 391.402 3.862 10 40 GHCB COC(=O)CCCCCN1C(=O)/C(=C/c2ccc(OC)cc2)SC1=S 4714283 ASTOLJXBBHKEPZ-QINSGFPZSA-N 379.503 3.630 10 40 GHCB COc1ccc(N(Cc2ccccc2)Cc2cc(=O)n3ccsc3n2)cc1 10395177 RJPGYLCYQIWZAN-UHFFFAOYSA-N 377.469 3.971 10 40 GHCB Cc1ccccc1N1C(=O)/C(=C\c2c(C)n(C)c3ccccc23)C(=O)NC1=S 59302813 IZHQFCZOESDDER-ATVHPVEESA-N 389.480 3.626 10 40 GHCB Cc1cc(NC(=O)Cc2ccc(N)cc2)c(C)cc1I 226269179 QORURWBUBGDCBV-UHFFFAOYSA-N 380.229 3.671 10 40 GHCB Cc1ccc(C(=O)[C@H]2Sc3nnc(C)n3N[C@@H]2c2ccc(N(C)C)cc2)cc1 3258351 HUMULPMOVXZNNX-QUCCMNQESA-N 393.516 3.603 10 40 GHCB CCOC(=O)c1c(NC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)O)sc2c1CCC2 4662437 FELSALOMWGPMNN-UONOGXRCSA-N 391.489 3.799 10 40 GHCB CCCN1C(=O)/C(=C\c2cc(C)n(C)c2C)C(=O)N(c2ccccc2)C1=S 409024283 PKABOLDGVQTBOJ-QGOAFFKASA-N 381.501 3.596 10 40 GHCB COc1ccc(N(C)CCNC(=S)Nc2ccc(OC)c(Cl)c2)cc1 225798016 LDUAYQIGVJWXHV-UHFFFAOYSA-N 379.913 3.780 10 40 GHCB COc1ccccc1Nc1nnc(SCC(=O)c2ccc(O)c(O)c2)s1 6035785 GICKTBLSWSSKJR-UHFFFAOYSA-N 389.458 3.677 10 40 GHCB CC(=O)c1ccc(N2C(=O)/C(=C3/C(=O)N(C)c4ccccc43)SC2=S)cc1 4291577 SDZQFNZKWRPSAY-MSUUIHNZSA-N 394.477 3.642 10 40 GHCB Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)NC2=S)c1 408968453 YYESHVIZQQONEW-MDWZMJQESA-N 376.890 3.850 10 40 GHCB Cc1ccc(O)c(CN2CCC[C@@]3(CC2)CN(c2cccc(F)c2)C(=O)CO3)c1 2037977796 KBTYYVRDAMOJTM-HSZRJFAPSA-N 398.478 3.628 10 40 GHCB O=C(CSc1nnc(-c2ccco2)c(-c2ccco2)n1)Nc1nccs1 2483405 YUSALVLEEUNYJH-UHFFFAOYSA-N 385.430 3.579 10 40 GHCB O=C(O)c1ccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)cc1 2206981 XKZJZAKHPDMEBI-ZROIWOOFSA-N 381.438 3.667 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc4cc(OC)ccc4nc3C)CC2)cc1 54105222 RCXCBRAGXJZXKB-UHFFFAOYSA-N 391.471 3.523 10 40 GHCB CC1CCN(C(=O)/C(=C/c2ccc(N(C)C)cc2)NC(=O)c2ccccc2)CC1 6569655 GYSRIAXPRQOALW-XLNRJJMWSA-N 391.515 3.782 10 40 GHCB COc1cccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 7988927 GTEZTBPBGLHBCP-JOCHJYFZSA-N 382.504 3.512 10 40 GHCB CC1=CC(C)(C)N(C(C)C)c2cc(C)c(/C=C3\C(=O)NC(=S)N(C)C3=O)cc21 223500456 RIPAJDPAUMTLPM-LICLKQGHSA-N 397.544 3.662 10 40 GHCB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 6865667 SKOHJFOXMKQSKJ-UHFFFAOYSA-N 393.399 3.798 10 40 GHCB O=C(C1=CN(c2ccccc2)c2cc(Cl)ccc2S1(=O)=O)N1CCCC1 49003834 UZRINAGIQCHBLD-UHFFFAOYSA-N 388.876 3.729 10 40 GHCB CCOc1ccc(N/C(C)=C2\C(=O)N(c3ccccc3)N=C2CC(=O)OC)cc1 112123370 PUAGZKBNZWFEFN-QNGOZBTKSA-N 393.443 3.737 10 40 GHCB CC[C@H](Oc1ccc(C)c(C)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 217027349 SJGYMUCWPAZYNE-QHCPKHFHSA-N 395.547 3.529 10 40 GHCB CN(C)c1ccc(CNC(=O)Cn2c(-c3cscn3)nc3ccccc32)cc1 12551172 UWKYHGVEHDNQFB-UHFFFAOYSA-N 391.500 3.542 10 40 GHCB COc1ccc2oc(C)c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2c1 48265057 IKHZDMYIKPEPJD-UHFFFAOYSA-N 394.471 3.859 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)CCC(=O)c3ccccc3)cc2F)C[C@H](C)O1 48365412 SKLPOZAARUQOMB-IRXDYDNUSA-N 398.478 3.719 10 40 GHCB COCCN1C(=O)/C(=C/c2c[nH]c3ccc(Br)cc23)SC1=S 409130426 HTUYPJKUTUKGBY-MLPAPPSSSA-N 397.319 3.778 10 40 GHCB CCCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S 5372282 NMCSLMCZSUMVJB-ADVGAGMGSA-N 379.503 3.930 10 40 GHCB COc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)cc1OC 12371166 AUZDKRUYZBPJKH-PTNGSMBKSA-N 395.502 3.550 10 40 GHCB COC(=O)[C@H](C)N1C(=O)/C(=C/c2c(OC)ccc3ccccc23)SC1=S 1239091 KXUUDEFDQPUWLX-OKHBPPCESA-N 387.482 3.611 10 40 GHCB COc1cccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(C)SC4=NC3=O)c2C)c1 5487953 AJLATQCKIYRCIG-DVUFLMGDSA-N 393.472 3.742 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)N=C2O)cc1Cl 8914956 WLXPGQANMVLGGM-RIYZIHGNSA-N 395.802 3.701 10 40 GHCB CN1CCC2(CC1)N=C(c1ccccc1O)C[C@H](c1cc(Cl)ccc1O)N2 15830398 YVFYVFRJJYUSQQ-GOSISDBHSA-N 385.895 3.697 10 40 GHCB COc1ccc(N2CCN(C(=O)c3nc(Cl)sc3C(C)C)CC2)cc1 95473117 CKWPDTBKYDZVKA-UHFFFAOYSA-N 379.913 3.891 10 40 GHCB CCN(CCNC(=S)Nc1cc(C(=O)OC)ccc1C)c1ccc(C)cc1 225793300 VLVIUKCIMIWUDT-UHFFFAOYSA-N 385.533 3.903 10 40 GHCB COc1cc(Cl)c(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc1OC 409093241 ZLXCBQUSUVALHF-LYGDGENHSA-N 399.921 3.737 10 40 GHCB COc1ccc(CNC(=O)c2ccc3c4c(onc24)-c2ccccc2C3=O)cc1 2293646 FRAJUVGAWNQQSS-UHFFFAOYSA-N 384.391 3.978 10 40 GHCB O=C1N=C(Nc2ccccc2C(=O)O)S/C1=C/c1ccc(Br)o1 20226956 XAQULFCBWJGGIG-YRNVUSSQSA-N 393.218 3.823 10 40 GHCB CCc1cc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)ccc1OC 223710522 AKCGHPQCIPWRSG-UHFFFAOYSA-N 388.533 3.726 10 40 GHCB CCc1ccccc1N1C(=O)/C(=C\c2ccc(N(CC)CC)o2)C(=O)NC1=S 12363646 ZFNCLGWFRNJEBG-SSZFMOIBSA-N 397.500 3.520 10 40 GHCB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(c2ccc(Cl)cc2)CC1 10906432 ZDGJPNFGIBRWFI-UHFFFAOYSA-N 384.907 3.867 10 40 GHCB Cc1cccnc1-n1c(C)cc(CN(CCN(C)C)Cc2cccnc2)c1C 22931666 JXIHXIAFUXSKHC-UHFFFAOYSA-N 377.536 3.756 10 40 GHCB CCCCOc1ccc(/C=C2\SC(=S)N([C@H](C)C(=O)OC)C2=O)cc1 27563102 LXAZIVQNFBMEHX-QJMZJAKPSA-N 379.503 3.628 10 40 GHCB COC(=O)c1cccc(NC(=S)NCCCN2CCCc3ccccc32)c1 225746326 YXDUEDFZSLHEQR-UHFFFAOYSA-N 383.517 3.603 10 40 GHCB CCCN1C(=O)/C(=C\c2ccc(OC)cc2)C(=O)N(c2ccccc2)C1=S 409023467 NBIMHRLFZOTYJZ-NBVRZTHBSA-N 380.469 3.649 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(c2ccc(O)c(C(=O)O)c2)C1=O 4356815 SUCFMCRATTUKDS-NVNXTCNLSA-N 387.438 3.505 10 40 GHCB CCCCOc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 5097868 QSQORAKFPTUFHM-JOCHJYFZSA-N 383.536 3.964 10 40 GHCB Cc1cccc(/C=C2\SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 5373480 HTWWZDSNWWCQHG-WISAJEAXSA-N 383.494 