smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)C=[N+]=[N-])cc1 4869480 KHKSOXMNYWMGSY-UHFFFAOYSA-N 315.354 2.279 10 40 DECB CCN1C(=O)/C(=C\c2ccccc2[N+](=O)[O-])C(C(=O)OC)=C1C 32109272 GZGJLLWNFIBCAN-XFXZXTDPSA-N 316.313 2.287 10 40 DECB CN(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 4573364 UVKFZPJATGQLHN-UHFFFAOYSA-N 324.292 2.072 10 40 DECB CC(=O)Oc1cc(OC(C)=O)c2c(c1)C(=O)c1ccccc1C2=O 4016081 PAZMTMHZLAZJRP-UHFFFAOYSA-N 324.288 2.313 10 40 DECB COc1ccc([C@H]2CNCc3c2ccc(OC)c3O)cc1O 3847194 FNIFXZANNCKMSL-GFCCVEGCSA-N 301.342 2.350 10 40 DECB biogenic CC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373950 JPPQJXVBHSEXAJ-CMWXKVOJSA-N 310.400 2.090 10 40 DECB Cc1cc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)on1 60241296 RPUFZEFZPLLYSB-UHFFFAOYSA-N 302.378 2.391 10 40 DECB c1cnc(N2CCC[C@@H](NCc3ccc4c(c3)CCO4)C2)nc1 43288592 WOUVIWZGZLVEFQ-MRXNPFEDSA-N 310.401 2.170 10 40 DECB O=C1/C(=C/c2cccnc2)SC(=S)N1C[C@@H]1CCCO1 12625393 TUOBXANTKCVYMU-ZWIPKHHJSA-N 306.412 2.462 10 40 DECB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(O)cc1 13029776 FDGHQIADTKVPMY-UHFFFAOYSA-N 307.327 2.200 10 40 DECB COc1ccc(C[C@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)cc1 1673165 JORBZMDJMACPKC-KPZWWZAWSA-N 317.385 2.361 10 40 DECB CCN(CC)c1ccc(/C=C2/NC(=O)N(C)C2=O)c(OC)c1 409191658 ZVOQPYUBGSUGAR-UKTHLTGXSA-N 303.362 2.064 10 40 DECB O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(O)cc2O)N1 3019195 ARALPLKQENYHNR-GDBMZVCRSA-N 324.336 2.267 10 40 DECB CN(Cc1ccc(N2CCCCC2)cc1)c1ccc2nnnn2n1 9113972 QHEYXHKPYXWJDH-UHFFFAOYSA-N 323.404 2.146 10 40 DECB O=C(CC1CCCC1)N1CCN(C(=O)c2cc(O)cs2)CC1 101072632 CXPXHRFAJRICMZ-UHFFFAOYSA-N 322.430 2.318 10 40 DECB COc1ccc2c(c1)CCCN2CC(=O)Nc1cc(C)no1 40488802 RMIHYIIXCZLAIU-UHFFFAOYSA-N 301.346 2.383 10 40 DECB CC[C@H](C)N1C(=O)/C(=C\NN2CCCCCC2)C(O)=NC1=S 38179479 CYDOMTUFKOSRSB-NIANNCQZSA-N 324.450 2.133 10 40 DECB COc1cccc(/C=C2/SC(=S)N(CCC(=O)O)C2=O)c1 1216252 WCTOQHZQAPZILK-DHZHZOJOSA-N 323.395 2.371 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1cc([N+](=O)[O-])ccc1O 58865918 PENWZWWIFJTOOG-UHFFFAOYSA-N 319.269 2.054 10 40 DECB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc([N+](=O)[O-])o1 241969 VWSKKZWAOIGZLM-UHFFFAOYSA-N 307.258 2.332 10 40 DECB CC1(C)OC(=O)C(=Cc2ccc(Br)o2)C(=O)O1 173074 UYEGEDWFSICFJN-UHFFFAOYSA-N 301.092 2.262 10 40 DECB biogenic CN1C(=O)/C(=C/c2cc3ccccc3n(C)c2=O)SC1=S 36625740 VNDIZYAIAZVQER-WQLSENKSSA-N 316.407 2.370 10 40 DECB OC1CCN(c2ccc(CNc3ncccn3)cc2F)CC1 52457424 ZPLFQHZNXLTOJX-UHFFFAOYSA-N 302.353 2.189 10 40 DECB O=C1c2ccccc2C(=O)c2c1nc1ccc(Cl)cc1[n+]2[O-] 85409391 KSKDOPSZMREBRU-UHFFFAOYSA-N 310.696 2.297 10 40 DECB NS(=O)(=O)c1ccc(/N=N\c2ccc(O)c(C(=O)O)c2)cc1 100091689 NBSRUZQXRUNPNY-NXVVXOECSA-N 321.314 2.153 10 40 DECB in-vitro COC(=O)c1cc(NS(=O)(=O)c2ccc(C)cc2)ccc1O 365603 MJGASXSWYPYCFU-UHFFFAOYSA-N 321.354 2.288 10 40 DECB COc1cccc(CNC(=O)NCCc2ccccc2)c1O 58330534 IEXSYVPXDLJGOP-UHFFFAOYSA-N 300.358 2.443 10 40 DECB Cc1nn(C)c(C)c1CC(=O)N(C)Cc1ccc(N(C)C)cc1 22130913 FQYZEYQABVHMHD-UHFFFAOYSA-N 314.433 2.304 10 40 DECB Cc1cc(CNC(=O)c2c(C)nn3cccnc23)ccc1N(C)C 78912550 FEGZJBFNXXMISD-UHFFFAOYSA-N 323.400 2.342 10 40 DECB CCCCN1C(=O)/C(=C\NN2CCCCCC2)C(O)=NC1=S 38181909 IEHASQOGVMMVAV-QXMHVHEDSA-N 324.450 2.135 10 40 DECB COc1ccc(O)c([C@@H](C)NC(=O)Cc2c(C)n[nH]c2C)c1 188449747 BDZIFECQBDHYPS-SECBINFHSA-N 303.362 2.161 10 40 DECB CN(C)c1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 13550915 RZLJWBWOUSOSJL-VBKFSLOCSA-N 307.353 2.214 10 40 DECB CCOc1ccccc1/C=C1/SC(N2CCOCC2)=NC1=O 319974 BJMYCCFORNCNFZ-SDNWHVSQSA-N 318.398 2.388 10 40 DECB O=[N+]([O-])c1ccc(O)c(CNC[C@H](O)c2cccc(F)c2)c1 71792564 RMARTCCADCBSFN-HNNXBMFYSA-N 306.293 2.263 10 40 DECB [N-]=[N+]=CC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1 80881206 WLGLEWHRLFWXLX-MRXNPFEDSA-N 323.352 2.394 10 40 DECB COc1cc(/C=C2\SC(=S)NC2=O)cc(OC)c1OC 12339010 DIAAFVBEJDBJAC-POHAHGRESA-N 311.384 2.201 10 40 DECB COc1ccc([C@H]2NCCc3cc(O)c(O)cc32)cc1OC 3727930 JROWMMCJPNPOEB-QGZVFWFLSA-N 301.342 2.350 10 40 DECB biogenic CCn1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c2ccccc21 4123239 GSRMLMZCNOEXDW-UHFFFAOYSA-N 311.341 2.095 10 40 DECB CN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 5006739 YJXRDKFPNGFOFB-PTNGSMBKSA-N 323.308 2.398 10 40 DECB COc1cc(C(=O)C(=O)c2ccc(OC)c(OC)c2)ccc1O 1595860 UKAOQGQKJJRFOX-UHFFFAOYSA-N 316.309 2.484 10 40 DECB CN1CCCc2cc(/C=C/C(=O)NCCc3cnn(C)c3)ccc21 58282737 TWXKJYIISUWNLP-SOFGYWHQSA-N 324.428 2.175 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C/c3ccncc3)S2)C[C@H](C)O1 4808476 LBTGLQQURCGEBX-VVSJRVCUSA-N 303.387 2.161 10 40 DECB COC(CN/C(C)=C1\C(=O)N(c2ccc(F)cc2)N=C1C)OC 103916054 JWGYGMXBXMLXKA-GDNBJRDFSA-N 321.352 2.031 10 40 DECB CC1=Nc2ccccc2N2C(=O)C(C(=O)C(F)(F)F)=S=C12 409415770 JPYHATDCCHKOML-UHFFFAOYSA-N 312.272 2.306 10 40 DECB C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cl)cn1C 97377737 ANOJFXIZUHLTEU-SECBINFHSA-N 308.765 2.451 10 40 DECB CC1=NN(c2ccccc2)C(=O)/C1=C(/C)NCCc1c[nH]cn1 13519713 FOPTVWPUQDBLMV-VBKFSLOCSA-N 309.373 2.239 10 40 DECB CC[C@@]12OC(=N)[C@@](C#N)([C@H]1C)C(C#N)(C#N)[C@@H](c1ccccn1)O2 5794495 IPNKUMLEOVIXCR-MCPWVCTESA-N 321.340 2.446 10 40 DECB CCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(C)C1=O 15010455 ACMXPNRLFQDFCB-GXDHUFHOSA-N 324.336 2.330 10 40 DECB N#CCOc1cccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c1 33758516 RHYLPQJFTSGUIH-VBKFSLOCSA-N 319.320 2.050 10 40 DECB CN(C)c1ccc(CNS(=O)(=O)Cc2ccccc2)cc1 8746908 LHIUTVVSQWORGM-UHFFFAOYSA-N 304.415 2.372 10 40 DECB CC(=O)Oc1cccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c1 33856704 BFQIQYZSPSCYRV-WJDWOHSUSA-N 322.320 2.073 10 40 DECB C[C@H](N/C=C1\C(=O)N=C(S)N(C2CC2)C1=O)c1ccccc1 102551457 YREKWSCGOZYAQQ-YWEFTTLKSA-N 315.398 2.038 10 40 DECB CC(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 14256750 KTLFMXCOTLLGRO-UHFFFAOYSA-N 317.326 2.226 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CCNC(=O)[C@H]1C[C@@H]1C 69519549 CNXMJKGVFXTYAQ-ZFWWWQNUSA-N 318.417 2.293 10 40 DECB CC[C@@]12OC(=N)[C@@](C#N)([C@H]1C)C(C#N)(C#N)[C@@H](c1ccncc1)O2 5823262 UJWZFMUVSLNJLA-MCPWVCTESA-N 321.340 2.446 10 40 DECB CC[C@@H](C)Oc1ccccc1C=C1C(=O)N(C)C(=O)N(C)C1=O 408602957 PGYWUKPINWNUJN-LLVKDONJSA-N 316.357 2.298 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccnc3)C2=O)cc1C 59336684 QUEWWSLCZNMHRF-OQLLNIDSSA-N 321.336 2.365 10 40 DECB COc1cc(N[C@H](C)c2ccc(N3CCOCC3)cc2)ncn1 65393886 VOTHFZCTIFUXEY-CYBMUJFWSA-N 314.389 2.495 10 40 DECB Cc1c(C)n(C)c2ccc(OCc3nnc4n3CCOC4)cc12 572110660 LJUHRHLKBDTERG-UHFFFAOYSA-N 312.373 2.496 10 40 DECB COc1ccccc1/C=C1\C(=O)NN(c2ccc(F)cc2)C1=O 90183 YPZXIVBOAZUHKQ-GXDHUFHOSA-N 312.300 2.296 10 40 DECB CCCCc1cc(=O)oc2c(CN[C@H](C)C(=O)O)c(O)ccc12 2114958 YPVZAWAHOALPCU-SNVBAGLBSA-N 319.357 2.404 10 40 DECB biogenic O=C1/C(=C/N2CCOCC2)SC(=S)N1c1ccccc1 59397228 XHGBZCYJBRAMKA-BENRWUELSA-N 306.412 2.225 10 40 DECB O=C(O)CCCN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1304735 AYYVOLPEHTXSEV-DHZHZOJOSA-N 323.395 2.458 10 40 DECB CCN1C(=O)/C(=C/c2ccccc2OCC(=O)O)SC1=S 1581283 MLGZPMMALYWBRN-XFFZJAGNSA-N 323.395 2.371 10 40 DECB COc1ccc(N/C(C)=C2/C(=O)NN(c3ccccc3)C2=O)cc1 104230691 LSKTVVUHSWMSMK-VBKFSLOCSA-N 323.352 2.459 10 40 DECB COc1ccc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 25747585 IXSBQGSNUOOPPV-UHFFFAOYSA-N 314.345 2.325 10 40 DECB COc1cccc(CN(C)C(=O)Cc2ccc(O)c(O)c2)c1 1540434476 JXZNKGKIMPNYIA-UHFFFAOYSA-N 301.342 2.308 10 40 DECB Cc1c(CC(=O)NC2CCCC2)c(=O)oc2c(O)c(O)ccc12 5346016 JQKCTLJAGGADAH-UHFFFAOYSA-N 317.341 2.114 10 40 DECB COC(=O)[C@@H]1C[C@H](N=[N+]=[N-])CN1C(=O)OCc1ccccc1 34212661 KSOAQYHIARNCDQ-RYUDHWBXSA-N 304.306 2.249 10 40 DECB CCCN1C(=O)/C(=C\c2ccc(O)cc2)C(C(=O)OC)=C1C 409206508 KIMXWXYBLUCQLF-UVTDQMKNSA-N 301.342 2.475 10 40 DECB COc1ccc(C2=NN(CCO)C(=O)/C2=C\c2ccccc2)cc1 102411666 ORIWFHPQCBUICE-LGMDPLHJSA-N 322.364 2.317 10 40 DECB COc1ccc(N2CCn3c(nc4cc(C(N)=O)ccc43)C2)cc1 20724121 QWRAKPANWDVKQI-UHFFFAOYSA-N 322.368 2.164 10 40 DECB C[C@@H](N/C=C1\C(=O)N=C(S)N(C2CC2)C1=O)c1ccccc1 102551463 YREKWSCGOZYAQQ-QQMDNXKGSA-N 315.398 2.038 10 40 DECB O=C(O)CCCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S 1011301 YTEAQCYWZIQXRU-FLIBITNWSA-N 323.395 2.458 10 40 DECB COc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3)C2=O)cc1 296553 UYFWAYYORZHCSM-RVDMUPIBSA-N 322.320 2.362 10 40 DECB CCN(CC)c1ccc(CNC(=O)c2ccc(O)nn2)cc1F 71889204 RBFZTZLFPOVTQI-UHFFFAOYSA-N 318.352 2.098 10 40 DECB CN(C)c1ccc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)cc1 12550589 KNIJSHHJYLSBEI-INIZCTEOSA-N 323.396 2.495 10 40 DECB CN(C)c1ccc2c(c1)CN(C(=O)c1c[nH]cn1)[C@H]2c1cnco1 96086994 PYNDPSHPGVKAOG-MRXNPFEDSA-N 323.356 2.209 10 40 DECB Cc1cccc(N2C(=O)/C(=C\c3ccc[nH]3)C(=O)NC2=S)c1 20841895 BBWAMUBJFBUCLB-LCYFTJDESA-N 311.366 2.154 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C\c3ccncc3)S2)C[C@@H](C)O1 6625673 LBTGLQQURCGEBX-NWEHMNAPSA-N 303.387 2.161 10 40 DECB O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(F)cc1 409373783 VLTMDJQRGCLUND-MDWZMJQESA-N 314.272 2.081 10 40 DECB S=C(NCc1ccccn1)Nc1ccc2c(c1)OCCO2 17449850 VBAOQOHELXLKRL-UHFFFAOYSA-N 301.371 2.339 10 40 DECB CC(=O)N1c2ccccc2[C@@]2(O)[C@@H]1SC1=[N+]2CCCCC1 479934 INCGYHPVJAEXLI-JKSUJKDBSA-N 303.407 2.256 10 40 DECB