3.892 10 40 GHCB CN(C)c1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2ccco2)C2CC2)cc1 15935721 ZMUMOALLTUIXDP-NRFANRHFSA-N 395.503 3.750 10 40 GHCB COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 408893379 MXPOAGABTXBWLD-ATVHPVEESA-N 385.460 3.709 10 40 GHCB CCCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OC)cc2)SC1=S 2240166 MGIXZFXLRYXHLK-QINSGFPZSA-N 379.503 3.630 10 40 GHCB O=C1NC(=S)N(c2cccc3ccccc23)C(=O)/C1=C\Nc1ccc(F)cc1 17249311 GEEXAFXUUCDJGO-ATVHPVEESA-N 391.427 3.723 10 40 GHCB Oc1cc2c(cc1[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1)OCO2 20745067 RSRXHKPLBDWUTH-GOSISDBHSA-N 382.243 3.849 10 40 GHCB COc1cc2ccccc2cc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 219397384 VRHVRBNMRDNFBS-UHFFFAOYSA-N 389.499 3.530 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1cc(OC)ccc1OC 408895652 VBSVXAKEYYDMCP-UYRXBGFRSA-N 393.439 3.889 10 40 GHCB COCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(N(C)C)cc3)c2C)C1=O 409132649 JRFIOZSGQPJXTQ-CPNJWEJPSA-N 399.516 3.843 10 40 GHCB CCOc1ccc2c(c1)SC1=NC(=O)/C(=C\c3ccc(O)c(OC)c3)C(=N)N12 16996076 KYMAQXFXYISFAV-PQJMHHKISA-N 395.440 3.669 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc4ccc(OC)cc4nc3C)CC2)cc1 58436423 VCYSROUHNRGBHU-UHFFFAOYSA-N 391.471 3.523 10 40 GHCB CNC(=O)Cc1nc(CN(Cc2ccccc2O)[C@@H](C)c2ccccc2)cs1 95451558 PWKLVEPACOWFLY-INIZCTEOSA-N 395.528 3.901 10 40 GHCB CCOc1cc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc(Cl)c1O 409080746 MOFHPRAMSDRERU-KSSSLANASA-N 399.921 3.825 10 40 GHCB CN1C(=O)/C(=C/c2ccc(Oc3nc(Cl)ncc3F)cc2)SC1=S 6145127 QJQIFIJSCYWDDW-WDZFZDKYSA-N 381.841 3.892 10 40 GHCB CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(Cn2cncn2)cc1 10394327 BTWYJQVERUEYIE-UHFFFAOYSA-N 389.503 3.589 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc(OC)c(OC)c1 12413422 AYWWLBQSADLZIQ-AQTBWJFISA-N 393.439 3.971 10 40 GHCB O=C1/C(=C/c2cnc3ccccc3n2)SC(=S)N1c1ccc2c(c1)OCO2 54361195 ZPYCXNHGFKZRLA-IDUWFGFVSA-N 393.449 3.764 10 40 GHCB COc1cc(/C=C2\C(=O)NN(c3ccc(Cl)cc3)C2=O)ccc1OC(C)C 83314132 CISDISWKTQEFHP-MHWRWJLKSA-N 386.835 3.597 10 40 GHCB Cc1ccnc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3C)c2C)c1 222747785 AXQREOQMRQABRU-WOJBJXKFSA-N 377.517 3.795 10 40 GHCB CC(C)N1CCc2cc(CN(C)Cc3ccccc3N3CCOCC3)ccc21 19715881 MBVIYFYVPZAWPK-UHFFFAOYSA-N 379.548 3.926 10 40 GHCB O=C(C1=CN(c2ccc(Cl)cc2)c2ccccc2S1(=O)=O)N1CCCC1 49003779 YGYQZKJWOVQOCC-UHFFFAOYSA-N 388.876 3.729 10 40 GHCB O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(CN2CCCC2=O)cc1 20488469 YWNZQBSHLBIALE-UHFFFAOYSA-N 391.515 3.729 10 40 GHCB CCN(CC)c1ccc(/C=c2\sc3nc4c(C)cc(C)cc4n3c2=O)c(O)c1 104369981 SUJKIWBKXPXAFM-ODLFYWEKSA-N 393.512 3.626 10 40 GHCB CCc1ccc(N2C=C(C(=O)N3CCCC3)S(=O)(=O)c3ccccc32)cc1 35527523 FOAFJDGQZCPOEZ-UHFFFAOYSA-N 382.485 3.638 10 40 GHCB Cc1cc(/C=C2/N=C(S)NC2=O)c(C)n1-c1ccc(Br)cc1 1170587 DDMJJZPGGRKWMD-RIYZIHGNSA-N 376.279 3.613 10 40 GHCB O=C(O)CN1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S 967110 DHUZZZSRYGMFNN-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB Cc1csc(NC(=O)CCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 1902658 AVLPTEYVEXKWCH-XFFZJAGNSA-N 395.556 3.743 10 40 GHCB aggregator CCc1ccc(/C=C2\SC(=S)N(CCC(=O)Nc3ccccn3)C2=O)cc1 8871659 VTJZPPYYGFPRCQ-SSZFMOIBSA-N 397.525 3.874 10 40 GHCB Cc1cc(/C=C2/C(=O)NC(=S)N(C)C2=O)c(C)n1-c1ccc2ccccc2c1 409146058 QLOIYKWTAMGNMG-UNOMPAQXSA-N 389.480 3.504 10 40 GHCB CCOc1ccc(/C=C2\C(=O)N(Cc3ccccc3)C(C)=C2C(=O)OC)cc1 408977577 IZWXCQDRCXMROT-ZHZULCJRSA-N 377.440 3.958 10 40 GHCB CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2COc3ccccc3O2)cc1 28580647 VWZHQWGVUWGYIW-QFIPXVFZSA-N 392.455 3.714 10 40 GHCB COc1ccc(N2CCCN(C(=O)c3ccc4nc(C)sc4c3)CC2)cc1 19286573 MONFSTLZWBGURY-UHFFFAOYSA-N 381.501 3.966 10 40 GHCB CCOc1ccc(N2C[C@@](O)(c3ccc(Cl)cc3)[N+]3=C2SCCC3)cc1 2965979 RUMUBFWTEUGKIO-HXUWFJFHSA-N 389.928 3.909 10 40 GHCB O=C1/C(=C\Nc2cccc(F)c2)C(C(F)(F)F)=NN1c1ccc([N+](=O)[O-])cc1 100057188 GNKGXLMEMWQTLO-ZROIWOOFSA-N 394.284 3.995 10 40 GHCB CCOc1ccc(/C=C2\SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)c(OCC)c1 4836790 TYDMPYGBOAZXTF-BHFHNPPDSA-N 390.505 3.564 10 40 GHCB O=C(O)COc1ccccc1/C=C1\SC(=S)N(Cc2ccccc2)C1=O 34112361 FITRSAHBWUEVJS-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB CC(C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 13546734 CYZMJEXONZUVTE-BOPFTXTBSA-N 384.819 3.794 10 40 GHCB O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)Sc2scc(-c3ccc(O)c(O)c3)[n+]21 1636440 LYYRIQMBKOTXAS-FRKPEAEDSA-O 399.429 3.809 10 40 GHCB CC(C)c1ccc(/C=C2\C(=N)N3N=C(c4cccnc4)SC3=NC2=O)cc1 4657060 QFLTUOCBZYJDFY-YGHDLIBZSA-N 375.457 3.872 10 40 GHCB COC(=O)COc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1 409345341 LFVMHRKCROJJHO-LFIBNONCSA-N 391.514 3.772 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=S)N(c2ccccc2Cl)C1=O 409233705 HLNXKEVNYDKXEO-ACCUITESSA-N 386.860 3.570 10 40 GHCB CC(=O)N1CCN(c2ccc(OCCCOc3ccc(Cl)cc3)cc2)CC1 32741533 GHUHZHINNMLBRA-UHFFFAOYSA-N 388.895 3.856 10 40 GHCB CCCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1=S 5372163 CJUNOPFJYVQKME-XFNCEPBJSA-N 378.519 3.597 10 40 GHCB CCN(CC)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)O[C@@H]2CCC[C@@H]2C)cc1 1506296 LJSNHZXUZXRBAV-QMIHWGKISA-N 385.508 3.893 10 40 GHCB CC(/C=C1\SC(=S)N(NC(=O)c2ccncc2)C1=O)=C\c1ccccc1 5296920 QLZMBBWAMXJYKC-DXHZZVMKSA-N 381.482 3.574 10 40 GHCB O=C1N=C(O)N(Cc2ccco2)C(=O)/C1=C\c1ccc(Sc2ccccc2)o1 8914107 XZWGZXRTYIBFOH-WJDWOHSUSA-N 394.408 3.890 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccc(OC)cc2)C(=O)/C1=C\c1cccs1 4703006 PUURBTDLVXVWDZ-AQTBWJFISA-N 383.469 3.672 10 40 GHCB COc1ccccc1/C=C1\Sc2scc(-c3ccc(O)c(O)c3)[n+]2C1=O 16958355 FUMNPECDLWYZOH-MFOYZWKCSA-O 384.458 3.909 10 40 GHCB CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 22518474 APRKWYYKGDIQRF-QFIPXVFZSA-N 382.504 3.818 10 40 GHCB COc1ccc(N2C(=O)/C(=C/c3ccc(O)c([N+](=O)[O-])c3)SC2=S)cc1 33394489 JERUUTUBUATBSB-DHDCSXOGSA-N 388.426 3.715 10 40 GHCB COc1cc(/C=C2\SC(N3CCCC[C@H]3C)=NC2=O)cc(OC)c1OC 59484570 ZVWJLAPBFIATOJ-COOUDCDJSA-N 376.478 3.557 10 40 GHCB COc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 1192707 NDVDCAQGOMRTMP-CPNJWEJPSA-N 386.407 3.823 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C/c1ccccc1OCc1ccccc1 851134 CUAUJYOXSVQCDG-XMHGGMMESA-N 380.469 3.568 10 40 GHCB CC(=O)c1ccc(N2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)cc1 3069372 VVCYVPFFWHIZPV-NXVVXOECSA-N 380.450 3.617 10 40 GHCB COc1ccc(C2=NN(C(=O)c3ccco3)[C@H](c3ccccc3O)C2)cc1OC 4511408 BNUGKBGGRRLPNI-KRWDZBQOSA-N 392.411 3.994 10 40 GHCB COc1cc(OC)c(OC)cc1/C=C1\SC(N2CCCCCC2)=NC1=O 4576150 AWAXKEUMCIXDRJ-BOPFTXTBSA-N 376.478 3.559 10 40 GHCB COc1ccc(C(=O)NN2C(=O)/C(=C\c3ccc(C)s3)SC2=S)cc1 6301914 MZCIOGPAUKZALS-NTEUORMPSA-N 390.511 3.611 10 40 GHCB O=C(/C=C/c1cn(Cc2ccccc2)nn1)N(Cc1ccccc1)c1ccccn1 10814338 QGGUVURFVYRRFS-CCEZHUSRSA-N 395.466 3.968 10 40 GHCB CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C\c1ccc2c(c1)OCO2 13372260 QWYFDQIZFTZJLM-MLPAPPSSSA-N 384.775 3.573 10 40 GHCB COc1ccc2ccc(O)c(CN3Cc4c(OC)ccc(OC)c4[C@@H](O)C3)c2c1 29543446 QMLZSWNIQROQSL-FQEVSTJZSA-N 395.455 3.620 10 40 GHCB COc1ccc(N/C(C)=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c(OC)c1 112124247 VZKVGWILDBNGTL-UNOMPAQXSA-N 396.403 3.721 10 40 GHCB O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1 408961699 URTVOGZQGZPSPK-LDADJPATSA-N 395.846 3.607 10 40 GHCB COc1ccc(N(CCC(N)=O)Cc2csc(-c3ccccc3OC)n2)cc1 12594418 AAFJKGVERZZAFM-UHFFFAOYSA-N 397.500 3.709 10 40 GHCB CCN(CC)c1ccc(/C=C2/C(=N)N3N=C(c4ccco4)SC3=NC2=O)cc1 41076772 LQKFHFAGKHNNPN-MXJHRONDSA-N 393.472 3.793 10 40 GHCB CCOC(=O)c1cccc(-c2ccc(C=C3C(=O)OC4(CCCC4)OC3=O)o2)c1 58865862 RZSMKEZMZNDAJS-UHFFFAOYSA-N 396.395 3.877 10 40 GHCB CC(=O)Nc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 113830647 FLIHNVKREJFEHW-MHWRWJLKSA-N 399.453 3.959 10 40 GHCB COc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1OC 4577894 AMLSQICTYRIRTK-UHFFFAOYSA-N 387.391 3.732 10 40 GHCB biogenic O=C1NN(c2ccc(Br)cc2)C(=O)/C1=C\c1ccc(Cl)cc1 5671868 RWXCOFRIOVUJLK-ZROIWOOFSA-N 377.625 3.564 10 40 GHCB Cc1cc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)c(C)n1-c1cccnc1 409093279 YNCXHQUWPXDLRZ-RMFUMNGISA-N 399.541 3.869 10 40 GHCB CCN(CCCNC(=S)Nc1ccc2c(c1)OCCO2)c1ccc(C)cc1 225733838 PJHFNZJCKYHINH-UHFFFAOYSA-N 385.533 3.969 10 40 GHCB COc1ccc(N2CCCN(C[C@H](O)c3cccc(C(F)(F)F)c3)CC2)cc1 51473626 NIHCTIPUXCVWPZ-FQEVSTJZSA-N 394.437 3.960 10 40 GHCB CCCC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1O 101550090 SDAVIJZRXYQRPQ-LFIBNONCSA-N 395.371 3.585 10 40 GHCB O=C1/C(=C/c2ccc([N+](=O)[O-])o2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 113830615 UKBFWTNOJBJKAI-XFFZJAGNSA-N 377.359 3.502 10 40 GHCB Cc1ccnc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)NC(=S)N3C)c2C)c1 222747910 AXQREOQMRQABRU-VQTJNVASSA-N 377.517 3.795 10 40 GHCB CC(/C=C1\SC(=S)N(CC(=O)Nc2cc(C)on2)C1=O)=C\c1ccccc1 4745633 QAMDDICDXNARPE-VQDQISGBSA-N 399.497 3.769 10 40 GHCB COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C\c1sccc1C 408768449 JGSNMEREEKYFQL-BOPFTXTBSA-N 383.469 3.938 10 40 GHCB Cn1ccc(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cc1=O 53709522 KDKZSWNKIRLLRW-GOSISDBHSA-N 381.501 3.720 10 40 GHCB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1ccccc1C(F)(F)F 6634342 FSJKQZVFMHXHOT-QTNMRXCUSA-N 395.377 3.557 10 40 GHCB Cc1csc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 10368659 NWNTVDMIAUUOPI-UHFFFAOYSA-N 394.477 3.958 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)COc1ccc(Oc2ccccn2)cc1 28495573 RVZGYYJKLXQEKY-UHFFFAOYSA-N 391.471 3.977 10 40 GHCB O=C1N=C(N2CCOCC2)S/C1=C/c1cccc(OCc2ccccc2)c1 2429583 VDNIQYNUEGYEET-XMHGGMMESA-N 380.469 3.568 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc2c(c1)OCO2 408894453 QNXMZGLHQLYJIU-YVLHZVERSA-N 377.396 3.601 10 40 GHCB CCN(CC)CCC[C@@H](C)NC(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O 5846931 QELLECZGFFHTFO-MRXNPFEDSA-N 392.499 3.702 10 40 GHCB COc1ccc(/C=C/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3C)C2=O)cc1 4682183 HLHBSADFOMYOKL-AHEGLGOKSA-N 392.480 3.700 10 40 GHCB COc1ccc(N2CCN([C@H](c3cccs3)[C@@H](C)NC(=O)C3CC3)CC2)cc1 23181575 UWNHEZYWERCZFZ-IERDGZPVSA-N 399.560 3.535 10 40 GHCB Cc1ccc(-n2c(C)cc(/C=C/C(=O)N3CCC4(CC3)OCCO4)c2C)cc1 24997017 GCCGOBBMCYMTGH-RMKNXTFCSA-N 380.488 3.781 10 40 GHCB Cc1cc(C(=O)COC(=O)c2ccccc2)c(C)n1-c1ccc2c(c1)OCO2 3398598 RENOFQFCXYWWLU-UHFFFAOYSA-N 377.396 3.863 10 40 GHCB CCN1CCN([C@H](c2ccccn2)c2cc(Cl)c3cccnc3c2O)CC1 22860765 VVUDRIJJENVYNV-FQEVSTJZSA-N 382.895 3.716 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCCC3)cc2F)C(=O)N1Cc1ccccc1 14010247 DTTNYNUVKJNEBV-DEDYPNTBSA-N 379.435 3.909 10 40 GHCB CCN(CC)c1ccc(CN(C)C(=O)c2nc(C)n(-c3ccc(F)cc3)n2)cc1 9932603 MFHSKEYZCIVREU-UHFFFAOYSA-N 395.482 3.833 10 40 GHCB Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)NC2=S)c1 409242175 NFYCDYOWOPJMAC-LDADJPATSA-N 394.496 3.922 10 40 GHCB COc1cccc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=S)N=C2O)c1OC 1197601 FJNUNQIPYBJWDD-RVDMUPIBSA-N 382.441 3.684 10 