COc1cccc([C@@H]2NC(=N)Nc3nc4ccccc4n32)c1O 1408257 RCEVEHXPTRNDTP-CQSZACIVSA-N 309.329 2.247 10 40 DECB C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)c1cccnc1 97098049 MUZSBNGQRFCNTP-NWDGAFQWSA-N 300.358 2.344 10 40 DECB COCC1=NNC(=O)/C1=C\Nc1ccc(OC(F)(F)F)cc1 100375006 DISUEQCPNSSBIA-POHAHGRESA-N 315.251 2.013 10 40 DECB CC(C)Oc1ccc(C=C2C(=O)NC(=S)NC2=O)cc1Cl 408875735 KJVPPZVMWPZQKC-UHFFFAOYSA-N 324.789 2.042 10 40 DECB CN1C(=O)c2ccccc2O[C@H]2CN(Cc3ccccc3O)C[C@H]21 514288942 DKYBICQLIUXAFP-QAPCUYQASA-N 324.380 2.110 10 40 DECB biogenic,in-vitro CCN1C(=O)N/C(=C/c2ccc(N3CCCC3)c(F)c2)C1=O 4702431 BMERJOREDLXWPA-JLHYYAGUSA-N 303.337 2.339 10 40 DECB O=C(Cc1ccc2c(c1)OCCO2)c1ccc(O)c(O)c1O 138873 KPXGYSOEVDIKOH-UHFFFAOYSA-N 302.282 2.000 10 40 DECB biogenic CN(C)CN1C(=O)S/C(=C\c2ccc(N(C)C)cc2)C1=O 33518456 NIGGITRMJFINFX-LCYFTJDESA-N 305.403 2.308 10 40 DECB O=C(Cc1ccon1)N(Cc1ccccc1O)C[C@H]1CCCO1 96483727 SRPOWRJPDLXFBY-OAHLLOKOSA-N 316.357 2.131 10 40 DECB CC(=O)Oc1ccccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 107853762 UVABTWJKRMPWSJ-PTNGSMBKSA-N 322.320 2.073 10 40 DECB CCNC(NCC)=C1C(=O)N(Cc2ccccc2Cl)N=C1C 97103269 QQIPVQSPGPYVRC-UHFFFAOYSA-N 320.824 2.489 10 40 DECB N[C@@H](C(=O)O)c1cc(Br)cc(Br)c1O 199809645 REEZKJGKRLPPPA-ZCFIWIBFSA-N 324.956 2.002 10 40 DECB CC1(C)[C@@H]2CC[C@@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 100261962 RCPAVDBASIFGAJ-PXAZEXFGSA-N 303.333 2.016 10 40 DECB CC1=CC2=NC(=O)/C(=C/c3coc4ccccc4c3=O)C(=N)N2O1 13638128 YSVKZGVYOAAPJA-KWCXCCSBSA-N 321.292 2.243 10 40 DECB COc1ccc(N2CCC(O)(Cn3ccnc3C)CC2)cc1 12221679 WIUNBYYYTMAZSR-UHFFFAOYSA-N 301.390 2.232 10 40 DECB Cc1cc(O)c(CN2CCC(NC(=O)C3CC3)CC2)cc1C 48260304 RGAQBVDELZXYGX-UHFFFAOYSA-N 302.418 2.500 10 40 DECB O=C(O)c1ccc(NCCc2ccc(O)c(O)c2)c([N+](=O)[O-])c1 39393053 MSGHIVSJJJIWLD-UHFFFAOYSA-N 318.285 2.359 10 40 DECB COc1ccc(N/C(C)=C2\C(=O)NN(c3ccccc3)C2=O)cc1 17139882 LSKTVVUHSWMSMK-FOWTUZBSSA-N 323.352 2.459 10 40 DECB CNC(=O)CCN1C(=O)/C(=C/c2ccccc2)SC1=S 54360724 GCEJBYODUDIHSX-LUAWRHEFSA-N 306.412 2.024 10 40 DECB CNc1cc([C@H]2CN(c3ccc(OC)cc3)CCO2)nc(C)n1 72387800 GSSOZNQUAKNCQM-MRXNPFEDSA-N 314.389 2.413 10 40 DECB O=C(NCc1ccc(N2CCSCC2)cc1)C1CCOCC1 58377044 IPRAWCZEJUVAPM-UHFFFAOYSA-N 320.458 2.283 10 40 DECB CCC(CC)NC(=O)CN1CCN(c2ccc(OC)cc2)CC1 57548020 NBPINVZFWXGERA-UHFFFAOYSA-N 319.449 2.122 10 40 DECB COc1cc(N2CCCCC2)ccc1/C=C1/NC(=O)N(C)C1=O 409190042 VDOLVCSJHDNACI-GXDHUFHOSA-N 315.373 2.208 10 40 DECB CCCCN1C(=O)NC(=O)/C(=C/C=C/Nc2ccccc2)C1=O 4834363 DPBIEKPFFACCOR-PVGDTAGZSA-N 313.357 2.417 10 40 DECB aggregator COc1ccc(N2CCN(c3nccnc3S)CC2)cc1 40478758 DIIKLKCBRSKIKD-UHFFFAOYSA-N 302.403 2.101 10 40 DECB O=C(NCC[S@@](=O)Cc1ccccc1)c1cc(O)cs1 101167251 WKTLXHVHSCPKPD-FQEVSTJZSA-N 309.412 2.132 10 40 DECB CCOC(=O)CN1C(=O)/C(=C/c2ccccc2)SC1=S 1799868 RWWQKWATJKMLLI-FLIBITNWSA-N 307.396 2.451 10 40 DECB c1cnc(-n2cccn2)c(CNCc2ccc3c(c2)CCO3)c1 44978971 PSACWZNQBKCOIP-UHFFFAOYSA-N 306.369 2.492 10 40 DECB CCN(CC)c1ccc(CNC(=O)C(C)(C)NC(C)=O)cc1F 66841346 DBVDNGMISKTRNO-UHFFFAOYSA-N 323.412 2.203 10 40 DECB Cc1cc(CN(C)Cc2cc(=O)oc3cc(O)c(O)cc23)no1 97049058 KEOAKGMRPFRIPP-UHFFFAOYSA-N 316.313 2.133 10 40 DECB O=C(NCC[S@](=O)Cc1ccccc1)c1cc(O)cs1 101167247 WKTLXHVHSCPKPD-HXUWFJFHSA-N 309.412 2.132 10 40 DECB CCN1C(=O)C(=Cc2sccc2C)C(=O)N(CC)C1=S 6438618 TURLRBKLRFQGTA-UHFFFAOYSA-N 308.428 2.435 10 40 DECB O=S(=O)(Nc1cccc(N2CCCC2)c1)c1cccnc1 95395400 OUXLWHACOYFADZ-UHFFFAOYSA-N 303.387 2.483 10 40 DECB CC(C)OC(=O)CN1C(=O)/C(=C/c2ccccn2)SC1=S 1276877 CTQWEYZDRYYXIZ-XFFZJAGNSA-N 322.411 2.234 10 40 DECB CCOC(=O)c1nnn(-c2ccc(C)cc2)c1-c1cc[n+](C)cc1 98211223 XBONDFWKVWEAEF-UHFFFAOYSA-N 323.376 2.244 10 40 DECB Cc1cc(C(=O)O[C@@H](C)C(=O)N(C)C)c(C)n1-c1ccccn1 95350333 BCDUMNBJBDQSJW-ZDUSSCGKSA-N 315.373 2.123 10 40 DECB CCOC(=O)c1sc2nc(N3CCOCC3)cc(C)c2c1N 71282655 JDHJHXVIHANPNZ-UHFFFAOYSA-N 321.402 2.200 10 40 DECB Cc1ccc(N2CCC[C@H](NCc3ccc4c(c3)CCO4)C2)nn1 69926764 LXOSBEYVNPICFA-KRWDZBQOSA-N 324.428 2.479 10 40 DECB Cc1nc2n(n1)[C@@H](c1c(O)ccc3ccccc13)C=C(C(=O)O)N2 102278434 VVZXQXCKAVYSQK-CYBMUJFWSA-N 322.324 2.429 10 40 DECB O=C(C[C@@H]1SC(=S)NC1=O)Nc1ccccc1Cl 34926773 WRGDYDXZXJONIS-QMMMGPOBSA-N 300.792 2.185 10 40 DECB Oc1ccc2ccncc2c1CN1CCN(c2cnccn2)CC1 12979411 RGPNFGSFFGLMRG-UHFFFAOYSA-N 321.384 2.053 10 40 DECB Cc1cc(CNC(=O)CNC(=O)OC(C)(C)C)ccc1N(C)C 71896276 SGGZPDQOUVMEER-UHFFFAOYSA-N 321.421 2.202 10 40 DECB COc1cc(/C=C2/SC(=S)N(C)C2=O)cc(OC)c1O 12416513 WPWMOCDYLDVBRD-UXBLZVDNSA-N 311.384 2.240 10 40 DECB C[C@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(O)c(O)c1 1768066 IBCZJCQDLOHBPI-PIGZYNQJSA-N 303.358 2.058 10 40 DECB CCOc1cccc(CNCCC(=O)NC2CCCC2)c1O 75126687 IZJANHIRMNVSBW-UHFFFAOYSA-N 306.406 2.329 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CCNC(=O)[C@@H]1C[C@@H]1C 69519546 CNXMJKGVFXTYAQ-DZGCQCFKSA-N 318.417 2.293 10 40 DECB CC(C)COc1ccccc1C=C1C(=O)N(C)C(=O)N(C)C1=O 408600714 FKJFXZXKPBWDJF-UHFFFAOYSA-N 316.357 2.155 10 40 DECB COc1cccc(CC(=O)NCc2cc([N+](=O)[O-])ccc2O)c1 32972129 ISDQOLFJWLQCRJ-UHFFFAOYSA-N 316.313 2.168 10 40 DECB CN1CCO[C@@H](CNCc2ccc(N3CCCCC3)cc2)C1 75584175 FWOUSJHFVVPUNY-SFHVURJKSA-N 303.450 2.097 10 40 DECB CC1=NN2C(=N)/C(=C/c3ccc4c(c3)OCO4)C(=O)N=C2S1 96191652 QRDRDLINHOCRSH-LARYDZINSA-N 314.326 2.054 10 40 DECB CN1C(=O)C(=Cc2ccc(Cl)s2)C(=O)N(C)C1=S 4723762 DGEKMHDXEDYRDN-UHFFFAOYSA-N 300.792 2.000 10 40 DECB COc1ccc(OC)c(S(=O)(=O)Nc2ccc(O)cc2)c1 35686145 ZERFREYAKVATLJ-UHFFFAOYSA-N 309.343 2.210 10 40 DECB Nc1c(C(=O)O)cc(Cl)c2c1C(=O)c1ccccc1C2=O 4091250 SKWHCRIVYBRIPB-UHFFFAOYSA-N 301.685 2.396 10 40 DECB [N-]=[N+]=CC(=O)C[C@H](c1ccccc1)N1C(=O)c2ccccc2C1=O 4837208 YBJMNLJKEMVPAC-MRXNPFEDSA-N 319.320 2.284 10 40 DECB COc1ccc(N2CCN[C@@H](C(=O)Nc3ccccc3)C2)cc1 257214728 CNFDZPLYGSKASJ-QGZVFWFLSA-N 311.385 2.112 10 40 DECB N=C1/C(=C/c2coc3ccccc3c2=O)C(=O)N=C2SC=NN12 5340517 FJAJNDQHDCPAKD-YRYWFDQNSA-N 324.321 2.042 10 40 DECB CC[C@@H](C)NC(=S)N1CCN(c2ccc(OC)cc2)CC1 414806 QUAYFZURLLXOQR-CYBMUJFWSA-N 307.463 2.490 10 40 DECB CC(C)Oc1ccc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1 59139318 OXMADWSNBBRKSO-UHFFFAOYSA-N 318.398 2.073 10 40 DECB CN1CCc2c(sc3c2C(=O)N[C@H](c2ccccc2O)N3)C1 4899104 GOKCPNMELZKZBV-AWEZNQCLSA-N 315.398 2.296 10 40 DECB O=C(O)c1ccc(O)c(CN2CCN(c3ccccc3)CC2)c1 96530267 SGDFRSJAZBYKEC-UHFFFAOYSA-N 312.369 2.413 10 40 DECB O=C(Cc1cccc2ccccc12)NN1C(=O)CSC1=S 1465426 RSIDOXUMBDWXAP-UHFFFAOYSA-N 316.407 2.274 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C/c3ccccc3O)S2)C[C@H](C)O1 4549320 WXAKZNMWICFPFG-ZCJISOJFSA-N 318.398 2.472 10 40 DECB C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)c1cccnc1 97098050 MUZSBNGQRFCNTP-VXGBXAGGSA-N 300.358 2.344 10 40 DECB Cc1nn(-c2ccc([N+](=O)[O-])cc2)c2c1C(=O)C(=O)C(C)(C)C2 3102244 RGYUKGVDXVOQDH-UHFFFAOYSA-N 313.313 2.423 10 40 DECB CNC(=O)C(=O)c1cc(C)n(-c2ccc3snnc3c2)c1C 4054626 VBHHWYJRCJBFHP-UHFFFAOYSA-N 314.370 2.028 10 40 DECB C[C@@H]1CN2CCC[C@H]2CN1Cc1ccc(N2CCOCC2)cc1 72324630 MQMBPUANXYJSSL-APWZRJJASA-N 315.461 2.192 10 40 DECB C[C@@H](NN)c1cc(Br)cc(Br)c1O 199536016 RBPKKZYEEJHBPV-SCSAIBSYSA-N 309.989 2.442 10 40 DECB O=C1NC(=S)N=C(O)/C1=C\c1cc([N+](=O)[O-])ccc1Cl 3208042 INYPCGOXDHHUPG-UHFFFAOYSA-N 311.706 2.003 10 40 DECB O=[N+]([O-])c1ccc(O)c(CNC[C@@H](O)c2cccc(F)c2)c1 71792563 RMARTCCADCBSFN-OAHLLOKOSA-N 306.293 2.263 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\NC(C)(C)C)C2=O)cc1C 19594161 WPOFIJBIJWPKPG-UKTHLTGXSA-N 315.373 2.158 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc([N+](=O)[O-])cc1 49817 VYUIEWYCPNCSNZ-GXDHUFHOSA-N 309.281 2.056 10 40 DECB CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCC2 3667959 YSOYOJOVFAWJCR-UHFFFAOYSA-N 311.359 2.217 10 40 DECB CC[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 5967700 XTGUPMZDWXYAEP-HZAKCSEPSA-N 310.400 2.090 10 40 DECB CN(C)c1ccc(C=C2C(=O)OC3(CCCCC3)OC2=O)o1 241964 MSZOEBPCPZYMOF-UHFFFAOYSA-N 305.330 2.489 10 40 DECB O=C1NN(c2ccccc2)C(=O)C1=Cc1ccc([N+](=O)[O-])cc1 2049269220 VYUIEWYCPNCSNZ-UHFFFAOYSA-N 309.281 2.056 10 40 DECB Cn1c(/C=C2\C(=O)Nc3ccccc32)nc2ccccc2c1=O 18037826 FZDINVRCALMKGU-RAXLEYEMSA-N 303.321 2.426 10 40 DECB Nc1ccc(CN(c2ccccc2)[C@@H]2CCS(=O)(=O)C2)cc1 575421264 NZKVOHBAHPACNC-QGZVFWFLSA-N 316.426 2.463 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CNC(=O)c1ccoc1 69537984 HNQHQNRPLIUMRV-UHFFFAOYSA-N 316.357 2.154 10 40 DECB [O]C1=C(O)[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21 1560407559 QVBGIXAYDAMHJX-OAHLLOKOSA-N 303.246 2.300 10 40 DECB Cc1ccc(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 3186075 USKTZIHIIFMPDY-UHFFFAOYSA-N 320.414 2.115 10 40 DECB COc1cc(N2CCCCC2)ccc1/C=C1/NC(=S)NC1=O 409241499 XXRCLQTUQBTKFJ-UKTHLTGXSA-N 317.414 2.031 10 40 DECB COc1ccc(N2CCCN(C(=O)c3cc(C)on3)CC2)cc1 55877261 RZIQCXBODXXKIG-UHFFFAOYSA-N 315.373 2.344 10 40 DECB CCOc1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)cc1 39147 SYKSUKDZLCWNCF-SDNWHVSQSA-N 318.398 2.388 10 40 DECB Cc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1 207285 AJXPXSKUYLKYSJ-UHFFFAOYSA-N 307.327 2.200 10 40 DECB O=C1CSC2=NCN(c3ccc(OC(F)(F)F)cc3)CN12 6671702 VPQSEDAGJWRMNW-UHFFFAOYSA-N 317.292 2.252 10 40 DECB COc1ccc(N2CCN(c3cc(Cl)ncn3)CC2)cc1 40422444 SAHUITUZGIBKDT-UHFFFAOYSA-N 304.781 2.465 10 40 DECB Nc1ccc(CC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 20185695 LOYKIUTXMRCWIL-UHFFFAOYSA-N 313.376 2.299 10 40 DECB CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2O)NC(=S)N1 123258 ZXOAPVMSDDLYKO-CYBMUJFWSA-N 306.387 2.137 10 40 DECB Cn1nc(C(F)(F)F)cc1CNCc1ccc(O)cc1O 256053602 SBPVYLBPDKIYFO-UHFFFAOYSA-N 301.268 2.140 10 40 DECB NS(=O)(=O)c1ccc(NCc2cc(Cl)ccc2O)cc1 20547388 VNQKYCSNBORKSG-UHFFFAOYSA-N 312.778 2.305 10 40 DECB CCN1C(=O)C(=C2C=C(C)N(CCO)C(C)=C2)SC1=S 584906216 CZZOJPYUYBGCCB-UHFFFAOYSA-N 310.444 2.236 10 40 DECB O=C1c2cc(S(=O)(=O)O)ccc2C(=O)c2c(Cl)cccc21 5002968 UCCPGHXEJGZBGD-UHFFFAOYSA-N 322.725 2.362 10 40 DECB COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c(O)c2)c1 1577492 MWQFECMIRHKTMK-XIKOKIGWSA-N 317.385 2.361 10 40 DECB Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](C(N)=O)C2)cc1 53893481 XAEOZOOMHFFGBA-HNNXBMFYSA-N 311.385 2.042 10 40 DECB O=C(Cc1cccs1)NCc1ccc(N2CCOCC2)cc1 49740530 YUMAGGCXKVFWCQ-UHFFFAOYSA-N 316.426 2.444 10 40 DECB O=[N+]([O-])c1ccc(O)c(CNC2CCN(CC(F)F)CC2)c1 71792577 UTKOQFJIEITQGS-UHFFFAOYSA-N 315.320 2.120 10 40 DECB COc1cccc(N(Cc2ccc(N)cc2)S(C)(=O)=O)c1 225403532 VOUMOHDDXHUFTL-UHFFFAOYSA-N 306.387 2.244 10 40 DECB O=C1N=C(N2CCCNCC2)S/C1=C\c1ccc(F)cc1 41206370 HZCMKIHSFKEZNE-RAXLEYEMSA-N 305.378 2.091 10 40 DECB O=C1N=C(NCCCO)S/C1=C\c1c[nH]c2ccccc12 256055292 AWZUDHDXSIOWLA-JYRVWZFOSA-N 301.371 2.110 10 40 DECB CC(C)(C)N1C(=O)N=C(O)/C(=C\c2ccc(C(=O)O)cc2)C1=O 9041896 GLDAPOWTYAVXFV-DHZHZOJOSA-N 316.313 2.485 10 40 DECB CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccn(C)c(=O)c1 40068147 AFPOOWKZVKBHHC-UHFFFAOYSA-N 313.401 2.114 10 40 DECB CC[C@H](C)N1C(=O)/C(=C\Nc2ccccc2N)C(=O)N=C1S 103116486 QSWWUPNIJUNXPC-CUQRQBARSA-N 318.402 2.018 10 40 DECB CC(=O)c1c(C)oc(C)c1C(=O)CC(C#N)(C#N)C(C#N)C#N 33536 TYJZXIVPJKTEHI-UHFFFAOYSA-N 308.297 2.369 10 40 DECB CCCCC(=O)NN1C(=O)/C(=C/c2cccn2C)SC1=S 5552645 CLBXAZWUZBIFGE-LUAWRHEFSA-N 323.443 2.448 10 40 DECB CCCCCN1C(=O)/C(=C\N2CCOCC2)SC1=S 9420478 XGGBEOQMGPYQFM-ZHACJKMWSA-N 300.449 2.211 10 40 DECB CCOc1ccc(/C=C2\SC(=S)NC2=O)cc1C(=O)O 108238604 WXJGEIJMSOKUGB-POHAHGRESA-N 309.368 2.272 10 40 DECB O=C(O)c1ccc2c(=O)n3c(nc2c1)/C(=C\c1cccnc1)CC3 96792790 QMVJAVHRGCJUBD-WQLSENKSSA-N 319.320 2.434 10 40 DECB CCOC(=O)N1CCN(Cc2c(O)ccc3ccncc23)CC1 14250354 KYWQVOZVDODJPD-UHFFFAOYSA-N 315.373 2.215 10 40 DECB CC(C)(C)n1cc(C(=O)NCc2cc([N+](=O)[O-])ccc2O)cn1 48165229 OZLZNTAQLIYWCE-UHFFFAOYSA-N 318.333 2.182 10 40 DECB COc1ccc(N2CCN(Cc3nnc(C4CC4)o3)CC2)cc1 58173034 NUEOFATXFIMQJC-UHFFFAOYSA-N 314.389 2.278 10 40 DECB COc1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)c(OC)c1 437268 PBMKCAWMIBFDTC-XNTDXEJSSA-N 324.336 2.165 10 40 DECB O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(O)cc2O)N1 3019198 ARALPLKQENYHNR-GOEBONIOSA-N 324.336 2.267 10 40 DECB O=C1C/C(=C\c2ccc(O)c(O)c2)C(=O)N1Cc1ccccc1 9049403 BQZADESGPXQNEQ-RIYZIHGNSA-N 309.321 2.440 10 40 DECB Cc1cc(C(=O)O[C@H](C)C(=O)N(C)C)c(C)n1-c1ccccn1 58680892 BCDUMNBJBDQSJW-CYBMUJFWSA-N 315.373 2.123 10 40 DECB COc1cc(C(=O)N[C@H](C)Cc2ccccc2)cc(OC)n1 145940572 GISTYMJZIXMMPZ-GFCCVEGCSA-N 300.358 2.460 10 40 DECB CCCC1=NN(c2ccccc2)C(=O)/C1=C(/C)NCCCO 103917698 PLEPOJJUKCBRHT-SSZFMOIBSA-N 301.390 2.435 10 40 DECB CN(C)c1ccc(/C=C/C(=O)O[C@H]2C(=O)OCC2(C)C)cc1 65491528 XAQDQRWXKWKKSY-VSGCLNPGSA-N 303.358 2.261 10 40 DECB [N-]=[N+]=CC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1 16034542 MNBHSGKOGWFIOP-HNNXBMFYSA-N 308.341 2.289 10 40 DECB CCN(CC)c1ccc(CNC(=O)NCCCC(=O)OC)cc1 58289728 LARAICNIQPHDQF-UHFFFAOYSA-N 321.421 2.285 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C/Nc2ccccc2F)C(=O)NC1=S 5817722 KRWACLATOVIIHW-NCXKZPMSSA-N 321.377 2.163 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1 83319147 QZAQNPUAIWDXIZ-NTEUORMPSA-N 310.309 2.250 10 40 DECB CCOc1cccc(/C=C2\C(=O)N(C)C(C)=C2C(=O)OC)c1O 14406531 YFMIJYMJXPYUMU-XFXZXTDPSA-N 317.341 2.093 10 40 DECB O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(O)cc2O)N1 3019200 ARALPLKQENYHNR-ZBFHGGJFSA-N 324.336 2.267 10 40 DECB COc1ccc(/C=C2/C(=O)NN(c3ccc(F)cc3)C2=O)cc1 32099681 LINXJZUGPQVKNT-GDNBJRDFSA-N 312.300 2.296 10 40 DECB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccco1 2282873 KZTVTIQKNYQIJZ-XYOKQWHBSA-N 300.245 2.085 10 40 DECB COc1ccc(NC(=O)CCN2C(=O)[C@@H](C)SC2=S)cc1 11635898 HRRRDXSVKZFCGP-SECBINFHSA-N 324.427 2.273 10 40 DECB COc1ccc(N2CCCN(C(=O)c3cc(C)no3)CC2)cc1 55877792 LVMXDPUQKZTQLJ-UHFFFAOYSA-N 315.373 2.344 10 40 DECB Oc1ccc(CNCc2ccnn2CC(F)(F)F)c(O)c1 256051977 LIZCBNFHNZEABN-UHFFFAOYSA-N 301.268 2.146 10 40 DECB COc1ccc(-n2c(C)cc(/C=C3/NC(=O)NC3=O)c2C)cc1 451098 YUHRKYBXPWGLKT-OQLLNIDSSA-N 311.341 2.283 10 40 DECB O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(O)c(O)c2)N1 95975 LNQLXMJBKUUMHY-XJKSGUPXSA-N 324.336 2.267 10 40 DECB biogenic CCOc1cc(/C=C2\SC(NC(C)=O)=NC2=O)ccc1OC 408761973 IVXSLAWFSJGNGN-JYRVWZFOSA-N 320.370 2.200 10 40 DECB O=C(O)C1=C[C@@H](c2c(O)ccc3ccccc23)n2ncnc2N1 102243689 ABBGUAHUKUQAFQ-LBPRGKRZSA-N 308.297 2.120 10 40 DECB CCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 55329183 URDKNYQDDOEVER-VXGBXAGGSA-N 309.385 2.258 10 40 DECB C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1ccc2c(c1)CCO2 78898024 XSMUKCWOTJELQR-DYVFJYSZSA-N 314.429 2.358 10 40 DECB CCN1CCN(c2c(N)cc(OC)cc2Br)CC1 45886064 BJCSRQVXCZTFRE-UHFFFAOYSA-N 314.227 2.182 10 40 DECB CC(=O)Nc1cccc2c1C(=O)c1cccc(NC(C)=O)c1C2=O 4714318 FKRYJILJIVPKTR-UHFFFAOYSA-N 322.320 2.379 10 40 DECB NC1=Nc2nc3ccccc3n2[C@@H](c2cc(Cl)ccc2O)N1 7126830 ZHMWPCZTUSWCMW-ZDUSSCGKSA-N 313.748 2.492 10 40 DECB CN(C)Cc1ccc(CNC(=O)c2ccc(O)c(O)c2)cc1F 97050730 OQDMCXDGWJNQIH-UHFFFAOYSA-N 318.348 2.229 10 40 DECB COc1cc(N2CCN[C@@H]3CCCC[C@H]32)cc(OC)c1OC 218836158 KBZCKJLNPPQHBR-ZIAGYGMSSA-N 306.406 2.433 10 40 DECB Cc1cc(CNC(=O)CN(C)[C@H]2CCSC2)ccc1N(C)C 97230259 KDHSCZJJWRQFAY-HNNXBMFYSA-N 321.490 2.115 10 40 DECB CCOC(=O)CN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 1277091 XNIVQTJSCIBRDC-XFFZJAGNSA-N 323.395 2.157 10 40 DECB O=C1/C(=C/Nc2nc[nH]n2)SC(=S)N1c1ccccc1 618255346 YOCFXYWZZGSXLZ-TWGQIWQCSA-N 303.372 2.123 10 40 DECB COc1cc(Br)c(N2CCOCC2)c([N+](=O)[O-])c1 45957701 NBNVFVKDFRXCJI-UHFFFAOYSA-N 317.139 2.203 10 40 DECB CC[C@H](N[C@@H](CC)c1ccccc1O)C(=O)N1CCOCC1 156281426 PAMWLEVGISPLRR-GJZGRUSLSA-N 306.406 2.070 10 40 DECB Cc1ccc(C)n1-c1ccc(N2CCNCC2)c([N+](=O)[O-])c1 3893953 NNIMUEKQBANQMW-UHFFFAOYSA-N 300.362 2.412 10 40 DECB Cn1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)c1 35648609 WRISBMJUDJLVLI-YFHOEESVSA-N 310.400 2.091 10 40 DECB CN(C)c1ccc2nc3c(C(=O)O)cc(O)c(O)c3[o+]c2c1 13099253 OWHXYAGCYVQADL-UHFFFAOYSA-O 301.278 2.438 10 40 DECB CC(=O)NCCCCCC(=O)N(C)Cc1ccc(N(C)C)cc1 61075262 VUEZCOXTOJAMRW-UHFFFAOYSA-N 319.449 2.408 10 40 DECB CCC[C@@H](C)NC(=O)CN1CCN(c2ccc(OC)cc2)CC1 39561418 CUQYCLJGOCDMKX-OAHLLOKOSA-N 319.449 2.122 10 40 DECB Cc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccccc2O)C1=O 408897083 VJDTZGKBZAIKIH-JLHYYAGUSA-N 322.320 2.367 10 40 DECB COc1ccc2nc(/N=N/c3c(N)nc(N)nc3N)sc2c1 17426709 RFBOHYDWXBWMSO-FMQUCBEESA-N 316.350 2.257 10 40 DECB CCCc1cc(=O)oc2c(CN3CCN(C)CC3)c(O)ccc12 19361344 NBARNRAPUINKJV-UHFFFAOYSA-N 316.401 2.199 10 40 DECB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C\c1ccccc1O 408883858 WZGYXDAPBIKKGH-RAXLEYEMSA-N 324.361 2.224 10 40 DECB CN(C)c1ccc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 7366237 STBKMTFMVAFMHJ-UHFFFAOYSA-N 314.345 2.372 10 40 DECB C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(C=O)cc2)SC1=S 5375005 YTTSECPNJVLURM-QKNMJKLUSA-N 321.379 2.173 10 40 DECB Cc1cc(C)c(O)c(CN2CCC[C@@H]2CN2CCOCC2)c1 95974171 MCJHFAFTCAKULH-QGZVFWFLSA-N 304.434 2.306 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccc(O)c3)C2=O)cc1 179625 OMNOSRRMISICIS-XNTDXEJSSA-N 322.320 2.367 10 40 DECB CC(C)(C)OC(=O)NC(C)(C)C(=O)NCc1ccccc1O 58218532 BRGBYWCOKLJUMS-UHFFFAOYSA-N 308.378 2.312 10 40 DECB Oc1ccc(C2=Nn3c(nnc3-c3ccco3)SC2)cc1O 13122547 DDUUUIHMOYDWLN-UHFFFAOYSA-N 314.326 2.307 10 40 DECB CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2O)NC(=S)N1 123261 ZXOAPVMSDDLYKO-ZDUSSCGKSA-N 306.387 2.137 10 40 DECB CCc1ccc(N2NC(=O)/C(=C/c3ccc(O)cc3)C2=O)cc1 32099536 JHODQYPEIJUZJH-WJDWOHSUSA-N 308.337 2.416 10 40 DECB CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCCC2)cc1 283314269 QFSGWVACXYDWKN-UHFFFAOYSA-N 317.433 2.208 10 40 DECB O=C(Cc1ccon1)N(Cc1ccccc1O)C[C@@H]1CCCO1 96483726 SRPOWRJPDLXFBY-HNNXBMFYSA-N 316.357 2.131 10 40 DECB CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccco1 7197361 YPPDWHMBQANPNL-UHFFFAOYSA-N 316.357 2.161 10 40 DECB CC(=O)Oc1ccccc1C=C1C(=O)OC2(CCCC2)OC1=O 58866190 XTABPCDWILCFMF-UHFFFAOYSA-N 316.309 2.366 10 40 DECB CC[C@@H](NC(=O)[C@@H](C)N1CCSCC1)c1ccccc1O 95976930 RAKOZVPKWARMHI-TZMCWYRMSA-N 308.447 2.397 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1ccc(-c2ccccc2)cc1 6575888 WCHLHTXYKWJEJW-UHFFFAOYSA-N 308.362 2.268 10 40 DECB Cn1c(=O)c(C(=O)Nc2ccc(N)cc2)c(O)c2ccccc21 100502035 HYCYCWMQUWRXRM-UHFFFAOYSA-N 309.325 2.079 10 40 DECB O=C1NC(=O)C(=Cc2ccc(Cc3ccccc3F)cc2)C(=O)N1 408869144 QYARQWFLIXBCHY-UHFFFAOYSA-N 324.311 2.166 10 40 DECB CC(=O)NN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S 5453606 FJQUAEKFHBBMCW-SDQBBNPISA-N 317.395 2.420 10 40 DECB CC(C)C12CN3CC(C)(CN(C1)C3c1ccccc1O)C2=O 32123817 YBKPGSQISZHPRL-UHFFFAOYSA-N 300.402 2.253 10 40 DECB biogenic NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccccn3)cc2)C1 