40 GHCB Cc1cccc(NC(=O)COc2ccccc2/C=C2\SC(=S)NC2=O)c1 15056147 MJJNDKNRZWHRIT-YBEGLDIGSA-N 384.482 3.501 10 40 GHCB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S 966989 JXPDZYUODGTZMZ-MFVBVHDHSA-N 399.493 3.940 10 40 GHCB Nc1nn2c(=O)c3c([nH]c2c1/N=N/c1cccc(C(F)(F)F)c1)CCCC3 4649604 NBKUKCKAJFELCL-WCWDXBQESA-N 376.342 3.918 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)NCCc3ccccc3)n2C)cc1 7423590 QSAWPYJZEDLXSM-UHFFFAOYSA-N 381.501 3.547 10 40 GHCB biogenic CCOc1ccccc1/C=C1\C(=O)N(Cc2ccccc2)C(C)=C1C(=O)OC 13371813 KXRZCIYKFQOIRY-RGEXLXHISA-N 377.440 3.958 10 40 GHCB O=C(CSCc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)cc1 13670928 FYVKDNWGUOJHHN-UHFFFAOYSA-N 385.489 3.745 10 40 GHCB CC(C)Oc1ccc(NC(=S)NCc2ccc(N3CCOCC3)cc2)cc1 225421596 MUIXHAXZTRPYDU-UHFFFAOYSA-N 385.533 3.797 10 40 GHCB O=C(O)COc1ccccc1/C=C1\SC(Nc2ccc(Cl)cc2)=NC1=O 108267648 CEKGKGGKKVFPLV-DHDCSXOGSA-N 388.832 3.886 10 40 GHCB COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Cl 409043912 ABCINPWMDPJPNQ-KPKJPENVSA-N 391.210 3.668 10 40 GHCB CN(C)c1ccc(/C=C2/NC(=S)N(c3ccc(OC(F)F)cc3)C2=O)cc1 100252855 GNUUTPCKXKIRIN-LFIBNONCSA-N 389.427 3.616 10 40 GHCB Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1-c1cccc(Cl)c1 7181275 KRLGYAWYPNYOFQ-UHFFFAOYSA-N 385.807 3.700 10 40 GHCB COc1cc(/C=C2/C(=O)N(c3ccc(C)c(C)c3)N=C2C)cc([N+](=O)[O-])c1O 36143498 SBFVPYOZTFJZNT-LZYBPNLTSA-N 381.388 3.732 10 40 GHCB CCCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n[nH]c1=O 6910376 LEHHKROZJJHYQP-UHFFFAOYSA-N 388.468 3.503 10 40 GHCB Cc1ccccc1NC1=NC(=O)/C(=C\c2ccc(N3CCOCC3)cc2)S1 16441039 CGKADHZHSDAYSO-XMHGGMMESA-N 379.485 3.914 10 40 GHCB Cc1cccc(N2C[C@](O)(c3ccc(OC(F)F)cc3)[N+]3=C2SCCC3)c1 2966117 BIGITDJCOHJDSV-FQEVSTJZSA-N 391.463 3.767 10 40 GHCB CC(C)(C)OC(=O)CN1C(=O)S/C(=C/c2ccc(N3CCCC3)cc2)C1=O 4933334 GOFBLLLFEAAVQH-FOWTUZBSSA-N 388.489 3.665 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C/c3ccc(C=O)cc3)SC2=S)cc1 5375052 HWYADJXZLVXHCB-PDGQHHTCSA-N 383.494 3.952 10 40 GHCB COc1ccc(N2C(=O)/C(=C\c3ccc(O)c(O)c3)SC2=S)c(OC)c1 35038866 OVTVRCQWCDBXPR-LZYBPNLTSA-N 389.454 3.521 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cccc(OC)c1OC 408893288 LVZUBJRGVWWKMB-LGMDPLHJSA-N 379.412 3.581 10 40 GHCB CC(=O)Oc1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 409332944 TUVKMZLBNMXFLC-CAOOACKPSA-N 399.449 3.746 10 40 GHCB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 4680109 XECZFUXVSQMNCW-COYFKBPASA-N 378.428 3.839 10 40 GHCB O=C(CN1CCCCC1)Nc1cc(Cl)cc2c1C(=O)c1ccccc1C2=O 4772716 ISOQNYQBHBLCTO-UHFFFAOYSA-N 382.847 3.540 10 40 GHCB COc1ccc(/C=C2\SC(=O)N([C@@H](C(=O)O)C(C)C)C2=S)cc1OC 5171678 IETKGPSICQYDQT-YLHGKKIISA-N 381.475 3.650 10 40 GHCB Cn1cc(/C=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)c2ccccc21 13496541 ZMPADSUMTCEDHR-BOPFTXTBSA-N 393.493 3.725 10 40 GHCB aggregator CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1 408914541 YJQGZSJTJVWHIR-FHXOWUIVSA-N 382.391 3.669 10 40 GHCB CCOc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Cl 409400082 OOQCHKNRLHSPQK-JYRVWZFOSA-N 377.227 3.854 10 40 GHCB CC(C)(C)OC(=O)N1[C@H](Cc2ccc(N)cc2)CC[C@H]1[C@@H](O)c1cccnc1 1547139875 QWSDDZWLEHRRIV-UFYCRDLUSA-N 383.492 3.708 10 40 GHCB O=C(CN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc(F)cc1 1266351 PIPCBZHWCYUHRE-JYRVWZFOSA-N 378.475 3.727 10 40 GHCB CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1csc(-c2ccccn2)n1 57997185 ZMMDEWZDUQBHTG-UHFFFAOYSA-N 380.517 3.862 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(N4CCCCC4)o3)C2=O)cc1C 4704542 LZQFSDUPASUUOZ-AQTBWJFISA-N 393.443 3.553 10 40 GHCB COc1ccc(/C=C2/SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1O 15008421 JOYZXYFCXUONDY-GZTJUZNOSA-N 386.498 3.873 10 40 GHCB COc1ccc(N2CCN(C[C@](C)(O)c3cccc(C(F)(F)F)c3)CC2)cc1 58322919 YTPMZQWPRQMQET-FQEVSTJZSA-N 394.437 3.744 10 40 GHCB COC(=O)C1=CN(c2ccc(C(C)C)cc2)c2cc(F)ccc2S1(=O)=O 64979184 VJSIVIIVHLWOSP-UHFFFAOYSA-N 375.421 3.889 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cc(OC)ccc1OC 408892623 IQYYBNCPGKRNAH-AQTBWJFISA-N 379.412 3.581 10 40 GHCB CC1=CC(C)(C)N(C(C)C)c2cc(C)c(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc21 223508176 MYAXSYMTLBOQKU-UHFFFAOYSA-N 395.503 3.839 10 40 GHCB CCOc1ccc2c(c1)SC1=NC(=O)/C(=C/c3ccc(O)c(OC)c3)C(=N)N12 3859316 KYMAQXFXYISFAV-IIQNZDCVSA-N 395.440 3.669 10 40 GHCB COc1ccc(Cl)cc1-n1c(C)cc(C(=O)O[C@H](C)C(=O)NC(C)C)c1C 16685458 HPPCTNUYZMKGLK-CQSZACIVSA-N 392.883 3.826 10 40 GHCB Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 408964871 SXMUKJFCCYBJNK-CPNJWEJPSA-N 389.386 3.591 10 40 GHCB CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3Br)C2=O)cc1 408984214 IGNBMVKWHADSLS-PTNGSMBKSA-N 399.244 3.678 10 40 GHCB Cc1cc(/C=C2\SC(=S)NC2=O)c(C)n1-c1ccc(Cl)c(C(=O)O)c1 408999017 RDMZVXWCBZFDAT-NSIKDUERSA-N 392.889 3.935 10 40 GHCB CCOc1cc(Br)c(/C=C2/SC(=S)N(C)C2=O)cc1OC 409331713 OPLAORWHCDWALR-WUXMJOGZSA-N 388.308 3.687 10 40 GHCB CCC[C@H](c1nnnn1C1CCCCC1)N1CCN(c2ccc(OC)cc2)CC1 57669499 GWUOZJLEFSACOU-OAQYLSRUSA-N 398.555 3.850 10 40 GHCB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)c(Cl)c3)C2=O)cc1 59426718 VZIFEUKBOLZSGK-MDWZMJQESA-N 375.211 3.968 10 40 GHCB O=c1c(-c2ccc3c(c2)OCCO3)coc2c(CN3CCCCC3)c(O)ccc12 19938611 FPOCOMFNUAHZAX-UHFFFAOYSA-N 393.439 3.923 10 40 GHCB biogenic CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)c1 408935102 GRVFTCZLMZXQFD-AQTBWJFISA-N 378.428 3.759 10 40 GHCB CC[C@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 22514214 SUFKYWUYHSLUHQ-FQEVSTJZSA-N 388.895 3.855 10 40 GHCB