54124338 PAZLPHUODMDJBC-OAHLLOKOSA-N 310.401 2.395 10 40 DECB CN1CCc2c(sc3c2C(=O)N[C@@H](c2ccccc2O)N3)C1 4899105 GOKCPNMELZKZBV-CQSZACIVSA-N 315.398 2.296 10 40 DECB CN(Cc1ccccc1O)C(=O)Cc1cn2ccsc2n1 58356423 DYPUMEVGSUZPAJ-UHFFFAOYSA-N 301.371 2.303 10 40 DECB CN1CCCc2cc(CNC[C@@H]3CNc4ccnn4C3)ccc21 58308830 UMPBXADGUNVZJN-OAHLLOKOSA-N 311.433 2.097 10 40 DECB CCN1C(=O)/C(=C/c2ccccc2OC(C)C)C(=O)NC1=S 409393692 ZAMKSIHQRWHLQT-FMIVXFBMSA-N 318.398 2.120 10 40 DECB COc1cccc(-n2c(C)cc(/C=C3\NC(=O)NC3=O)c2C)c1 409060420 ZUSYRTBJMARKAJ-NVNXTCNLSA-N 311.341 2.283 10 40 DECB Cc1ccc(N2NC(=O)/C(=C\c3ccc(O)c(O)c3)C2=O)cc1C 3114015 RMOCFAMMZUWGJO-RIYZIHGNSA-N 324.336 2.176 10 40 DECB CCOCCO[C@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 69368792 OEULBSRZXMZCJH-CQSZACIVSA-N 320.433 2.127 10 40 DECB O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCOc2ncccc21 96451744 GRONPMWOJJSEPO-BQYQJAHWSA-N 311.297 2.429 10 40 DECB CCc1nnsc1C(=O)NCc1ccc(N(C)C)c(F)c1 58731242 GPMUAJRASYQFDM-UHFFFAOYSA-N 308.382 2.236 10 40 DECB CCCCN(CC(N)=O)Cc1cc(Cl)cc(C(C)=O)c1O 50145706 OZEAFOCDQSQNIK-UHFFFAOYSA-N 312.797 2.336 10 40 DECB CCOc1cccc(/C=C2\SC(N3CCOCC3)=NC2=O)c1 44026111 IQBGXSNIXOQKMD-KAMYIIQDSA-N 318.398 2.388 10 40 DECB CC1=C2[C@H](CCS2(=O)=O)[C@@H]2C(=O)c3ccccc3C(=O)[C@@H]2C1 16028720 UVXXXOSBZCSZQB-MCIONIFRSA-N 316.378 2.410 10 40 DECB biogenic CCNC(=O)c1ccc(/C=C2\SC(=S)N(C)C2=O)cc1 5374679 RBJVFFVQHNTCMI-FLIBITNWSA-N 306.412 2.267 10 40 DECB O=S(=O)(O)c1ccc(/N=N\c2c(O)cc(O)cc2O)cc1 104366603 VZNWXPSRHNOUOI-YPKPFQOOSA-N 310.287 2.466 10 40 DECB CC1(C)[C@H]2CC[C@@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 100261965 RCPAVDBASIFGAJ-SJCJKPOMSA-N 303.333 2.016 10 40 DECB COc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1[N+](=O)[O-] 5234124 USYTZGUOJWYUGN-UHFFFAOYSA-N 324.314 2.110 10 40 DECB CN(C)C(=O)[C@@H]1CC[C@H](N=[N+]=[N-])[C@@H](NC(=O)OC(C)(C)C)C1 169449516 LVJZCKRMMBTVNC-VWYCJHECSA-N 311.386 2.447 10 40 DECB Cn1c(-c2ccc(O)c(O)c2O)cs/c1=N\c1ccccn1 101721003 WDEDZVNPMXYUBR-ICFOKQHNSA-N 315.354 2.498 10 40 DECB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NCCCC(=O)O 19143462 VNWARJLHVAASSW-LCYFTJDESA-N 321.764 2.401 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 1254845 ZUVZZNBYZGLVRK-SDKXAQGSSA-N 322.411 2.392 10 40 DECB CCN1C(=O)N/C(=C/c2ccc(N(CC)CC)cc2OC)C1=O 14010261 RCNHSKZTUUVCSF-GXDHUFHOSA-N 317.389 2.454 10 40 DECB CCOc1cccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)c1 8023099 PDSOOZJVHBSURE-YRNVUSSQSA-N 323.395 2.371 10 40 DECB OC1CCN(c2ccc(CNCc3cccnc3)cc2F)CC1 71825306 CYQHMHBMQXMINH-UHFFFAOYSA-N 315.392 2.472 10 40 DECB Cn1c(/C=C2/C(=O)Nc3ccccc32)nc2ccccc2c1=O 36624719 FZDINVRCALMKGU-JLHYYAGUSA-N 303.321 2.426 10 40 DECB CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2)C(N)=O)cc1 248797 LQTPQUHUPWEKPE-FOWTUZBSSA-N 309.369 2.009 10 40 DECB COc1cccc([C@@H]2NCCc3cc(O)c(O)cc32)c1OC 3703466 GWNMBOJDROASRW-INIZCTEOSA-N 301.342 2.350 10 40 DECB O=C1N=C(O)/C(=C\c2cccs2)C(=O)N1C[C@H]1CCCO1 2282257 HYZNETGXVVCRQN-MXFUOJGSSA-N 306.343 2.229 10 40 DECB Cc1ccc(-n2c(C)cc(/C=C3\NC(=S)NC3=O)c2C)nc1 15012665 VPWQQKFHUAVYDM-QPEQYQDCSA-N 312.398 2.143 10 40 DECB CCN1C(=O)/C(=C\c2cccc(OC)c2O)C(C(=O)OC)=C1C 59435699 VOSRMAFKIPVECK-XFXZXTDPSA-N 317.341 2.093 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C\NN2CCCCCC2)C(O)=NC1=S 38179478 CYDOMTUFKOSRSB-JPQYHBGPSA-N 324.450 2.133 10 40 DECB CC(C)COc1ccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 68933186 OXLQIFOZYWNZFZ-UHFFFAOYSA-N 316.357 2.155 10 40 DECB COc1cccc(CNc2ccc(S(C)(=O)=O)cc2)c1O 21013424 WDLYVWNLVDYABF-UHFFFAOYSA-N 307.371 2.416 10 40 DECB COC1(NC(=O)c2cccc(C)c2)C(=O)c2ccccc2C1=O 226297923 DTHSEZUZQXQLJD-UHFFFAOYSA-N 309.321 2.147 10 40 DECB CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(C)nn1C 59733325 QTABXCNNGWYMOR-UHFFFAOYSA-N 300.406 2.457 10 40 DECB COc1ccc(N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 5930271 FMEKTKQDRRBEMR-UHFFFAOYSA-N 314.345 2.325 10 40 DECB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccncc3)C2=O)c1 277637 PHQKFJKNRNPQHP-XNTDXEJSSA-N 321.336 2.365 10 40 DECB O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/c1ccc(O)cc1 492505 DSJJLBWTTPIHNB-XNTDXEJSSA-N 322.320 2.054 10 40 DECB COc1cc(OC)c(/N=N\c2c(N)nc(N)nc2O)cc1Cl 104125371 AVOQLKIMZMKCBQ-HNENSFHCSA-N 324.728 2.433 10 40 DECB Cc1n[nH]cc1CN[C@@H](C)c1ccc(N2CCOCC2)cc1 65463740 BFRBWTPHYFTEQA-ZDUSSCGKSA-N 300.406 2.406 10 40 DECB CCOCCO[C@@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 69368785 OEULBSRZXMZCJH-AWEZNQCLSA-N 320.433 2.127 10 40 DECB Nc1ccc(CN(C2CC2)S(=O)(=O)c2ccccn2)cc1 97094605 WVSLSWRKUFEXEK-UHFFFAOYSA-N 303.387 2.017 10 40 DECB COc1ccc(N(CCC(N)=O)C[C@@H](O)c2ccccc2)cc1 8705057 SLJRMAQWPQAOLP-QGZVFWFLSA-N 314.385 2.111 10 40 DECB CCCCN1CCc2cc(/C=C3/C(=O)NC(=O)N=C3O)ccc21 5033137 CLNWFNCOBZXZJN-UHFFFAOYSA-N 313.357 2.439 10 40 DECB O=C1NC(=O)C(=Cc2ccccc2Cc2ccccc2F)C(=O)N1 408868101 MKXUKRHFNGOSRP-UHFFFAOYSA-N 324.311 2.166 10 40 DECB CC(C)(C)OC(=O)N1CCN(c2ccc(CN)cc2F)CC1 39947551 RKPOSFCQCMOLPM-UHFFFAOYSA-N 309.385 2.342 10 40 DECB in-vitro O=C1NN=C(C(F)(F)F)/C1=C\NCc1cccc(Cl)c1 100408816 MJSSWXHPBDHTEX-RMKNXTFCSA-N 303.671 2.362 10 40 DECB O=C(O)[C@@H]1Nc2c(O)cc(Cl)c([N+](=O)[O-])c2[C@H]2C=CC[C@@H]21 4539520 WGUAPOVFDKLQGB-JFWOZONXSA-N 310.693 2.492 10 40 DECB biogenic,in-vitro CCOC1=NN(c2ccccc2)C(=O)/C1=C\NCc1cccnc1 100249992 XVTIFWRJKFWLSM-SSZFMOIBSA-N 322.368 2.452 10 40 DECB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc[nH]3)C2=O)cc1 507187 RRLVYXNTJJFGRR-GXDHUFHOSA-N 309.325 2.244 10 40 DECB CN1c2ccccc2C(=O)N[C@H]1c1c[nH]nc1-c1cccnc1 11034658 HBQIJEQKMVIJBG-MRXNPFEDSA-N 305.341 2.350 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C\c3cccc(O)c3)S2)CC1 33320411 QOOMGBURMIJYSP-SDNWHVSQSA-N 317.414 2.000 10 40 DECB O=C(COc1ccc(N2CCCC2)cc1)NCC(F)(F)F 96455292 CLKSOMAQVSHJPP-UHFFFAOYSA-N 302.296 2.344 10 40 DECB CCN(CC)c1ccc(/C=C2\C(=O)N(C)C(=O)N=C2O)cc1 24543581 GVQWGJYEFBMINP-RAXLEYEMSA-N 301.346 2.465 10 40 DECB O=S(=O)(Nc1ccc(O)cc1)c1ccc(-n2cccn2)cc1 36359886 TZTAMZHJUBNKOS-UHFFFAOYSA-N 315.354 2.379 10 40 DECB CC(C)OCCCNCc1cc(=O)oc2cc(O)c(O)cc12 8723763 GBNMNSZAYXCICJ-UHFFFAOYSA-N 307.346 2.109 10 40 DECB Cc1ccc(NS(=O)(=O)c2ccccc2)c(C(=O)C=[N+]=[N-])c1 5582671 SNCLWZXIXRLMRJ-UHFFFAOYSA-N 315.354 2.279 10 40 DECB CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(N(C)C)cc1 4044807 DVNKEEHUUWGAFQ-HNNXBMFYSA-N 317.389 2.334 10 40 DECB CCOc1ccccc1/C=C1\C(=O)N(C)C(C)=C1C(=O)OC 408895808 VVKCBMDVOVREAH-RAXLEYEMSA-N 301.342 2.388 10 40 DECB CN(C)c1ccc(CNC(=O)CN2CCc3ccccc3C2)cc1 12534282 SNMDTCZBIMILPM-UHFFFAOYSA-N 323.440 2.427 10 40 DECB COc1ccc(N2CCN(c3nccnc3Cl)CC2)cc1 40478745 JIHGMIGGKKBLJC-UHFFFAOYSA-N 304.781 2.465 10 40 DECB CCCCC(=O)NN1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5552777 ALFTXUDZNRTSHG-NTMALXAHSA-N 309.416 2.437 10 40 DECB N=C1/C(=C/c2ccco2)C(=O)N=C2SC(c3cccnc3)=NN12 542729 OPPJPCWWTVKXGV-RQWODAFVSA-N 323.337 2.342 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C\Nc2ccc(F)cc2)C(=O)NC1=S 9288216 SIHMCNQLGUFWBM-ZPBHHCQCSA-N 321.377 2.163 10 40 DECB Cc1nc2c(c(=O)[nH]1)CN(Cc1ccc(N3CCCC3)cc1)CC2 12222730 OUGXXFULJWLBCV-UHFFFAOYSA-N 324.428 2.237 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 5690107 SENGJYWBFIKNOC-HUYFXPKMSA-N 324.427 2.336 10 40 DECB CNC(=O)c1cccnc1NCCCSc1nccs1 89392142 DNLUUZRQJUFSQT-UHFFFAOYSA-N 308.432 2.492 10 40 DECB COCCCN/C(C)=C1\C(=O)N(c2ccc(F)cc2)N=C1C 100423012 OGHGGSYGPUYPDW-PTNGSMBKSA-N 305.353 2.448 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)s1 107775327 ZEHFRWZDFMOIRP-KPKJPENVSA-N 316.338 2.312 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 1805088 DLJAWAOAHJQVKI-WPVMNKCKSA-N 308.384 2.146 10 40 DECB CCCOC(=O)CN1C(=O)/C(=C/c2cccnc2)SC1=S 1809432 WINLMSBTEVTGHA-XFFZJAGNSA-N 322.411 2.236 10 40 DECB CCOc1cc([C@H]2NCCc3cc(O)c(O)cc32)ccc1O 19691263 YKLRGISFHBOWHB-QGZVFWFLSA-N 301.342 2.437 10 40 DECB COCCNCc1c(O)c(Cl)cc2c3c(c(=O)oc12)CCC3 20625278 MHVACGVHOTUCKG-UHFFFAOYSA-N 323.776 2.377 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1cc([N+](=O)[O-])ccc1F 59489892 RMOOTHMXGUMKGY-UHFFFAOYSA-N 321.260 2.488 10 40 DECB CCN1C(=O)N/C(=C/c2cc(C)n(-c3cccnc3)c2C)C1=O 9265565 BCMANZYPVJHHLG-OQLLNIDSSA-N 310.357 2.402 10 40 DECB CCN1C(=O)C(=CNC2CCCCCC2)C(=O)N(CC)C1=S 8484594 LJAMCPMOLCDOEV-UHFFFAOYSA-N 323.462 2.178 10 40 DECB CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 55329184 URDKNYQDDOEVER-RYUDHWBXSA-N 309.385 2.258 10 40 DECB CCC(O)(CC)CNCc1ccc(N2CCOCC2)c(F)c1 66991120 HWYUJZSXUJPLNT-UHFFFAOYSA-N 310.413 2.303 10 40 DECB c1cnc(N2CCC[C@H](NCc3ccc4c(c3)CCO4)C2)nc1 43288590 WOUVIWZGZLVEFQ-INIZCTEOSA-N 310.401 2.170 10 40 DECB COc1ccc(OC)c(C=C2C(=O)OC3(CCCC3)OC2=O)c1 5916239 OMASFUFGXJYHTR-UHFFFAOYSA-N 318.325 2.458 10 40 DECB COc1ccc(N2CCN([C@H](CN)c3ccco3)CC2)cc1 19795783 KVLBJBLIMUFLET-MRXNPFEDSA-N 301.390 2.110 10 40 DECB O=C1OCCN1CCN1CCCc2cc(OC(F)F)ccc21 65597624 KWFBYHWASPUSNJ-UHFFFAOYSA-N 312.316 2.493 10 40 DECB O=C1/C(=C\c2ccccn2)SC(=S)N1C[C@@H]1CCCO1 96019592 UNCJSBXAVQDULX-SERMCNLOSA-N 306.412 2.462 10 40 DECB CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc1 6540837 IJPKREMCYLZVEL-QQMDNXKGSA-N 318.398 2.120 10 40 DECB COc1ccc(S(=O)(=O)Nc2ccccc2C)c2nonc12 32579212 KOGLBKHGGRNBHR-UHFFFAOYSA-N 319.342 2.341 10 40 DECB CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccn2)SC1=S 2447598 BWPIWQOPSCJTLZ-CBFJXKFUSA-N 308.384 2.146 10 40 DECB CONC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 74217003 NAGGSFGKXKRJQP-UHFFFAOYSA-N 302.330 2.157 10 40 DECB COc1ccc([C@@H]2CNCc3c2ccc(OC)c3O)cc1O 3847193 FNIFXZANNCKMSL-LBPRGKRZSA-N 301.342 2.350 10 40 DECB biogenic CC(C)OC(=O)CN1C(=O)/C(=C\c2ccco2)SC1=S 4483113 OSSQTJPYJNDUDG-UXBLZVDNSA-N 311.384 2.432 10 40 DECB CC1=NN(c2ccccc2)C(=O)/C1=C(\N)Nc1nc(C)cc(C)n1 101091021 ZVFUGGJTWNYXSP-CCEZHUSRSA-N 322.372 2.098 10 40 DECB CCc1ccc(/C=C2\SC(N3CCN(C)CC3)=NC2=O)cc1 13749152 KHTUSKGHRUIAKM-QINSGFPZSA-N 315.442 2.467 10 40 DECB COC(=O)Nc1nnc(Sc2ncc([N+](=O)[O-])s2)s1 8716939 IOZHQYTXEUCSBT-UHFFFAOYSA-N 319.349 2.232 10 40 DECB COc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1OC 15938926 GUAUWURXSVMHCW-UVTDQMKNSA-N 324.336 2.165 10 40 DECB COc1ccccc1/C=C1\SC(=S)N([C@H](C)C(=O)O)C1=O 1203236 IWDBBBIBRNNGFL-XNYAHFKXSA-N 323.395 2.370 10 40 DECB O=C1N/C(=C/c2ccc(O)c(O)c2)C(=O)N1Cc1ccccc1 409197662 LOQYOPACEHEMFH-MDWZMJQESA-N 310.309 2.191 10 40 DECB CC(=O)O[C@]12C=C[C@@](OC(C)=O)(CCc3ccc(o3)CC1)O2 6761561 GXKCEGADIFAOCH-HZPDHXFCSA-N 306.314 2.264 10 40 DECB CCCCN/C=C1\C(=O)NC(=S)N(c2ccccc2C)C1=O 100962683 PCMOUIWKTBZCCB-ZRDIBKRKSA-N 317.414 2.016 10 40 DECB COc1ccc2ccc(O)c(CN3CCN(C(C)=O)CC3)c2c1 16077752 YBKHAOQBKOHRLQ-UHFFFAOYSA-N 314.385 2.218 10 40 DECB Cc1cc(N2CCOCC2)ccc1/C=C1/SC(=O)N(C)C1=O 981670 JBCOAYSZHPRAKG-GXDHUFHOSA-N 318.398 2.498 10 40 DECB Cc1cc(CN(C)Cc2ccc(N3CCOCC3)c(F)c2)n[nH]1 19658377 ZBFQIEIRVGYGBG-UHFFFAOYSA-N 318.396 2.326 10 40 DECB NS(=O)(=O)c1ccc(/N=N/Nc2ccc(C(=O)O)cc2)cc1 4428597 YVOXCXFBTMLHDW-UHFFFAOYSA-N 320.330 2.143 10 40 DECB CC1(C)[C@H]2CC[C@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 100261957 RCPAVDBASIFGAJ-YVEFUNNKSA-N 303.333 2.016 10 40 DECB Cn1cc([C@@H]2OCC[C@@H]2CNCc2ccc3c(c2)CCO3)cn1 89755315 WBAQSRNLYPCBRO-CRAIPNDOSA-N 313.401 2.222 10 40 DECB O=C1C(=O)[C@@H](c2ccccc2)S(=O)(=O)[C@@H]1c1ccccc1 5854860 AZBBYBGBGXLIKV-HZPDHXFCSA-N 300.335 2.036 10 40 DECB COc1cc(/N=N\c2c(N)nc(N)nc2O)c(OC)cc1Cl 17885623 OZGLQXRHIBTCJP-HNENSFHCSA-N 324.728 2.433 10 40 DECB CCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2446385 AOEJRFGNFVCDHD-DFYQSJSGSA-N 324.427 2.480 10 40 DECB CCCN(CCC)c1ccc(C=C2C(=O)NC(=O)NC2=O)cc1 4599192 JLUPYJQUSXVRLR-UHFFFAOYSA-N 315.373 2.062 10 40 DECB C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)c1cccnc1 97098047 MUZSBNGQRFCNTP-RYUDHWBXSA-N 300.358 2.344 10 40 DECB CCOc1ccc(C(=O)O)cc1/C=C1\SC(=S)NC1=O 408531829 RUIVZFZGLWPUDD-POHAHGRESA-N 309.368 2.272 10 40 DECB COc1ccc(N2CCN(C(=O)c3ccc(C)n3C)CC2)cc1 8727487 HKPDDVSPUGFJEU-UHFFFAOYSA-N 313.401 2.305 10 40 DECB COC(=O)c1c(O)c(O)cc2c1CCNC[C@@H]2c1ccccc1 138412840 LAXHIMODSURKFU-CQSZACIVSA-N 313.353 2.162 10 40 DECB CN(C)c1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1 966855 NQCAEFWJMWHHDD-YRNVUSSQSA-N 322.411 2.038 10 40 DECB Cc1ccccc1N1C(=O)/C(=C/c2ccoc2)C(=O)NC1=S 409241990 PNTLJRRHFNYXBS-XYOKQWHBSA-N 312.350 2.419 10 40 DECB O=C(O)CCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 1754549 JRFVMRNBAOSUAF-YFHOEESVSA-N 309.368 2.068 10 40 DECB Cc1ccc(F)cc1NS(=O)(=O)c1cccc2nonc12 13948440 GEOHWFYFHNHASM-UHFFFAOYSA-N 307.306 2.471 10 40 DECB CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(C)C1=O 6440728 DDHFHVIVKRGHJV-LZAIMSLLSA-N 318.398 2.120 10 40 DECB C[C@@H]1CN(C2=NC(=O)/C(=C\c3ccncc3)S2)C[C@@H](C)O1 33560097 LBTGLQQURCGEBX-AHCVXCRNSA-N 303.387 2.161 10 40 DECB Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCCC2)c(O)c1O 58161298 RIFQEEIQLHLZAK-SNVBAGLBSA-N 307.346 2.010 10 40 DECB CCC12CN3CC(C)(CN(C1)C3c1cccc(OC)c1O)C2=O 19323557 PGRZKKGBLLDBOW-UHFFFAOYSA-N 316.401 2.016 10 40 DECB biogenic CCOC(=O)[C@@H]1CCCN(Cc2cc(C)cc(OC)c2O)C1 89983566 CVGLKAHNDJUTCO-CYBMUJFWSA-N 307.390 2.484 10 40 DECB CCOc1ccc(C=C2C(=O)OC(C)(C)OC2=O)cc1OC 33749095 LKDJKKSARRJGPK-UHFFFAOYSA-N 306.314 2.313 10 40 DECB C[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1ccc2c(c1)CCO2 78898032 XSMUKCWOTJELQR-SUMWQHHRSA-N 314.429 2.358 10 40 DECB COC(=O)CN1C(=O)/C(=C/c2ccc(OC)cc2)SC1=S 1101219 GWQMDTXXGVOOMR-XFFZJAGNSA-N 323.395 2.069 10 40 DECB Cc1c(O)c(CNCCCO)cc2c1oc(=O)c1ccccc12 13653500 UZWTXLMBAWGUNX-UHFFFAOYSA-N 313.353 2.432 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5374593 BWMXWQYIHRPZIZ-MBACFSSFSA-N 310.400 2.325 10 40 DECB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(N(C)CC)cc1 182770 WNWBRPAUERVSQI-HNNXBMFYSA-N 317.389 2.334 10 40 DECB CS(=O)(=O)Nc1cc(Cl)c(O)c(Br)c1 3055262 VQASFVXIDOMRQW-UHFFFAOYSA-N 300.561 2.180 10 40 DECB CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccncc2)SC1=S 1476230 ZTTOWVGXKQFKJJ-CBFJXKFUSA-N 308.384 2.146 10 40 DECB CCC[C@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2446387 AOEJRFGNFVCDHD-UBYNWHESSA-N 324.427 2.480 10 40 DECB CCCN1C(=O)N/C(=C/c2cc(C)n(CCOC)c2C)C1=O 409241935 PJRNGYHLOSZGHA-GXDHUFHOSA-N 305.378 2.054 10 40 DECB CCCOC(=O)CN1C(=O)/C(=C/c2ccccn2)SC1=S 1809437 ALIXHFFENZEGFS-FLIBITNWSA-N 322.411 2.236 10 40 DECB Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 3394242 JAODYQUJLOXKCH-UHFFFAOYSA-N 320.370 2.231 10 40 DECB O=c1c([C@H]2NCCc3cc(O)c(O)cc32)coc2ccccc12 16525183 OTPBUNCWPYWHIS-KRWDZBQOSA-N 309.321 2.439 10 40 DECB C[C@H](Sc1nncs1)C(=O)N(C)Cc1ccccc1O 48606784 CIVRCSAOHIUOGW-VIFPVBQESA-N 309.416 2.383 10 40 DECB COc1nccnc1NCc1ccc(N2CCOCC2)c(F)c1 95959182 MHAFDQWVFKASRT-UHFFFAOYSA-N 318.352 2.073 10 40 DECB CN1CCN(C2=NC(=O)/C(=C\C=C/c3ccccc3)S2)CC1 13633080 GZAHMUZEGYENCQ-HAVFLYGMSA-N 313.426 2.461 10 40 DECB CCOC(=O)[C@@H]1Nc2c(C(=O)OC)cccc2[C@@H]2C=CC[C@H]12 58850733 JZORPBWRAZUARM-ITDIGPHOSA-N 301.342 2.490 10 40 DECB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1C(C)C 14183090 WJTLDDGMXMACKQ-UHFFFAOYSA-N 303.362 2.120 10 40 DECB CC[C@H](C)N1C(=O)/C(=C\NNc2ccccc2)C(O)=NC1=S 38182607 QPQYPPBJTAAHTE-JMZICWNOSA-N 318.402 2.369 10 40 DECB Cc1cc(/N=N/c2ccc(S(N)(=O)=O)cc2)c(N)cc1N 98086980 ZSQXGXYCVBCCJA-ISLYRVAYSA-N 305.363 2.222 10 40 DECB O=C1NC(=S)N(c2cccc(F)c2)C(=O)/C1=C/c1ccco1 409018216 RGHAOCIOOBAATD-XYOKQWHBSA-N 316.313 2.250 10 40 DECB O=CN1N=C(c2ccccc2O)C[C@H]1c1ccc2c(c1)OCO2 66091608 IZRQQFNTVFIKRQ-AWEZNQCLSA-N 310.309 2.428 10 40 DECB O=C(NCc1c(O)ccc2c1CCCC2)c1ccc2nncn2c1 75159789 TZUHPMPSGYSRJB-UHFFFAOYSA-N 322.368 2.244 10 40 DECB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1ccc(N(C)C)cc1 408896262 XDBWDQLOWOGBNX-UVTDQMKNSA-N 300.358 2.055 10 40 DECB C[C@@H]1CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)[C@@H]1O 15219144 WWVNIBVFNYKUQY-CQLKUDPESA-N 322.316 2.424 10 40 DECB biogenic COc1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)cc1 1673166 JORBZMDJMACPKC-KZULUSFZSA-N 317.385 2.361 10 40 DECB Cn1c(SCC(=O)O)nnc1-c1ccc(-n2cccc2)cc1 228979749 NSAIKUDPVUJMEO-UHFFFAOYSA-N 314.370 2.450 10 40 DECB O=C1COc2ccc(N3CCNCC3)cc2N1Cc1ccccc1 31947243 CEIPWBVUXKCWEX-UHFFFAOYSA-N 323.396 2.022 10 40 DECB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccccc3O)C2=O)c1 408739472 CEOSLVCPHAIYPM-GXDHUFHOSA-N 322.320 2.367 10 40 DECB CCC[C@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 4482975 AOEJRFGNFVCDHD-MXBGMFSPSA-N 324.427 2.480 10 40 DECB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1CC1 25086751 MAUZPKHENBJCCP-UHFFFAOYSA-N 303.406 2.075 10 40 DECB CCCCN(C)S(=O)(=O)NCCCSc1nccs1 69658480 NFEDTQGWXXNLRV-UHFFFAOYSA-N 323.509 2.192 10 40 DECB CN(Cc1cc2c(cc1O)OCO2)Cc1nccn1C(F)F 12535781 AONVBASZXBIGQN-UHFFFAOYSA-N 311.288 2.345 10 40 DECB c1cnnc(N2CCC[C@@H]2CNCc2ccc3c(c2)CCO3)c1 75132734 KQTRJAIXFGRXIA-MRXNPFEDSA-N 310.401 2.170 10 40 DECB COC(=O)c1ccc(N/C=C2/C(=O)NN=C2c2ccccc2)cc1 100281608 RVMAVZRHQGFWRN-RVDMUPIBSA-N 321.336 2.303 10 40 DECB C[C@H]1CN2CCC[C@@H]2CN1Cc1ccc(N2CCOCC2)cc1 72324448 MQMBPUANXYJSSL-QFBILLFUSA-N 315.461 2.192 10 40 DECB O=C1NN=C(C(F)(F)F)/C1=C/NCc1cccc(Cl)c1 95932659 MJSSWXHPBDHTEX-TWGQIWQCSA-N 303.671 2.362 10 40 DECB COc1ccc(N2CCN[C@H](C(=O)Nc3ccccc3)C2)cc1 257214727 CNFDZPLYGSKASJ-KRWDZBQOSA-N 311.385 2.112 10 40 DECB Cc1cccc(Cn2nnc3c2C(=O)c2ccccc2C3=O)c1 384289 IYWAWMLPAXYKLU-UHFFFAOYSA-N 303.321 2.410 10 40 DECB O=C(/C=C/c1cccnc1)NCc1ccc(N2CCOCC2)cc1 56199299 VDDSEIYMQYMJEM-VMPITWQZSA-N 323.396 2.248 10 40 DECB Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCCC2)c(O)c1O 58161296 RIFQEEIQLHLZAK-JTQLQIEISA-N 307.346 2.010 10 40 DECB Cc1nn(C)c(C)c1C(=O)N(C)Cc1ccc(N(C)C)cc1 58406959 ZOHXPUPGGAIOLO-UHFFFAOYSA-N 300.406 2.375 10 40 DECB C[C@@H](Sc1nncs1)C(=O)N(C)Cc1ccccc1O 48606785 CIVRCSAOHIUOGW-SECBINFHSA-N 309.416 2.383 10 40 DECB Cc1ccoc1C(=O)NCc1ccc(N2CCNCC2)c(F)c1 95971562 VZVDSOYOASZEIO-UHFFFAOYSA-N 317.364 2.067 10 40 DECB CC1(C)[C@@]2(C)CC[C@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 28580589 DZULUWDRKKFMHB-ZWKOTPCHSA-N 317.360 2.406 10 40 DECB CC(=O)N1c2ccccc2[C@]2(O)[C@H]1SC1=[N+]2CCCCC1 479933 INCGYHPVJAEXLI-CVEARBPZSA-N 303.407 2.256 10 40 DECB CCOc1ccccc1NS(=O)(=O)c1cccc2nonc12 14256135 ZWUWUDCRQNAMSX-UHFFFAOYSA-N 319.342 2.422 10 40 DECB Oc1ccc(CNCc2ccn(CC(F)(F)F)n2)c(O)c1 256054756 XPPVXZITBYLAMO-UHFFFAOYSA-N 301.268 2.146 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2377116 SENGJYWBFIKNOC-BRNRAETOSA-N 324.427 2.336 10 40 DECB CC[C@@H](OC1CCCCC1)C(=O)NN1C(=O)CSC1=S 95942115 LSYJMDMRIUVXMH-SNVBAGLBSA-N 316.448 2.006 10 40 DECB Cc1cc(O)c(CN(C)[C@@H]2CCS(=O)(=O)C2)cc1C(C)C 27165313 XLVUJEQMBRKVAJ-CQSZACIVSA-N 311.447 2.443 10 40 DECB CN1C(=O)C(=CNc2cccc3ccccc23)C(=O)N(C)C1=O 3189447 YOSHEBUFWAUMKX-UHFFFAOYSA-N 309.325 2.186 10 40 DECB COc1cc(OC)c(OC)cc1/C=C1\SC(=S)NC1=O 12882334 GJAYKCMAXFREKQ-WZUFQYTHSA-N 311.384 2.201 10 40 DECB CCOc1cn(-c2ccc(N)cc2)nc1C(=O)N1CCCC1 97673639 PZNYAQIUXFECPI-UHFFFAOYSA-N 300.362 2.089 10 40 DECB COC(=O)c1c(C)[nH]c(C(=O)N(C)Cc2ccccc2O)c1C 42117430 KKYNURDTARFESL-UHFFFAOYSA-N 316.357 2.396 10 40 DECB COc1ccc(N2CCN(Cc3nc(C4CC4)no3)CC2)cc1 58157385 IDBXGDODCRSAQB-UHFFFAOYSA-N 314.389 2.278 10 40 DECB Cc1ccc(/C=C2/SC(N3CCN(C)CC3)=NC2=O)cc1 19940063 GJRZEJOBVATPBF-SDNWHVSQSA-N 301.415 2.213 10 40 DECB O=C(O)CCCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 1304736 AYYVOLPEHTXSEV-FLIBITNWSA-N 323.395 2.458 10 40 DECB CCOc1ccc(/C=C2\C(=O)N(C)C(C)=C2C(=O)OC)cc1 408978414 ZOXFPIHPQHNHNG-UVTDQMKNSA-N 301.342 2.388 10 40 DECB COC(=O)C1=C(C)NC(=O)/C1=C\c1ccccc1Br 573243 RKWZJMOKFFAJHT-YFHOEESVSA-N 322.158 2.409 10 40 DECB COc1cc(C(=O)N[C@@H](C)Cc2ccccc2)cc(OC)n1 145940366 GISTYMJZIXMMPZ-LBPRGKRZSA-N 300.358 2.460 10 40 DECB CC[C@@H](N[C@H](CC)c1ccccc1O)C(=O)N1CCOCC1 156281770 PAMWLEVGISPLRR-HUUCEWRRSA-N 306.406 2.070 10 40 DECB CC[C@H](NC(=O)[C@H](C)N1CCSCC1)c1ccccc1O 95976931 RAKOZVPKWARMHI-JSGCOSHPSA-N 308.447 2.397 10 40 DECB CCNC(=O)[C@@H](C)NC(=O)c1ccc(-n2c(C)ccc2C)cc1 24956924 XJOQGTCUYUJJPM-CQSZACIVSA-N 313.401 2.349 10 40 DECB O=C1NN=C(C(F)(F)F)/C1=C\NCc1ccc(Cl)cc1 13496705 WJMPCDZDSDNJDC-RMKNXTFCSA-N 303.671 2.362 10 40 DECB COc1ccc(C(=O)Nc2ccc(O)cc2C(=O)O)cc1OC 4040721 KVWSTVZNCFZFPZ-UHFFFAOYSA-N 317.297 2.360 10 40 DECB biogenic COC(=O)C1=C(C)N(C(C)C)C(=O)/C1=C\c1ccc(O)cc1 408996862 FHLPUENRFVAZSA-ZROIWOOFSA-N 301.342 2.473 10 40 DECB O=C(NC1=NN(c2ccccc2)C(=O)C1)NC1CCCCC1 6927529 AIMLPOPOGZQUSX-UHFFFAOYSA-N 300.362 2.369 10 40 DECB CSCc1nnc(SCC(=O)c2ccc(O)c(O)c2)o1 58315120 PKVDWUPFLWCOGC-UHFFFAOYSA-N 312.372 2.319 10 40 DECB CC(C)C[C@@H]1NC(=O)[C@H](C(C)C)N(Cc2ccccc2O)C1=O 72233717 HLORGVUHNJHOSV-HOCLYGCPSA-N 318.417 2.290 10 40 DECB COc1ccc2c(c1)CCCN2CC(=O)Nc1cn(C)nc1C 19658842 XZHNVCPYAGKLJE-UHFFFAOYSA-N 314.389 2.128 10 40 DECB O=C(C[C@@H]1SC(=S)NC1=O)Nc1ccc2[nH]ccc2c1 34926911 QMDLQMQGVJDLLC-JTQLQIEISA-N 305.384 2.013 10 40 DECB CC1(C)OC(=O)C(=CNc2nc3ccccc3s2)C(=O)O1 13999618 HHCFSGVGLLGOFF-UHFFFAOYSA-N 304.327 2.428 10 40 DECB CCN1C(=O)/C(=C/c2cc(C)n(CCOC)c2C)N(C)C1=S 409137808 YXQTYDQVVUGDHM-UVTDQMKNSA-N 321.446 2.171 10 40 DECB CN(C)S(=O)(=O)c1ccc(CSc2nccs2)o1 48876311 YPPDKMRFIHLQKX-UHFFFAOYSA-N 304.418 2.279 10 40 DECB O=c1c([C@@H]2NCCc3cc(O)c(O)cc32)coc2ccccc12 16525181 OTPBUNCWPYWHIS-QGZVFWFLSA-N 309.321 2.439 10 40 DECB C=CC(=O)NCCNC(=O)c1cc(C)n(-c2ccccc2)c1C 69775700 QVOQSFZQOZDSAX-UHFFFAOYSA-N 311.385 2.126 10 40 DECB COc1cc2c(cc1O)[C@@H](Cc1ccc(O)c(O)c1)NCC2 895655 RHMGJTZOFARRHB-CYBMUJFWSA-N 301.342 2.242 10 40 DECB in-vitro O=C1NN=C(C(F)(F)F)/C1=C/NCc1ccccc1Cl 100408805 VGANXPBHMNRFFE-VURMDHGXSA-N 303.671 2.362 10 40 DECB O=CN1N=C(c2ccccc2O)C[C@@H]1c1ccc2c(c1)OCO2 66091609 IZRQQFNTVFIKRQ-CQSZACIVSA-N 310.309 2.428 10 40 DECB Cc1cc(CNC(=O)c2nccn3ccnc23)ccc1N(C)C 76083188 HNRVIWDSVIXJCT-UHFFFAOYSA-N 309.373 2.034 10 40 DECB O=C(NC1CC1)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 58343181 NDPUKPWNSQPZIV-UHFFFAOYSA-N 314.429 2.372 10 40 DECB O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(O)c(O)c2)N1 95979 LNQLXMJBKUUMHY-BBRMVZONSA-N 324.336 2.267 10 40 DECB biogenic O=C1NN=C(C(F)(F)F)[C@@H]1/N=N/c1cccc([N+](=O)[O-])c1 100235330 HYNAGEZLFXNCHE-BZSVUZHVSA-N 301.184 2.095 10 40 DECB COc1ccc(/C=C2/SC(=S)N(C)C2=O)cc1[N+](=O)[O-] 13600874 YGYRWEVXSGCSFS-UXBLZVDNSA-N 310.356 2.434 10 40 DECB CCOc1ccc(O)c([C@H]2NC(N)=Nc3nc4ccccc4n32)c1 9609916 PGIFCNWTSQQGKA-HNNXBMFYSA-N 323.356 2.237 10 40 DECB [N-]=[N+]=NC[C@@H]1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1 75286318 FQUBFDDPWLBKIZ-LLVKDONJSA-N 321.312 2.298 10 40 DECB CCOC(=O)CCN1C(=O)/C(=C/c2ccco2)SC1=S 5236333 GHSLEXGHRNCVRA-NTMALXAHSA-N 311.384 2.434 10 40 DECB CCN(Cc1ccc(N(C)C)cc1)Cc1nnnn1C1CC1 44072497 UKDCLOUKEVUMIW-UHFFFAOYSA-N 300.410 2.096 10 40 DECB CCCCCCOc1ccc(C=C2C(=O)NC(=O)NC2=O)cc1 408538720 PRZQFVVVMLKKSY-UHFFFAOYSA-N 316.357 2.395 10 40 DECB CCOC(=O)NC(NC(=O)OCC)c1ccc(N(C)C)cc1 5736854 FBHWCPDYKDXHCX-UHFFFAOYSA-N 309.366 2.243 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373964 KKZSENKQLYBNIV-RUYJGKKWSA-N 324.427 2.336 10 40 DECB CN(Cc1ccccc1O)C(=O)Cn1ccc(=O)c2ccccc21 58424986 DZFLIQAHLBPCDV-UHFFFAOYSA-N 322.364 2.366 10 40 DECB CN1C(=O)/C(=C2/CC(=O)N(c3ccccc3)C2=O)c2ccccc21 9482704 SOBAGTMSQGQYOZ-VKAVYKQESA-N 318.332 2.380 10 40 DECB CN(C)c1ccc2c(c1)OCCN2C(=O)NCc1ccco1 95461072 SKVBRDBXFQYGQT-UHFFFAOYSA-N 301.346 2.454 10 40 DECB COc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1C 33700472 QPXZENIUTUBWOT-PTNGSMBKSA-N 308.337 2.465 10 40 DECB CCc1cccc(C)c1NC(=O)C[C@@H]1SC(=S)NC1=O 34926847 KYLYLGOZTIFNGM-JTQLQIEISA-N 308.428 2.403 10 40 DECB Cc1cc(C(=O)NCCC(N)=O)c(C)n1-c1cccc(Cl)c1 75147969 IMVFQUKXKRIPCM-UHFFFAOYSA-N 319.792 2.353 10 40 DECB CCN1C(=O)/C(=C\c2ccc(N3CCOCC3)o2)SC1=S 6463002 MGYAGFMFMSUICX-PKNBQFBNSA-N 324.427 2.337 10 40 DECB O=C1NC(=S)S/C1=C\c1ccc(N2CCOCC2)cc1 4046452 GSOZCFRSMTYPLM-XFXZXTDPSA-N 306.412 2.012 10 40 DECB CCOc1ccc(/C=C2\SC(NC(C)=O)=NC2=O)cc1OC 408756927 YIKYQWUELWJOLT-JYRVWZFOSA-N 320.370 2.200 10 40 DECB CC[C@H](NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1ccccc1O 248588725 YRHARCRSXURZOW-NOLJZWGESA-N 306.406 2.069 10 40 DECB O=C(O)CCCN1C(=O)/C(=C/c2ccccn2)SC1=S 967131 ZQCNGSIDJSWKHF-NTMALXAHSA-N 308.384 2.148 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1 4680828 CUAWQLQVFPGAHC-XNTDXEJSSA-N 322.320 2.367 10 40 DECB CCOc1cc([C@@H]2NCCc3cc(O)c(O)cc32)ccc1O 19691261 YKLRGISFHBOWHB-KRWDZBQOSA-N 301.342 2.437 10 40 DECB CCCc1noc(CN2CCN(c3ccc(OC)cc3)CC2)n1 58246428 STFDOTWRHNAELE-UHFFFAOYSA-N 316.405 2.353 10 40 DECB COc1ccc(N2CCN(C(=O)CC(C)C)CC2)c([N+](=O)[O-])c1 4741172 QTHNJDRXMDNMAO-UHFFFAOYSA-N 321.377 2.298 10 40 DECB Cc1cc(N2CCCC2)c(F)cc1/C=C1/NC(=S)NC1=O 33704191 YFNYSQAMWJFVCH-XYOKQWHBSA-N 305.378 2.080 10 40 DECB O=C1C(=O)[C@H](c2ccccc2)S(=O)(=O)[C@H]1c1ccccc1 5854851 AZBBYBGBGXLIKV-HOTGVXAUSA-N 300.335 2.036 10 40 DECB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(N)cc1 3885493 POKPHEDBFKATIT-UHFFFAOYSA-N 307.331 2.286 10 40 DECB CCC[C@@H](NCc1c(O)ccc2c(C)cc(=O)oc12)C(=O)O 4540324 WHUNYSQHNABNEU-GFCCVEGCSA-N 305.330 2.150 10 40 DECB CN(Cc1ccccc1O)C(=O)NC1CCN(C2CC2)CC1 45410044 WWEJHGSTUUNRGS-UHFFFAOYSA-N 303.406 2.160 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1ccc([N+](=O)[O-])s1 2024398 LHOBNVRNEMCLDJ-UHFFFAOYSA-N 309.299 2.410 10 40 DECB NC(=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 28328899 FSBTUUFIKUUWMV-UHFFFAOYSA-N 323.396 2.316 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CCNC(=O)[C@@H]1C[C@H]1C 69519552 CNXMJKGVFXTYAQ-UKRRQHHQSA-N 318.417 2.293 10 40 DECB COc1ccc(C[C@H](C)NC[C@H](O)c2ccc(O)c(O)c2)cc1 1673163 JORBZMDJMACPKC-SGTLLEGYSA-N 317.385 2.361 10 40 DECB O=C(O)/C=C/c1c2ccc(=O)c(O)c-2oc2c(O)c(O)ccc12 3954334 HVUVBNCTBKJHHZ-ZZXKWVIFSA-N 314.249 2.112 10 40 DECB in-vivo COc1ccc(Cl)cc1/C=C1\SC(NC(C)=O)=NC1=O 409025202 ROANJVPZZZMBFW-WDZFZDKYSA-N 310.762 2.455 10 40 DECB O=C1NC(=O)C(=Cc2ccccc2Oc2ccccc2)C(=O)N1 5604131 PXWGIYQKTWHIHT-UHFFFAOYSA-N 308.293 2.228 10 40 DECB COc1ccc(CCN2C(=O)[C@H](C)SC2=S)cc1OC 3615840 VJCUUIJOMOFSRV-VIFPVBQESA-N 311.428 2.495 10 40 DECB CC(=O)Oc1cc(N(C)C)c(N)c2c1C(=O)c1ccccc1C2=O 35323603 GETSUOQADJYLDY-UHFFFAOYSA-N 324.336 2.036 10 40 DECB CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCc3ccccc3C1)C(=O)C2=O 100261949 UIEXPJLYCJLADP-LIRRHRJNSA-N 311.381 2.146 10 40 DECB CCCOc1ccc(Cl)cc1C=C1C(=O)NC(=S)NC1=O 96193590 XJOCXBRXVGKKTA-UHFFFAOYSA-N 324.789 2.043 10 40 DECB CCN1C(=O)/C(=C\c2ccc(OC)cc2)C(C(=O)OC)=C1C 99933 UFCFCNCPGZGYMD-UVTDQMKNSA-N 301.342 2.388 10 40 DECB O[C@H](CN1CCCc2cc(OC(F)F)ccc21)Cn1cccn1 95381621 KKPDFEJQBYXXDS-CYBMUJFWSA-N 323.343 2.298 10 40 DECB Cc1ccccc1-n1c(C)cc(C=C2C(=O)NC(=O)NC2=O)c1C 409001397 POUMDZHMNPYMTO-UHFFFAOYSA-N 323.352 2.152 10 40 DECB O=C1NC(=O)C(=Cc2ccccc2Cc2cccc(F)c2)C(=O)N1 408875671 LDVHUCPRSIIJBE-UHFFFAOYSA-N 324.311 2.166 10 40 DECB CN1C(=O)N/C(=C\c2ccc(-c3cccc(C(=O)O)c3)o2)C1=O 4700805 ISHYSZDEAUYISB-WQLSENKSSA-N 312.281 2.167 10 40 DECB O=C(NN1C(=O)CSC1=S)c1ccc(Cl)cc1Cl 1452229 OSCMAJDKIUTKML-UHFFFAOYSA-N 321.210 2.499 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C\c3ccncc3)S2)C[C@H](C)O1 83332741 LBTGLQQURCGEBX-IMXZGNLGSA-N 303.387 2.161 10 40 DECB NS(=O)(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1 3953923 NBSRUZQXRUNPNY-FOCLMDBBSA-N 321.314 2.153 10 40 DECB in-man C[C@@H]1CN(C2=NC(=O)/C(=C/c3ccncc3)S2)C[C@@H](C)O1 248704 LBTGLQQURCGEBX-RWUOYMPMSA-N 303.387 2.161 10 40 DECB O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(O)c(O)c2)N1 95972 LNQLXMJBKUUMHY-CZUORRHYSA-N 324.336 2.267 10 40 DECB biogenic CN(C)c1ccc(CNC(=O)c2ccc(-n3cncn3)cc2)cc1 12556300 WAJBXASRVWCCFC-UHFFFAOYSA-N 321.384 2.263 10 40 DECB CC(C)([N+](=O)[O-])/[N+]([O-])=N/c1nonc1NCc1ccccc1 44932704 UPPKJOKJCQGYMK-VKAVYKQESA-N 306.282 2.289 10 40 DECB COC(=O)/C(=C1\C(=O)N(c2ccccc2)N=C1C)C(F)(F)F 4524113 UOFNXKCTHAQBME-ZHACJKMWSA-N 312.247 2.441 10 40 DECB CN(C)Cc1noc2c1C[C@H](NCc1ccc(F)cc1O)CC2 2055730286 VJBZSAQSSOFBBP-CYBMUJFWSA-N 319.380 2.228 10 40 