COc1cccc(-c2c[nH]c([C@@H]3COCCN3Cc3ccc(N(C)C)cc3)n2)c1 72322107 JFZSAUAPWJJNSW-QFIPXVFZSA-N 392.503 3.725 10 40 GHCB biogenic,in-vitro CC1(C)[C@@H]2CC[C@@H]1C[C@@H]2O[C@@H]1CC(=O)C[C@H]2C(=O)c3cccc(O)c3C(=O)[C@H]12 101168361 NLLZPZMJMSXUEY-UBTFOXBXSA-N 382.456 3.576 10 40 GHCB CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)C(=O)N=C1S 9361104 NSHOCVCLIRSZMM-YBEGLDIGSA-N 387.892 3.805 10 40 GHCB COCCN1C(=O)S/C(=C/c2ccc(-c3cccc(C(=O)O)c3C)o2)C1=O 409146426 UAXKZNSMNKZNNV-MHWRWJLKSA-N 387.413 3.636 10 40 GHCB Cc1cc(N2CCCC2)c(F)cc1/C=C1\NC(=O)N(Cc2ccccc2)C1=O 33670347 YRKBWMJXFGNZLW-UYRXBGFRSA-N 379.435 3.827 10 40 GHCB CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)cc1 2702114 NRXHDDJWEPNCLI-YBEGLDIGSA-N 398.465 3.749 10 40 GHCB COc1ccc(N2N=C(C)/C(=C(\C)Nc3cc(OC)ccc3OC)C2=O)cc1 112121154 YFTQSEDFPVAFFG-MOSHPQCFSA-N 381.432 3.821 10 40 GHCB CN1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)ccc2O)N3)C1 6732674 JROGYPQNSRRQEU-CQSZACIVSA-N 394.294 3.633 10 40 GHCB CCOC(=O)C1=CN(c2ccc(C)cc2)c2cc(F)c(F)cc2S1(=O)=O 67172820 USESMNJYIURDMZ-UHFFFAOYSA-N 379.384 3.603 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCC3)cc2F)C(=O)N1Cc1ccccc1F 409068714 BPQKOKVMOMGFSW-YBFXNURJSA-N 383.398 3.658 10 40 GHCB CCN1C(=O)/C(=C\c2ccc(OC(=O)c3ccco3)c(OC)c2)SC1=S 4471083 KIYHXSIFTBZZHU-XNTDXEJSSA-N 389.454 3.729 10 40 GHCB COc1ccc2cc(CNc3ccc(N4CCCCC4)cc3CO)c(=O)[nH]c2c1 13565086 HJNVNSOEVHVANI-UHFFFAOYSA-N 393.487 3.631 10 40 GHCB CCCOc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccccc2CC)C1=O 408877209 UHNXJEHZGXGRHA-VKAVYKQESA-N 378.428 3.704 10 40 GHCB CCn1c(C)cc(/C=C2\C(=O)NC(=S)N(c3ccc(C)c(C)c3)C2=O)c1C 409075069 SXDYGLZWSIYIAV-WOJGMQOQSA-N 381.501 3.573 10 40 GHCB Cc1ccccc1NC(=O)CN1C(=O)S/C(=C/c2ccc(N(C)C)cc2)C1=O 409162223 YQEXYSZXRIZNKN-LDADJPATSA-N 395.484 3.736 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=S)N(c3cccc(F)c3)C2=O)c(C)n1C(C)(C)C 409021689 TYNUMPRFXFLSTQ-LICLKQGHSA-N 399.491 3.830 10 40 GHCB N=C1/C(=C\c2ccc(O)cc2)C(=O)N=C2SC(c3ccccc3Cl)=NN12 26608362 HHCWEYBMOXKZCO-FZKGXIISSA-N 382.832 3.713 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O 408809874 SKTDVRVAECDEAV-SDNWHVSQSA-N 384.819 3.714 10 40 GHCB CCCOc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)c1 408933811 BMERRKNZMIJMMN-RGEXLXHISA-N 394.427 3.541 10 40 GHCB CCN(CC)c1ccc(CNC(=O)COc2ccc(Br)cc2)cc1 225695133 NAWKQZANBQEKNW-UHFFFAOYSA-N 391.309 3.991 10 40 GHCB CC(=O)Oc1cccc(N2C(=O)c3ccc(Oc4ccc(N)cc4)cc3C2=O)c1 850647 VNAFOKTYYLBURF-UHFFFAOYSA-N 388.379 3.787 10 40 GHCB CC1(c2ccc(Cl)cc2)OC(=O)C(=Cc2ccc([N+](=O)[O-])s2)C(=O)O1 1868636 SSBCGWAIELJLRY-UHFFFAOYSA-N 379.777 3.666 10 40 GHCB COc1ccc(N2CCN([C@@H](C)C(=O)c3c[nH]c4ccccc34)C[C@@H]2C)cc1 61947426 QBWWYEMWPYCDIA-IRXDYDNUSA-N 377.488 3.958 10 40 GHCB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2/C(=N)N3C=CSC3=NC2=O)o1 20238830 NRYYWYPWZORMHQ-RBCZPYDQSA-N 380.385 3.940 10 40 GHCB O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1cccc(O)c1 1267299 HUJJYUWTLOXNCP-PTNGSMBKSA-N 388.470 3.605 10 40 GHCB CN(C)c1ccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 14899414 SNWJVSNZYAWDME-UHFFFAOYSA-N 385.467 3.537 10 40 GHCB CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Nc2ccc3c(c2)OCO3)cc1 10262373 FUKCEFMTYOMDQZ-LJQANCHMSA-N 397.475 3.694 10 40 GHCB O=S(=O)(Nc1ccc2c(c1)OCO2)c1ccc(Br)cc1Cl 5121229 SVIVUWMNACYVKQ-UHFFFAOYSA-N 390.642 3.632 10 40 GHCB COC(=O)c1ccc(Cl)c(-n2c(C)cc(/C=C3\SC(=O)NC3=O)c2C)c1 408815773 SBIUXZQERNGWQE-NVNXTCNLSA-N 390.848 3.858 10 40 GHCB CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(C(=O)O)cc1 409041318 UXOCFYISUKSWAB-UXBLZVDNSA-N 396.271 3.886 10 40 GHCB CCC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(OCC)c(OC)c2)SC1=S 33656244 IARHMPSMLVQMIE-JXCQQFQQSA-N 395.502 3.548 10 40 GHCB COc1ccc(C2=NN(C(=O)c3ccco3)[C@@H](c3ccccc3O)C2)cc1OC 4511409 BNUGKBGGRRLPNI-QGZVFWFLSA-N 392.411 3.994 10 40 GHCB Cc1c(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c2ccccc2n1C 654844 QPMJXHFLSUQFFN-BOPFTXTBSA-N 393.830 3.807 10 40 GHCB Cc1ccc(N2NC(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1 4866355 YPMUKGGDCGLBHG-LDADJPATSA-N 389.367 3.625 10 40 GHCB COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(C)c(F)c4)on3)CC2)cc1 8587261 ZTIQZMGCAXHFQA-UHFFFAOYSA-N 395.434 3.760 10 40 GHCB aggregator COc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2cc(C)cc(C)c2)C1=O 14011121 SRQIODOTYGGWNA-YBEGLDIGSA-N 384.819 3.632 10 40 GHCB O=C(CCc1ccc(-c2ccccc2F)o1)NCc1cc([N+](=O)[O-])ccc1O 15763058 MHGHMDWZUSNVHJ-UHFFFAOYSA-N 384.363 3.949 10 40 GHCB O=C1/C(=C/c2c[nH]c3ccccc23)SC(=S)N1C1=C[C@H]2OCO[C@H]2C=C1 26771500 XCWKBNLMOGZJKV-VXXFBBPWSA-N 382.466 3.564 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)N3CCN(c4nccs4)CC3)c2C)c1 32612306 CPTXTNGSCDPJKS-UHFFFAOYSA-N 396.516 3.522 10 40 GHCB CN(C)c1ccc(CNC(=O)c2cn[nH]c2-c2cccc(Br)c2)cc1 72329086 BWRAMIJAVMRDJQ-UHFFFAOYSA-N 399.292 3.835 10 40 GHCB Cc1cc(N2CCCCC2)ccc1/C=c1\sc2nc3ccccc3n2c1=O 106997607 OIESCPLCYZDORH-ZHZULCJRSA-N 375.497 3.756 10 40 GHCB CCN1C(=O)C(=Cc2ccc3c(c2)[C@H](C)CC(C)(C)N3C)C(=O)N(CC)C1=S 113775757 FXKNDGDJWSDFJV-CQSZACIVSA-N 399.560 3.788 10 40 GHCB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)n1C(C)(C)C 408960529 GNOJQVKKIWGJEN-GZTJUZNOSA-N 383.423 3.665 10 40 GHCB COc1ccccc1NC(=O)COC(=O)c1cc(C)n(-c2ccccc2)c1C 3248201 FZHPUSSMWBABKA-UHFFFAOYSA-N 378.428 3.898 10 40 GHCB CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cc(OC)ccc1OC 12413417 QGUPEVVBZDUSRG-RGEXLXHISA-N 393.439 3.971 10 40 GHCB O=C1N=C(O)/C(=C/NN2CCCCCC2)C(=O)N1c1cccc2ccccc12 34236861 