DECB Nc1c(SCC(=O)O)ccc2c1C(=O)c1ccccc1C2=O 3845285 GIIBUPVVSGCCGT-UHFFFAOYSA-N 313.334 2.221 10 40 DECB biogenic CCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 4653459 IURHXSIHLHJJAB-UHFFFAOYSA-N 324.292 2.120 10 40 DECB O=C(NCc1ccc(N2CCSCC2)cc1)Nc1cn[nH]c1 40554038 PBBKSZXOJCKEJL-UHFFFAOYSA-N 317.418 2.285 10 40 DECB CN(C)c1ccc(/N=N/c2nc(C(=O)O)c(C(=O)O)[nH]2)cc1 5334170 HQKQBHVAENDJCC-WUKNDPDISA-N 303.278 2.288 10 40 DECB CCN1/C(=C2/SC(=S)N(N)C2=O)C=Cc2ccccc21 101999958 IUZMKYBYBXXCBC-VAWYXSNFSA-N 303.412 2.485 10 40 DECB c1nc2n(n1)C[C@@H](NCc1ccc(N3CCCCC3)cc1)CC2 69600135 FVUFOBSQYGAACV-INIZCTEOSA-N 311.433 2.373 10 40 DECB CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cccn2C)C1=O 409089073 MVKDJZZCAJDIEC-SDNWHVSQSA-N 323.352 2.254 10 40 DECB COc1ccc(-c2nc(C)c3c(O)c(C(N)=O)sc3n2)cc1 13728472 VXKWGQXMYNBAOK-UHFFFAOYSA-N 315.354 2.480 10 40 DECB Cc1ccc(N2C(=O)/C(=C/NCCCO)SC2=S)cc1 618254490 DDRNUODJCKDGEM-XFXZXTDPSA-N 308.428 2.173 10 40 DECB O=C1C(=O)[C@@H](c2ccccc2)S(=O)(=O)[C@H]1c1ccccc1 17223165 AZBBYBGBGXLIKV-IYBDPMFKSA-N 300.335 2.036 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1ccc(C(=O)O)cc1 527599 NAKWTHAFJTTXNV-UHFFFAOYSA-N 302.282 2.139 10 40 DECB O=C1/C(=C\c2cccnc2)SC(=S)N1C[C@@H]1CCCO1 33429599 TUOBXANTKCVYMU-WBOGTDJTSA-N 306.412 2.462 10 40 DECB [N-]=[N+]=CC(=O)[C@@H](Cc1ccccc1)NC(=S)Nc1ccccc1 12320979 WJFGAQHVPVUPEW-OAHLLOKOSA-N 324.409 2.454 10 40 DECB O=C1c2ccccc2C(=O)N1N=[N+]([O-])N1Cc2ccccc2C1 104229959 XXZSXELWSWBBKH-UHFFFAOYSA-N 308.297 2.091 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccncc2)SC1=S 1476232 ZTTOWVGXKQFKJJ-SBMLRHLQSA-N 308.384 2.146 10 40 DECB COCCN1C(=O)S/C(=C/c2ccc(N(C)C)cc2)C1=O 409146812 LCYHXBKCGGGCGR-JLHYYAGUSA-N 306.387 2.435 10 40 DECB CC[C@H](C)NC(=S)N1CCN(c2ccc(OC)cc2)CC1 414807 QUAYFZURLLXOQR-ZDUSSCGKSA-N 307.463 2.490 10 40 DECB Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(O)cc3)C2=O)c1 62550 FIHYEPLLKDUHDI-XNTDXEJSSA-N 322.320 2.367 10 40 DECB CCCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 55328998 KECGUIGNYDATHG-UHFFFAOYSA-N 319.449 2.495 10 40 DECB COn1c(-c2ccccc2)nc2c1C(=O)c1ccccc1C2=O 96336947 GXBQFRLCIWCMLW-UHFFFAOYSA-N 304.305 2.384 10 40 DECB CC1=C([N+](=O)[O-])CS(=O)(=O)/C1=C/c1ccc(N(C)C)cc1 13749070 LKPXWDBZYWTSNM-RIYZIHGNSA-N 308.359 2.073 10 40 DECB O=C(NN1C(=O)CSC1=S)c1csc2c1CCCC2 6550495 SCHVBMYMIMMCSO-UHFFFAOYSA-N 312.441 2.132 10 40 DECB NC1=Nc2nc3ccccc3n2[C@H](c2cc(Cl)ccc2O)N1 7126821 ZHMWPCZTUSWCMW-CYBMUJFWSA-N 313.748 2.492 10 40 DECB COc1ccc(N(C)CC(=O)Nc2cc(C)no2)cc1OC 58264309 IKMGAGMGKLCELD-UHFFFAOYSA-N 305.334 2.075 10 40 DECB Nc1ccc(CN(c2ccccc2)[C@H]2CCS(=O)(=O)C2)cc1 575421255 NZKVOHBAHPACNC-KRWDZBQOSA-N 316.426 2.463 10 40 DECB c1cnc(N2CCC(NCc3ccc4c(c3)CCO4)CC2)nc1 43288551 LAGMQHIADDLQED-UHFFFAOYSA-N 310.401 2.170 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C/c3ccncc3)S2)C[C@@H](C)O1 13123203 LBTGLQQURCGEBX-OWDBWLNLSA-N 303.387 2.161 10 40 DECB NC(=O)CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 8706427 OEXUUFBMXGKPOE-CYBMUJFWSA-N 317.414 2.307 10 40 DECB COc1ccc(N2CCN(C(=S)NCC(C)C)CC2)cc1 414884 GHMWRQRDDNEEIQ-UHFFFAOYSA-N 307.463 2.348 10 40 DECB CC[C@H](C)N1C(=O)/C(=C/Nc2ccccc2F)C(=O)NC1=S 9287361 KRWACLATOVIIHW-WKMLFNHBSA-N 321.377 2.163 10 40 DECB Cc1ccc(-n2c(C)cc(C(=O)NCCCC(N)=O)c2C)cc1 71851688 IDCNWWUCLKAGAC-UHFFFAOYSA-N 313.401 2.398 10 40 DECB NC(=O)C[C@@H](Nc1c2ccccc2nc2ccccc12)C(=O)O 5529514 NLWSHVQOMAJEGR-CQSZACIVSA-N 309.325 2.129 10 40 DECB CN1CCc2cc(O)c(O)cc2[C@H]1Cc1ccc(O)c(O)c1 56408 VHRSWCTVFBWHKE-CYBMUJFWSA-N 301.342 2.281 10 40 DECB biogenic,in-vitro O=C1c2c(O)ccc(O)c2C(=O)c2c(F)c(F)c(F)c(F)c21 4974078 PKJLMPNJHMHOIE-UHFFFAOYSA-N 312.174 2.430 10 40 DECB O=C(NCc1ccccc1O)c1ccc(Cn2ccccc2=O)o1 95393285 ROHMVIQUEMDSBM-UHFFFAOYSA-N 324.336 2.125 10 40 DECB CC1(C)[C@@H]2CC[C@@]1(C(=O)N1CCc3ccccc3C1)C(=O)C2=O 100261946 UIEXPJLYCJLADP-KUHUBIRLSA-N 311.381 2.146 10 40 DECB Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](C(N)=O)C2)cc1 53893482 XAEOZOOMHFFGBA-OAHLLOKOSA-N 311.385 2.042 10 40 DECB Cc1nsc(NCc2ccc(N3CCOCC3)c(F)c2)n1 96429206 NFQZNELNQTWTEQ-UHFFFAOYSA-N 308.382 2.434 10 40 DECB COc1cc2c(cc1O)[C@H](Cc1ccc(O)c(O)c1)NCC2 895656 RHMGJTZOFARRHB-ZDUSSCGKSA-N 301.342 2.242 10 40 DECB in-vitro O=S(=O)(Nc1ccc2c(c1)OCO2)c1ccc(F)c(F)c1 3268487 HQHXRMJIXIKUNY-UHFFFAOYSA-N 313.281 2.494 10 40 DECB C[C@]1(O)CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)C1 4654725 UGEKKXLEYACFTD-LJQANCHMSA-N 322.316 2.048 10 40 DECB biogenic,in-vitro Cc1n[nH]cc1CNCc1ccc(N2CCC(O)CC2)c(F)c1 97160014 BPLKDYTVDUASFB-UHFFFAOYSA-N 318.396 2.108 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc2c(c1)CCCO2 95471139 BGBRYPCPBMJADT-FOWTUZBSSA-N 320.348 2.473 10 40 DECB CCC12CN3CC(CC)(CN(C1)C3c1ccccc1O)C2O 19320209 KVUSYDDIDNYQLV-UHFFFAOYSA-N 302.418 2.189 10 40 DECB biogenic Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)N(C)C)cc1 5643725 OSGMALINSFVHSX-UHFFFAOYSA-N 300.358 2.339 10 40 DECB CC[C@@H](NC(=O)[C@H](C)N1CCSCC1)c1ccccc1O 95976932 RAKOZVPKWARMHI-GXTWGEPZSA-N 308.447 2.397 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2377121 SENGJYWBFIKNOC-ZJRUKIMVSA-N 324.427 2.336 10 40 DECB OC1CCN(c2ccc(CNCc3ccccn3)cc2F)CC1 71825305 ADNMSZPGQPLKJC-UHFFFAOYSA-N 315.392 2.472 10 40 DECB O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(O)c(O)c2)N1 95976 LNQLXMJBKUUMHY-CJNGLKHVSA-N 324.336 2.267 10 40 DECB biogenic NC(=O)c1cccnc1N1CC=C(c2c[nH]c3ncccc23)CC1 24055978 FAKAJPOSRIGKOF-UHFFFAOYSA-N 319.368 2.351 10 40 DECB CC1=NN(c2ccc(C)cc2)C(=O)/C1=C\NCCCC(=O)O 35185254 SXPLLAGPEVTYSN-UVTDQMKNSA-N 301.346 2.056 10 40 DECB COc1ccc(N2CCN(C(=S)NC(C)(C)C)CC2)cc1 1386204 CUEAUSXJHZJQKR-UHFFFAOYSA-N 307.463 2.490 10 40 DECB CC1(C)[C@]2(C)CC[C@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 100260036 DZULUWDRKKFMHB-QZTJIDSGSA-N 317.360 2.406 10 40 DECB CCO/C(C)=C1/C(=O)N(c2ccccc2)N=C1CC(=O)OC 1433026 BCGPKKJTYSIUHL-RVDMUPIBSA-N 302.330 2.263 10 40 DECB Cc1cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)c(C)n1C1CC1 8334218 ZFHXGFSYZMVBGE-UHFFFAOYSA-N 317.414 2.039 10 40 DECB COc1ccc2c(c1)CCCN2CC(=O)Nc1cc(C)on1 9117633 LGNXUKLWJQBBBX-UHFFFAOYSA-N 301.346 2.383 10 40 DECB Cc1cnn(CCC(=O)NCCCSc2nccs2)c1 74136175 ZSIXEYZHSLQKHA-UHFFFAOYSA-N 310.448 2.337 10 40 DECB N=C1/C(=C\c2ccc[nH]2)C(=O)N=C2SC(c3ccncc3)=NN12 32005374 LXVGJANIRMHFIT-AHCHECIRSA-N 322.353 2.077 10 40 DECB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=C1\SC(=S)NC1=O 100149968 GWAWHIWSNHOXGC-QBQSQJOESA-N 317.395 2.057 10 40 DECB O=C1NC(=O)C(=Cc2ccccc2OCc2ccccc2)C(=O)N1 59514535 GEPFYWDDNSFESR-UHFFFAOYSA-N 322.320 2.015 10 40 DECB O=C1/C(=C\c2ccccn2)SC(=S)N1C[C@H]1CCCO1 96019594 UNCJSBXAVQDULX-OYGDSYQHSA-N 306.412 2.462 10 40 DECB COc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)c(OC)c1 87835 MRZJYVCSKLUWMM-UHFFFAOYSA-N 318.325 2.458 10 40 DECB Cc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(C)n1CC(C)C 7981969 ZISKXRZBFLMPLF-UHFFFAOYSA-N 317.389 2.195 10 40 DECB O=CN1N=C(c2ccc(O)cc2)C[C@@H]1c1ccc2c(c1)OCO2 66091595 PJURZYLLEKARDD-OAHLLOKOSA-N 310.309 2.428 10 40 DECB Cc1cc(=O)n2nc(N)c(/N=N/c3ccc4c(c3)OCO4)c2[nH]1 4649647 OXXBRZAZSGNUEI-ISLYRVAYSA-N 312.289 2.057 10 40 DECB CC(C)C(=O)N[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2O)C1 69703764 XSUVCMOFBZRWGE-ZDUSSCGKSA-N 321.377 2.037 10 40 DECB Cc1ccc(O)c(/C=C2/C(=O)NN(c3ccc(F)cc3)C2=O)c1 5961198 IMSCPYTUXMQKMQ-ZROIWOOFSA-N 312.300 2.301 10 40 DECB COc1ccc2ccc(O)c(CN3CCCC[C@@H]3C(N)=O)c2c1 9913895 OHJSCHWDBKYKJT-MRXNPFEDSA-N 314.385 2.394 10 40 DECB O=C1c2ccccc2C(=O)c2c(O)c3c(c(O)c21)CCC[C@@H]3O 4995536 NVNRWHHTJDJRHF-NSHDSACASA-N 310.305 2.243 10 40 DECB Cn1cccc1/C=C1\SC(=S)N(CCCC(=O)O)C1=O 13758001 BCHGGUQQEBAARH-NTMALXAHSA-N 310.400 2.091 10 40 DECB O=C(O)CN1C(=O)/C(=C/c2ccc(F)c(F)c2)SC1=S 58367374 SBJDLOSBYYUIEX-WTKPLQERSA-N 315.322 2.251 10 40 DECB O=C1N[C@H](c2ccc(N3CCOCC3)cc2)Nc2ccccc21 9378710 YRPKYMUJTIQXDH-QGZVFWFLSA-N 309.369 2.377 10 40 DECB O=C1C/C(=C\c2ccc(O)c(O)c2)C(=O)N1CCc1ccccc1 9477019 KXFGQKOJKOMAPV-XNTDXEJSSA-N 323.348 2.483 10 40 DECB CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 55329182 URDKNYQDDOEVER-TXEJJXNPSA-N 309.385 2.258 10 40 DECB O=C1N=C(S)N(C2CCCCC2)C(=O)/C1=C\c1ccc[nH]1 1813892 NMYDDDULJJBWCV-XFXZXTDPSA-N 303.387 2.385 10 40 DECB O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C/NC1CC1 5771205 BJPNOXNTSMRJPS-GXDHUFHOSA-N 321.336 2.059 10 40 DECB COc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OC(C)=O 409353033 ZZPRFWTZSJTSDZ-KPKJPENVSA-N 323.395 2.452 10 40 DECB COc1ccc(N2CCC(Nc3ncnc4[nH]ncc34)CC2)cc1 69436107 HDFZCPBXRYHKKJ-UHFFFAOYSA-N 324.388 2.442 10 40 DECB O=C(O)CN1C(=O)/C(=C/c2ccc(F)cc2F)SC1=S 70039531 WMCIGMRIXSBGGM-OQFOIZHKSA-N 315.322 2.251 10 40 DECB COc1cc(C(=O)C(=O)c2ccc(O)c(OC)c2)ccc1O 1747299 MJHMXBDRUWSJOS-UHFFFAOYSA-N 302.282 2.181 10 40 DECB biogenic Oc1ccc(Br)cc1CNCCNc1ncccn1 78394152 OQLKURNKLTWDSS-UHFFFAOYSA-N 323.194 2.146 10 40 DECB CC[C@@H](N/C=C1\C(=O)N(c2ccc(C)c(C)c2)N=C1C)C(=O)O 101513700 PYFYJWOIQJWQMC-KQGZCTBQSA-N 315.373 2.363 10 40 DECB COc1ccc2c(c1)CCN2Cc1cc(=O)n2ccsc2n1 58934270 AUWJUPCAYXDNAU-UHFFFAOYSA-N 313.382 2.327 10 40 DECB CCN1C(=O)/C(=C\c2cn(C)c3ccccc23)C(=O)N=C1S 6783658 DWXXDNVPBWCBRD-WQLSENKSSA-N 313.382 2.236 10 40 DECB CN(C)c1ccc2c(c1)OCCN2C(=O)NCc1cccnc1 95405729 RGLRMVKAEZBCAJ-UHFFFAOYSA-N 312.373 2.256 10 40 DECB