QNNLFQLGDDQWCN-VKAVYKQESA-N 378.432 3.527 10 40 GHCB Cc1cc2nc3s/c(=C/c4ccc(N5CCCC5)cc4)c(=O)n3c2cc1C 59105104 DVXJJAWKALGRPE-DEDYPNTBSA-N 375.497 3.674 10 40 GHCB O=C1N=C(O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)C(=O)N1c1ccc(F)cc1 59135083 RGFZYUOCBPMZHX-KPKJPENVSA-N 389.726 3.894 10 40 GHCB COc1ccc(/C=C2/SC(N3CCN(c4ccccc4C)CC3)=NC2=O)cc1 12378264 FYSDEEINTYRUTB-HMMYKYKNSA-N 393.512 3.796 10 40 GHCB COc1cc(/C=C2\C(=O)N(c3cccc(C(=O)O)c3)N=C2C)ccc1OC(C)C 5719304 STWZZCLUGZDJLV-ZDLGFXPLSA-N 394.427 3.987 10 40 GHCB CC1=NN(c2ccccc2)C(=O)/C1=C/c1c(C)nn2c1nc(O)c1ccccc12 32690973 YMPDUTCACYZXPF-LDADJPATSA-N 383.411 3.703 10 40 GHCB CCOC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)cc1 13799378 NGEXFGDNIDSZHU-BOPFTXTBSA-N 384.457 3.937 10 40 GHCB COc1cc(/C=C2/C(=O)NN(c3ccc(Cl)cc3)C2=O)ccc1OC(C)C 5384526 CISDISWKTQEFHP-YBEGLDIGSA-N 386.835 3.597 10 40 GHCB COC(=O)c1ccc(COc2ccccc2/C=C2\SC(=S)NC2=O)cc1 15978385 WQGWKTPUXTYOLE-YBEGLDIGSA-N 385.466 3.541 10 40 GHCB COC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)[C@@H](C)CC(C)(C)N3C)C1=O 208199022 WXCNUWMFERZOAQ-RGZVIEDOSA-N 388.489 3.618 10 40 GHCB COC(=O)[C@@H](C)N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S 1276931 HBUDRVUVXYXJTQ-VWJVTLSUSA-N 376.286 3.756 10 40 GHCB CCOc1ccc([C@@]2(O)CN(c3ccc(CC)cc3)C3=[N+]2CCCS3)cc1 2684576 ODWLICCSAWDURZ-QFIPXVFZSA-N 383.537 3.818 10 40 GHCB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1ccc(-n2c(C)ccc2C)cc1 7273880 AZPCIPKRTXNTTP-UHFFFAOYSA-N 388.475 3.720 10 40 GHCB COc1ccc(/C=C2\SC(NC3CCCCC3)=NC2=O)c(OC)c1OC 8322945 PBBXCHQVPJADRX-PTNGSMBKSA-N 376.478 3.605 10 40 GHCB CCCCOc1cccc(C(=O)Nc2cc(OC)ccc2N2CCOCC2)c1 20528530 IERGCZHBJCAZDE-UHFFFAOYSA-N 384.476 3.963 10 40 GHCB CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)N(C)C(=S)N=C3O)c2c1 33311666 DRHNGXDZWNGQKI-WJDWOHSUSA-N 384.457 3.734 10 40 GHCB Cc1ccc(C)n1-c1nc(CC(=O)NCc2ccc3c(c2)CCCN3C)cs1 58770063 JDKJJFFNYXNFFJ-UHFFFAOYSA-N 394.544 3.792 10 40 GHCB O=S(=O)(c1ccc(/N=N/c2cc(O)cc3ccccc23)cc1)N1CCOCC1 110306369 MMCDDKQEIHSRRJ-QURGRASLSA-N 397.456 3.982 10 40 GHCB COc1ccc(Cl)cc1-n1c(C)cc(C(=O)OCC(=O)N2CCCC2)c1C 2655757 YNAVSVXQLBJQGY-UHFFFAOYSA-N 390.867 3.535 10 40 GHCB COCCn1c(C)cc(/C=C2/C(=N)N3C(=NC2=O)Sc2ccccc23)c1C 13813837 KUFQMKUQNMWVAC-HXBSJJRASA-N 380.473 3.621 10 40 GHCB O=S(=O)(Nc1c(F)c(F)c(O)c(F)c1F)c1ccc2c(c1)CCCC2 95426628 XMMIZMAIGVQFBS-UHFFFAOYSA-N 375.343 3.628 10 40 GHCB COc1ccc(C2=NN(C(=O)c3ccco3)[C@H](c3ccccc3O)C2)c(OC)c1 95945220 UJAYTKGJFMJTJY-SFHVURJKSA-N 392.411 3.994 10 40 GHCB CC(C)Oc1ccc(NC(=S)NCc2ccc(N3CCN(C)CC3)cc2)cc1 225777073 RPQHTHHCAJXTEU-UHFFFAOYSA-N 398.576 3.712 10 40 GHCB CCN1CCC2(CC1)Oc1c(OC)cccc1[C@H]1CC(c3ccc(O)cc3)=NN12 10214585 AZTHIOAKVRRTLW-HXUWFJFHSA-N 393.487 3.756 10 40 GHCB CC(C)(C)c1ccc(SCC(=O)NC2=NN(c3ccccc3)C(=O)C2)cc1 4668887 YFUSBXWILYFJBM-UHFFFAOYSA-N 381.501 3.943 10 40 GHCB CC1CCN([C@@H](c2ccc(N(C)C)cc2)c2nnnn2Cc2ccccc2)CC1 4847687 RAOWSLXITKUKFR-QFIPXVFZSA-N 390.535 3.609 10 40 GHCB CC1=NN(c2cccc(Br)c2)C(=O)/C1=C\c1ccc([N+](=O)[O-])o1 13603110 WZYRBTSOXCVFRF-JYRVWZFOSA-N 376.166 3.756 10 40 GHCB O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(s1)CCCC2 84341318 PZEVFBPOTXAIGG-UHFFFAOYSA-N 388.508 3.657 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)NC2=S)cc1C 408818636 PWCBKQMHULLFDJ-WOJGMQOQSA-N 389.480 3.626 10 40 GHCB CC(C)OC(=O)c1cccc(-c2ccc(C=C3C(=O)OC(C)(C)OC3=O)o2)c1 6256415 FGKKYGGMJGAORQ-UHFFFAOYSA-N 384.384 3.731 10 40 GHCB COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 89904570 FNINFASGRZVDQQ-HOTGVXAUSA-N 397.475 3.522 10 40 GHCB CN(C)C(=O)c1ccc(NC(=S)NCCCN2CCCc3ccccc32)cc1 225747023 DOARCQUVDFZTKU-UHFFFAOYSA-N 396.560 3.518 10 40 GHCB Cc1csc(NC(=O)c2ccc(/C=C3/SC(=S)N(C)C3=O)cc2)n1 4942301 CATSFUMMLWGVDQ-KPKJPENVSA-N 375.500 3.535 10 40 GHCB CCCOC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)sc2c1CCCC2 2086586 DLCAKYXPUCYWGE-OLZOCXBDSA-N 391.489 3.799 10 40 GHCB CCN(CC)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)O[C@H]2CCC[C@@H]2C)cc1 4043616 LJSNHZXUZXRBAV-DCPHZVHLSA-N 385.508 3.893 10 40 GHCB O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/Nc1ccc2c3c(cccc13)CC2 6138861 ZHWDIQAPPJCQBP-CPNJWEJPSA-N 397.434 3.513 10 40 GHCB CCOc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccc(C)cc2)C1=O 9188748 KJCIJWISNCKCRN-ATVHPVEESA-N 398.509 3.940 10 40 GHCB CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)C(O)=NC1=S 59182289 HDGAFRGVCRAZNK-GZTJUZNOSA-N 383.473 3.590 10 40 GHCB O=C(O)c1cc(/N=N\c2ccc(S(=O)(=O)Nc3ccccn3)cc2)ccc1O 100031653 NCEXYHBECQHGNR-MRCUWXFGSA-N 398.400 3.702 10 40 GHCB O=C(O)CCN1C(=O)/C(=C/c2ccc(-c3ccc(F)cc3)o2)SC1=S 5032414 NYWSZAIKDAQTCQ-ZROIWOOFSA-N 377.418 3.762 10 40 GHCB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)N1CCCCCC1 5370756 RYTODGZBVCMODO-FYWRMAATSA-N 378.519 3.664 10 40 GHCB Cn1cc(/C=C2/SC(NC(=O)c3ccc(F)cc3)=NC2=O)c2ccccc21 5374385 CSYLHGYMASOKCC-LICLKQGHSA-N 379.416 3.718 10 40 GHCB CCCCN1C(=O)NC(=O)/C(=C\c2cc(C)n(-c3ccc(C)cc3)c2C)C1=O 5834515 ZEBMDYQCTHUPLB-CPNJWEJPSA-N 379.460 3.664 10 40 GHCB CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(OC)cc2)SC1=S 5892295 MGIXZFXLRYXHLK-NTCAYCPXSA-N 379.503 3.630 10 40 GHCB COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)Nc1ccc(C)cc1 112121190 PBNLUZYJZGRDJB-ZHZULCJRSA-N 381.407 3.786 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3cccn3-c3ccccc3)C(=O)NC2=S)cc1 408856475 KBHSAPFCLIFSMG-XMHGGMMESA-N 387.464 3.617 10 40 GHCB O=C(O)CCN1C(=O)/C(=C\c2ccccc2OCc2ccccc2)SC1=S 5070258 JEQNWFPZLMSWHW-SFQUDFHCSA-N 399.493 3.942 10 40 GHCB O=C(O)Cn1cc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)c2ccccc21 17081468 HRZKIESAPFZESH-PXNMLYILSA-N 398.465 3.720 10 40 GHCB O=C1/C(=C\c2ccco2)SC(=S)N1CCC(=O)N1CCCc2ccccc21 4745514 OJWRHZXYGADLCH-GHRIWEEISA-N 398.509 3.850 10 40 GHCB CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 1241481 SFCAAAFQLVNFSR-HXUWFJFHSA-N 378.476 3.636 10 40 GHCB CN(C)c1ccc(CNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)cc1 12564972 GQTZSMBOIYWPEH-UHFFFAOYSA-N 388.467 3.679 10 40 GHCB CCCCNC(=O)CCCN1C(=O)/C(=C/c2cccc(OC)c2)SC1=S 4745279 DLZCRSRUECNLQO-SSZFMOIBSA-N 392.546 3.593 10 40 GHCB Cc1ccc(C(C)C)c(OCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 12608319 MGKTWCZGWIDIPL-UHFFFAOYSA-N 396.531 3.992 10 40 GHCB COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C\c1ccco1 59959340 JTUHLRMRGCUVKI-GDNBJRDFSA-N 388.217 3.919 10 40 GHCB Cc1nnc(SCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)s1 3389245 MFXWVLYUMPVZJL-UHFFFAOYSA-N 387.486 3.958 10 40 GHCB COc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Br)c2)cc1 226863259 GAFVYGQQPHYGAX-UHFFFAOYSA-N 392.658 3.618 10 40 GHCB CC(=O)NCc1ccc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 27157279 HXFPCJFTXXBOCU-UHFFFAOYSA-N 379.504 3.585 10 40 GHCB O=C(NN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)c1ccccc1F 5552691 ZDBCJIXIPLTRGU-SXGWCWSVSA-N 397.456 3.853 10 40 GHCB CC(=O)c1cccc(N2C(=O)/C(=C3/C(=O)Nc4ccc(F)cc43)SC2=S)c1 4291587 MKUVJCBTFJCJKD-NXVVXOECSA-N 398.440 3.756 10 40 GHCB COc1ccc(N2CCN(C(=O)COc3cc(Cl)cc(Cl)c3)CC2)cc1 21278625 HICNNYSGWGJNOL-UHFFFAOYSA-N 395.286 3.730 10 40 GHCB CCc1ccccc1-n1cccc1/C=C1/C(=N)N2C(SC)=NSC2=NC1=O 4909284 ZHTTUBKAXPBHRF-PLGUFMGPSA-N 395.513 3.979 10 40 GHCB CC(=O)Nc1ccc(NC2=NC(=O)/C(=C/c3ccc(N(C)C)cc3)S2)cc1 5373099 DJPNVFKGUZJVQH-PDGQHHTCSA-N 380.473 3.793 10 40 GHCB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1-c1ccc2ccccc2c1 59109596 ICBYDBSIWXVIMQ-UHFFFAOYSA-N 387.439 3.681 10 40 GHCB C[C@H]1CN(c2ccc(CNC(=O)c3cn(C)c4ccccc34)cc2F)C[C@@H](C)O1 65475756 GTRURBXULHNHMT-IYBDPMFKSA-N 395.478 3.861 10 40 GHCB Cc1ccc(NCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1 1021728 DOPLGMMZCQSRDR-MFOYZWKCSA-N 384.482 3.995 10 40 GHCB O=C1N=C(S)N(c2ccccc2F)C(=O)/C1=C\c1ccc(N2CCCCC2)o1 9164994 VKXNJUNDMSBRMN-OWBHPGMISA-N 399.447 3.652 10 40 GHCB CC1=C(C(=O)O[C@@H]2CC[C@H](C)[C@H](C)C2)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1 102060662 PGIBQQKMAPFGKC-LOSGSANQSA-N 385.508 3.748 10 40 GHCB CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc3c(c2)CCC(C)(C)O3)cc1 223746845 CPCWDEQWKIVRCB-UHFFFAOYSA-N 388.533 3.677 10 40 GHCB S=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(N2CCCC2)nc1 223952033 QPLNEABLACRLSO-UHFFFAOYSA-N 381.549 3.769 10 40 GHCB COC(=O)c1ccc(-c2ccc(/C=C3\SC(=S)NC3=O)o2)cc1Cl 408813096 FBHFKGZEBYYTQZ-QPEQYQDCSA-N 379.846 3.875 10 40 GHCB COc1ccc(/C=C2\C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)cc1O 409041311 UVPIQDRDEXGSAF-UITAMQMPSA-N 398.287 3.902 10 40 GHCB Cc1cccc(NC(=O)COc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2)c1 409346106 NHVCSQODXFOVRQ-BOPFTXTBSA-N 398.509 3.844 10 40 GHCB CC1=C(C(=O)O[C@H]2CCC[C@@H](C)C2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 5002897 AMOMSDKTONIICD-XVGQJIODSA-N 387.549 3.667 10 40 GHCB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1c(Cl)cccc1Cl 6654839 FQQCKLRRVRDVAZ-OJLMPMFISA-N 396.270 3.845 10 40 GHCB COc1cc([N+](=O)[O-])ccc1N/C=C1\C(=O)N(c2cccc(Cl)c2)N=C1C 13575915 YIOJYQDWEVBMMC-GDNBJRDFSA-N 386.795 3.975 10 40 GHCB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 13646982 YYPVNGDHDQBTPZ-SFHVURJKSA-N 396.531 3.904 10 40 GHCB CC[C@@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(N2CCOCC2)cc1 20110444 LSTZKXDPEARXTM-OAQYLSRUSA-N 382.504 3.614 10 40 GHCB Cc1cccc(N/C=C2/C(=O)NC(=S)N(c3ccc(F)c(Cl)c3)C2=O)c1 408553399 YQCYCWFIFIKGMD-LCYFTJDESA-N 389.839 3.531 10 40 GHCB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1 408897442 JHEUIINQPJRVIH-SJPXOZHESA-N 378.428 3.839 10 40 GHCB Cc1ccccc1-n1cccc1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O 408967577 VWLLUVCXQVFEMK-QGOAFFKASA-N 389.386 3.591 10 40 GHCB CCCN1C(=O)/C(=C\c2ccc(OC)cc2C)C(=O)N(c2ccccc2)C1=S 409017590 FSZJLAARXFCJEC-XMHGGMMESA-N 394.496 3.957 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=S)N(c3cc(C)cc(C)c3)C2=O)cc1 408985837 BEKXORBVRZNLJP-CPNJWEJPSA-N 394.496 3.924 10 40 GHCB Cc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCC2)cccc1[N+](=O)[O-] 5097948 BZIXZIKFFVSNFY-OAQYLSRUSA-N 396.491 3.536 10 40 GHCB CC(C)(C)C(=O)CSCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 79001607 DECSBHUFKFMHQZ-UHFFFAOYSA-N 395.480 3.749 10 40 GHCB COc1ccc(C2=NN(C(=O)c3ccco3)[C@@H](c3ccccc3O)C2)c(OC)c1 95945221 UJAYTKGJFMJTJY-GOSISDBHSA-N 392.411 3.994 10 40 GHCB Cc1ccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)NC2=S)c(C)c1 409123948 JHSQCOVWGZEBMU-SFQUDFHCSA-N 394.496 3.922 10 40 GHCB O=C(NN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1Cl 1281109 QEXVKIONJYLVAK-WQLSENKSSA-N 380.903 3.948 10 40 GHCB COc1cc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)ccc1O 1416692 WZAYNTUUTRVDBT-BOPFTXTBSA-N 386.498 3.873 10 40 GHCB COc1cc(Cl)c(C[C@@H]2SC(=S)N(Cc3ccco3)C2=O)cc1OC 8106947 XZBQHWNWZZCVDP-HNNXBMFYSA-N 397.905 3.922 10 40 GHCB CCN1CCN(C2=NC(=O)/C(=C/c3ccc(-c4ccccc4)cc3)S2)CC1 19842453 WYWLLXJNPIMCKJ-SILNSSARSA-N 377.513 3.961 10 40 GHCB CCCC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NCCc1c[nH]cn1 101434637 CUVBLZQQQFFQDE-AQTBWJFISA-N 394.504 3.628 10 40 GHCB O=C(O)COc1ccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1 1157970 FIXLWAQZIGIRGY-YBEGLDIGSA-N 385.466 3.551 10 40 GHCB O=C(O)CCN1C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)SC1=S 5013968 XKYOTPNVJLREHV-ZROIWOOFSA-N 377.418 3.762 10 40 GHCB CCOc1ccc(/C=C2\SC(=S)N([C@H](CC)C(=O)O)C2=O)cc1OCC 2700863 FBRFPKJWIBDEAF-DYTQJMLRSA-N 395.502 3.548 10 40 GHCB CCc1ccccc1NC1=NC(=O)/C(=C2/C(=O)N(C(C)=O)c3ccccc32)S1 5373327 VZFUGWUWSOUYFY-ZCXUNETKSA-N 391.452 3.595 10 40 GHCB O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C/c1ccc(F)cc1 35043299 IZXBZCHHLBCYMW-QGOAFFKASA-N 385.439 3.757 10 40 GHCB CCc1ccc(OCCn2cccc2/C=C2\C(=N)N3OC(C)=CC3=NC2=O)cc1 41078256 OGXLUPDTWGRNRE-QLDKJHNESA-N 390.443 3.580 10 40 GHCB O=C(NN1C(=O)/C(=C\c2ccc(O)c(Cl)c2)SC1=S)c1ccccc1 409171603 ASBDETIUXYTWMO-NTEUORMPSA-N 390.873 3.592 10 40 GHCB COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 842967 WYORYJDTAQGYMT-RGEXLXHISA-N 392.411 3.510 10 40 GHCB COc1cc(/C=C2\C(=N)N3C(=NC2=O)Sc2ccccc23)cc(OC)c1OC 5516663 FMBAVNBKGHMVPK-WNAOBFJWSA-N 395.440 3.582 10 40 GHCB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(N(CC)CC)cc2)C1=O 6325339 QXFLNYUEGZBGJI-MLDYKZIASA-N 376.478 3.521 10 40 GHCB C[C@H](N/C=C1\C(=O)N=C(S)N(CCC2=CCCCC2)C1=O)c1ccccc1 102552116 JCMLTNOVOJIXNP-JZBMNUFDSA-N 383.517 3.766 10 40 GHCB O=C1CCCN1c1ccc(NC(=S)NCc2ccc(N3CCCC3)cc2)cc1 225425015 GKHGEDMXDMHHKM-UHFFFAOYSA-N 394.544 3.900 10 40 GHCB CCOC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1 408831721 HFNQQRMQFFMIOU-AQTBWJFISA-N 384.432 3.990 10 40 GHCB Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccn2-c2ccccc2F)C1=O 9265422 PMUWPISDPFNBDI-SSZFMOIBSA-N 389.386 3.591 10 40 GHCB CCN1C(=O)NC(=O)/C(=C\c2ccc(-c3cc(Cl)ccc3Cl)o2)C1=O 59109622 WHEKMJGDNNEFHA-XYOKQWHBSA-N 379.199 3.735 10 40 GHCB O=C1/C(=C2/C(O)=Nc3ccc([N+](=O)[O-])cc32)SC(=S)N1c1ccccc1 4038868 LOHAFPWCUBRRCG-YPKPFQOOSA-N 383.410 3.972 10 40 GHCB O=C(O)COc1cccc(/C=C2/C(=O)N(c3ccccc3)N=C2c2ccccc2)c1 409081018 OYLXYVHRSLCQOO-RCCKNPSSSA-N 398.418 3.985 10 40 GHCB COc1ccc(/C=C2/SC(NC3CCCC3)=NC2=O)cc1Br 96121205 BENBCEGWFYJPGB-NTEUORMPSA-N 381.295 3.960 10 40 GHCB COc1ccc(N2CCN(C[C@H](O)COc3ccc(C(C)C)c(C)c3)CC2)cc1 20347298 AFKBSDYACHVHEH-NRFANRHFSA-N 398.547 3.689 10 40 GHCB Cc1ccc(S(=O)(=O)Nc2ccc(C)c3c2C(=O)c2ccccc2C3=O)cc1 3845297 HZNFZVLMRXZAME-UHFFFAOYSA-N 391.448 3.880 10 40 GHCB biogenic O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(C(F)(F)F)c1 5756902 KCYKPBLCCQAUDI-ZROIWOOFSA-N 378.281 3.511 10 40 GHCB O=C(O)CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 6210086 XIWBZYQQPVIQNF-SFQUDFHCSA-N 399.493 3.942 10 40 GHCB COc1ccc(-c2cnc(SCC(=O)NCc3ccccc3OC)n2C)cc1 7423690 ZGMYRPJDYILRRU-UHFFFAOYSA-N 397.500 3.513 10 40 GHCB COc1ccc(Oc2ccc(/C=C3\SC(=S)NC3=O)cc2[N+](=O)[O-])cc1 12540086 KMOBWPLIPKLYQX-DHDCSXOGSA-N 388.426 3.885 10 40 GHCB COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccc(N(C)C)cc1 409002620 VSYPITWHERYQEZ-LGMDPLHJSA-N 380.419 3.769 10 40 GHCB COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C\c1ccc(C)cc1 409059297 VZJMDIOMPCVIIA-PDGQHHTCSA-N 393.439 3.889 10 40 GHCB CCOc1cc(/C=C2/SC(Nc3ccc(NC(C)=O)cc3)=NC2=O)ccc1O 35043452 BNRBZKLYMOEYEK-WOJGMQOQSA-N 397.456 3.832 10 40 GHCB O=C1N/C(=C/c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccc(F)cc1 4688430 PYGINVLQWBIKOM-XSFVSMFZSA-N 379.435 3.909 10 40 GHCB Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2nnc3ccccn23)c1 10056592 MGFCTHDTDXHJGL-UHFFFAOYSA-N 379.851 3.720 10 40 GHCB CC(C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1 408804251 DUANNCXEAYQXBB-RVDMUPIBSA-N 384.819 3.794 10 40 GHCB CCOC(=O)/C=C\c1ccc(N(C)CCCN(C)C(=O)OC(C)(C)C)cc1 1772715298 RFSAVAVYWDFTFQ-KAMYIIQDSA-N 376.497 3.956 10 40 GHCB CCOC(=O)c1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C)cc1 924733 WIPOGSAAJXCKTO-UHFFFAOYSA-N 395.484 3.995 10 40 GHCB CCCCNC(=O)CCCN1C(=O)/C(=C\c2ccc(C)cc2)SC1=S 12032453 HZEBYJLEZYIIPL-DTQAZKPQSA-N 376.547 3.893 10 40 GHCB COc1cccc(-n2c(C)cc(C(=O)Nc3cnc4c(c3)c(C)nn4C)c2C)c1 24465125 KECGBKOQMJWPKJ-UHFFFAOYSA-N 389.459 3.945 10 40 GHCB COc1ccc(CCN2C(=O)/C(=C\c3cccnc3)SC2=S)cc1OC 35041492 SRSLMSGZYKPIDO-GZTJUZNOSA-N 386.498 3.543 10 40 GHCB Cc1cc(C(=O)Cn2nc(-c3ccc(F)cc3)oc2=O)c(C)n1-c1ccccc1 16277588 GSEKFADGMKRMRU-UHFFFAOYSA-N 391.402 3.933 10 40 GHCB CCn1nccc1/C=C1/C(=O)N(c2ccccc2)N=C1C(F)(F)C(F)(F)F 101609252 JZLYECXYZWOCMU-JLHYYAGUSA-N 384.308 3.887 10 40 GHCB O=C1CCCN1c1cccc(NC(=S)NCCCN2CCc3ccccc32)c1 225561229 MRRWMUBDUPGDAF-UHFFFAOYSA-N 394.544 3.553 10 40 GHCB COC(=O)c1ccc(Cl)c(NC(=S)NCCN(C)c2ccccc2)c1 225571427 VBWDJQFQWBCMBC-UHFFFAOYSA-N 377.897 3.549 10 40 GHCB CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 408811033 NGOFVQAZWVWETC-SFQUDFHCSA-N 384.819 3.795 10 40 GHCB O=C(COC(=O)c1cc[n+]([O-])cc1)Nc1ccc(/N=N/c2ccccc2)cc1 5788000 FDRFCAXKLPMBNW-GHVJWSGMSA-N 376.372 3.531 10 40 GHCB CN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 10432931 XPYYOIACSSTFDK-UHFFFAOYSA-N 392.478 3.838 10 40 GHCB Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C(=O)NC3CC3)c3ccccc3)sc2n1 10645212 LYPIWNKTUHQIGR-QGZVFWFLSA-N 395.484 3.672 10 40 GHCB COc1ccccc1/C=C1\SC(=S)N(Cc2ccc3c(c2)OCO3)C1=O 13713961 XMWXPXHWJBSORD-MFOYZWKCSA-N 385.466 3.825 10 40 GHCB CCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCN(c2ccccc2)CC1 22665091 BJJZYNWITXHWDN-HSZRJFAPSA-N 394.563 3.532 10 40 GHCB CCOc1ccccc1/C=C1\C(=O)N(c2ccc(OC)cc2)C(C)=C1C(=O)OC 408794941 KQINSZRTDHCRKR-RGEXLXHISA-N 393.439 3.971 10 40 GHCB O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1 409393652 RWBVAERJKAKZRT-LFIBNONCSA-N 393.786 3.661 10 40 GHCB