CCCCCOc1ccccc1C=C1C(=O)NC(=S)NC1=O 408737423 PTOGXAYIJJBIFI-UHFFFAOYSA-N 318.398 2.170 10 40 DECB COc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1C 96129583 ITHDGAGNNGYMFQ-IZZDOVSWSA-N 323.395 2.289 10 40 DECB COCCCN1C(=O)/C(=C\c2cccs2)C(C(=O)OC)=C1C 3623232 WFWHPVKLTOBKKL-RAXLEYEMSA-N 321.398 2.457 10 40 DECB CC(C)CCN1C(=O)/C(=C/N2CCOCC2)SC1=S 30819358 OIYHSVQHMVUDBJ-LUAWRHEFSA-N 300.449 2.066 10 40 DECB C[C@@H]1CN2CCC[C@@H]2CN1Cc1ccc(N2CCOCC2)cc1 72324627 MQMBPUANXYJSSL-VQIMIIECSA-N 315.461 2.192 10 40 DECB COc1ccc(N2CCC(NCc3c[nH]nc3C)CC2)cc1 78979904 KSZJFHHWVUUNBZ-UHFFFAOYSA-N 300.406 2.485 10 40 DECB CCCCCc1[nH]nc(C(=O)OC)c1/N=N\N1CCOCC1 16932196 AAKAOEQFXCFXKB-ZCXUNETKSA-N 309.370 2.260 10 40 DECB COCCN1C(=O)c2ccccc2N[C@@H]1c1ccc(O)c(O)c1 25310148 KEZSSFMVCGIJMN-INIZCTEOSA-N 314.341 2.311 10 40 DECB CC[C@H](N[C@H](CC)c1ccccc1O)C(=O)N1CCOCC1 156281545 PAMWLEVGISPLRR-CABCVRRESA-N 306.406 2.070 10 40 DECB COc1ccc2c(c1)c(=O)oc1cc(OCc3nnn[nH]3)ccc12 2226999 LWAXEGXUBXVIMJ-UHFFFAOYSA-N 324.296 2.047 10 40 DECB CCOCCCNC(=O)C1CCN(Cc2ccccc2O)CC1 4672314 MAEXQDXTYQFIDU-UHFFFAOYSA-N 320.433 2.147 10 40 DECB Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)on1 24207055 DWUSVZVCJVIIRT-UHFFFAOYSA-N 315.373 2.092 10 40 DECB [N-]=[N+]=CC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1 4837427 MNBHSGKOGWFIOP-OAHLLOKOSA-N 308.341 2.289 10 40 DECB O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C/c1ccco1 84725 XJUWAYOSEKJPQV-CSKARUKUSA-N 300.245 2.085 10 40 DECB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1cccc(OC)c1OC 408724358 CRMZKLMNEVNHKJ-XFXZXTDPSA-N 317.341 2.006 10 40 DECB CC(=O)Oc1ccc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)cc1 41078379 RPAQGILLLRCTRZ-FZGTXKIXSA-N 311.297 2.062 10 40 DECB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1 123909 MVIYDBUSZUWTLF-OAHLLOKOSA-N 317.389 2.332 10 40 DECB CC(=O)N1c2ccccc2[C@@]2(O)[C@H]1SC1=[N+]2CCCCC1 479935 INCGYHPVJAEXLI-HZPDHXFCSA-N 303.407 2.256 10 40 DECB C/C(C=C1C(=O)N(C)C(=S)N(C)C1=O)=C\c1ccccc1 59139694 GBDKOPHFLKBNOC-PKNBQFBNSA-N 300.383 2.232 10 40 DECB COc1ccccc1/C=C1\SC(=S)N([C@@H](C)C(=O)O)C1=O 1203233 IWDBBBIBRNNGFL-CLUBXZQOSA-N 323.395 2.370 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 5690110 SENGJYWBFIKNOC-PFEDMVJOSA-N 324.427 2.336 10 40 DECB COC(=O)c1c(O)c(O)cc2c1CCNC[C@H]2c1ccccc1 138412737 LAXHIMODSURKFU-AWEZNQCLSA-N 313.353 2.162 10 40 DECB CCc1nnsc1C(=O)NCc1ccc2c(c1)CCCN2C 58280437 CODBEPAQWGVGKZ-UHFFFAOYSA-N 316.430 2.413 10 40 DECB CCOc1cccc([C@@H]2NC(N)=Nc3nc4ccccc4n32)c1O 7125595 YWUGJACHBRMFKG-OAHLLOKOSA-N 323.356 2.237 10 40 DECB COC(=O)COc1ccc(/C=C2\SC(=S)N(C)C2=O)cc1 27019613 XNDBLANARJESOT-XFFZJAGNSA-N 323.395 2.069 10 40 DECB Cc1ccc(NC(=O)C[C@H]2SC(=S)NC2=O)cc1Cl 34926782 LLTBXHATQMWXEG-SECBINFHSA-N 314.819 2.494 10 40 DECB CC(C)Oc1ccc(Cl)cc1C=C1C(=O)NC(=S)NC1=O 408865090 AYTOLBVDSFCBPH-UHFFFAOYSA-N 324.789 2.042 10 40 DECB COCCN1C(=O)/C(=C\c2cccc(F)c2)C(C(=O)OC)=C1C 6348279 SHJSSJFEJFPGMD-UVTDQMKNSA-N 319.332 2.145 10 40 DECB CN1C(=O)/C(=C/c2ccc(C(=O)NC3CC3)cc2)SC1=S 5374687 LFJQIGWFMBTIGS-WQLSENKSSA-N 318.423 2.410 10 40 DECB CN1CCO[C@H](CNCc2ccc(N3CCCCC3)cc2)C1 75584174 FWOUSJHFVVPUNY-GOSISDBHSA-N 303.450 2.097 10 40 DECB Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1C(=O)O 13348772 KGZSZEVKLUOWEL-UHFFFAOYSA-N 307.327 2.200 10 40 DECB O=C(CN1CCN(c2ccccc2)CC1)c1ccc(O)c(O)c1 71328740 SUAZIJJQVNCDHZ-UHFFFAOYSA-N 312.369 2.103 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CCNC(=O)[C@H]1C[C@H]1C 69519555 CNXMJKGVFXTYAQ-HIFRSBDPSA-N 318.417 2.293 10 40 DECB COCCN1C(=O)/C(=C\c2ccc(C)cc2)C(C(=O)OC)=C1C 4702360 XUKJIELDPUSQKZ-PTNGSMBKSA-N 315.369 2.314 10 40 DECB CC(C)c1nc2n(n1)C[C@H](NCc1ccc3c(c1)CCO3)CC2 69897625 XAFPRBGKKDUYCY-OAHLLOKOSA-N 312.417 2.441 10 40 DECB O=C(Cc1cc(F)c(F)cc1F)NCc1ccc(O)c(O)c1 182510193 VHFIRGWOIAOBJS-UHFFFAOYSA-N 311.259 2.374 10 40 DECB C[C@@]1(O)CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)C1 4654724 UGEKKXLEYACFTD-IBGZPJMESA-N 322.316 2.048 10 40 DECB biogenic,in-vitro Nc1ccc(/N=N/c2ccc(N(CCO)CCO)cc2)cc1 4520979 NZKTVPCPQIEVQT-VHEBQXMUSA-N 300.362 2.475 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1ccc2c(c1)OCO2 346821 SIDNCSOLIIKZCS-UHFFFAOYSA-N 302.282 2.169 10 40 DECB COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)c1 1577493 MWQFECMIRHKTMK-KPZWWZAWSA-N 317.385 2.361 10 40 DECB O=C(C[C@H]1SC(=S)NC1=O)Nc1cccc(Cl)c1 34926774 NCJQGCLPWORYJB-MRVPVSSYSA-N 300.792 2.185 10 40 DECB CN(C)c1ccc(/C=C2\SC(N3CCOCC3)=NC2=O)cc1 13563155 UKGZFYRVZKIRSP-KAMYIIQDSA-N 317.414 2.055 10 40 DECB CCn1nc(C)c([N+](=O)[O-])c1NCCc1ccc(O)c(O)c1 192649470 LTGIEWLZPHEMDC-UHFFFAOYSA-N 306.322 2.185 10 40 DECB CNC(=O)CSc1ncc(-c2ccc(C)cc2)n1CCOC 44085902 SMGJOXLELQOBNY-UHFFFAOYSA-N 319.430 2.343 10 40 DECB O=C1/C(=C/c2cccs2)SC(=S)N1N1CCOCC1 2241488 FJVNTOBZEDSFDT-NTMALXAHSA-N 312.441 2.197 10 40 DECB C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(O)c(O)c1 1768056 IBCZJCQDLOHBPI-GTNSWQLSSA-N 303.358 2.058 10 40 DECB CN(C[C@H]1CCCO1)C(=O)NCc1ccc2c(c1)CCCN2C 72242376 JJDUSRPBFUEVCM-MRXNPFEDSA-N 317.433 2.389 10 40 DECB NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 57642645 ANBHEZCNDIBCJZ-UHFFFAOYSA-N 304.371 2.011 10 40 DECB COC(=O)c1cc2c(cc1C(=O)OC)C(=O)c1ccccc1C2=O 5809519 CAETZBDNCHXMNP-UHFFFAOYSA-N 324.288 2.035 10 40 DECB CCOC(=O)c1ccc(/N=N/N2CCC[C@H]2C(=O)NC)cc1 1409768 XWEHTDDTNBUTHF-BZSIDJSBSA-N 304.350 2.072 10 40 DECB COc1cccc(CNC(=O)NCCN2CCCC[C@H]2C)c1O 71794526 NDEIXTCIMOHIFV-CYBMUJFWSA-N 321.421 2.074 10 40 DECB O=C(Cc1cccc(F)c1F)NCCc1ccc(O)c(O)c1 96485768 XJZMMJWQKPXGLW-UHFFFAOYSA-N 307.296 2.277 10 40 DECB NC(=O)[C@H]1CCCN(c2ccc(CNc3ccccn3)cc2)C1 54124337 PAZLPHUODMDJBC-HNNXBMFYSA-N 310.401 2.395 10 40 DECB O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(O)cc2O)N1 3019201 ARALPLKQENYHNR-HOCLYGCPSA-N 324.336 2.267 10 40 DECB NC=C1C(=O)N(c2ccccc2)C(=O)N(c2ccccc2)C1=O 5104482 XPYMAWRYKVSVRC-UHFFFAOYSA-N 307.309 2.029 10 40 DECB CC(=O)Nc1ccc(N/C=C2\SC(=S)N(C)C2=O)cc1 618255317 WXTRPRGQRVRYHN-XFFZJAGNSA-N 307.400 2.388 10 40 DECB C[C@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(O)c(O)c1 1768060 IBCZJCQDLOHBPI-DIFFPNOSSA-N 303.358 2.058 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1ccc(-c2cccc(F)c2)o1 573103 ZCSJLKFMQKRMDB-UHFFFAOYSA-N 316.313 2.000 10 40 DECB COc1cccc(CNC(=O)NCCN2CCCC[C@@H]2C)c1O 71794527 NDEIXTCIMOHIFV-ZDUSSCGKSA-N 321.421 2.074 10 40 DECB COc1ccc(NC2(NC(C)=O)C(=O)c3ccccc3C2=O)cc1 226297898 AAAHGELPLCUGTH-UHFFFAOYSA-N 324.336 2.019 10 40 DECB O=C1NC(=O)C(=Cc2cccc(Oc3ccccc3)c2)C(=O)N1 3141903 BLUCZIJQFGJEEA-UHFFFAOYSA-N 308.293 2.228 10 40 DECB CN(C)c1ccc(CNC(=O)NCc2ccccn2)cc1F 58482951 CMHGDOLKPPLKAZ-UHFFFAOYSA-N 302.353 2.286 10 40 DECB Cc1ccc(-c2ccc(C=C3C(=O)NC(=O)NC3=O)o2)cc1C 59639459 BKBSDPFVUBHQKY-UHFFFAOYSA-N 310.309 2.313 10 40 DECB C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cl)cn1C 97377736 ANOJFXIZUHLTEU-VIFPVBQESA-N 308.765 2.451 10 40 DECB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1ccc(OC)c(OC)c1 100276325 ALCOYQNNKBCMLU-WQLSENKSSA-N 317.341 2.006 10 40 DECB Cc1ccc(Cl)cc1NC(=O)C[C@@H]1SC(=S)NC1=O 34926785 PIKMXCRJIWYGJW-VIFPVBQESA-N 314.819 2.494 10 40 DECB COc1cccc(/C=C2\C(=O)NN(c3ccc(C)cc3)C2=O)c1O 312716 BPNUQQSCDCBEAN-GXDHUFHOSA-N 324.336 2.171 10 40 DECB C[C@H](Cn1ccnc1)NC(=O)/C=C/c1ccc2c(c1)CCCN2C 58367682 UJUUDEHZNCTEEP-PMGBHYCQSA-N 324.428 2.484 10 40 DECB c1nc2n(n1)C[C@H](NCc1ccc(N3CCCCC3)cc1)CC2 69600132 FVUFOBSQYGAACV-MRXNPFEDSA-N 311.433 2.373 10 40 DECB Cc1c(C)c2ccc(O)c(CN[C@@H](C(=O)O)C(C)C)c2oc1=O 35686304 DPEKULHZYAKZKB-CQSZACIVSA-N 319.357 2.314 10 40 DECB CC(=O)Nc1nc(C(=O)NCc2ccc(N(C)C)cc2)cs1 32712290 RJNIRQRKGJSEAC-UHFFFAOYSA-N 318.402 2.098 10 40 DECB CCCCCCOc1ccccc1C=C1C(=O)NC(=O)NC1=O 408888054 WDQQIMHDFIIVGH-UHFFFAOYSA-N 316.357 2.395 10 40 DECB O=C(O)c1cc2c(cc1C(=O)O)C(=O)C(c1ccccc1)C2=O 104052355 YUDCPEDIAAYURE-UHFFFAOYSA-N 310.261 2.246 10 40 DECB CC1(C)[C@H]2CC[C@]1(C(=O)N1CCc3ccccc3C1)C(=O)C2=O 100261944 UIEXPJLYCJLADP-IFXJQAMLSA-N 311.381 2.146 10 40 DECB CCN1C(=O)NC(=O)/C(=C\c2ccc(N(CC)CC)cc2)C1=O 5947729 PCGOTLAIXVTCIV-SDNWHVSQSA-N 315.373 2.015 10 40 DECB COc1cccc(/C=C2\SC(N3CCCC3)=NC2=O)c1O 12436480 QLBICPOXFRLJFG-XFXZXTDPSA-N 304.371 2.467 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1ccc(-c2ccc(F)cc2)o1 9334735 XIMAWNGTXNERJS-UHFFFAOYSA-N 316.313 2.000 10 40 DECB CN(C)C(=O)[C@@H]1CC[C@H](N=[N+]=[N-])[C@H](NC(=O)OC(C)(C)C)C1 207674116 LVJZCKRMMBTVNC-OUAUKWLOSA-N 311.386 2.447 10 40 DECB COc1ccc(N2CCN(c3ccnc(Cl)n3)CC2)cc1 40478905 OXPCBNPMCKBRJL-UHFFFAOYSA-N 304.781 2.465 10 40 DECB COc1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1OC 1021011 GUAUWURXSVMHCW-GXDHUFHOSA-N 324.336 2.165 10 40 DECB COc1ccc(N(C)CC(=O)Nc2nccs2)cc1OC 58158480 DWBMBYDKESDCMK-UHFFFAOYSA-N 307.375 2.235 10 40 DECB CCc1cnccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 97377739 ZNNGBEGIJURURD-LLVKDONJSA-N 300.358 2.416 10 40 DECB CCn1cccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 408931681 OVOMGSYNOXEZTD-RVDMUPIBSA-N 323.352 2.483 10 40 DECB COc1ccc(N2CCN(C(=O)c3cccc(N)c3)CC2)cc1 193080116 DYOLQNMWSTWDID-UHFFFAOYSA-N 311.385 2.240 10 40 DECB OC1CCC(NCc2ccc(N3CCOCC3)c(F)c2)CC1 66969762 LWPUIHYLNBYFED-UHFFFAOYSA-N 308.397 2.055 10 40 DECB C[C@H](Cn1cccn1)NCc1ccc(N2CCOCC2)c(F)c1 69372218 ADWKQBLANOPAPR-CQSZACIVSA-N 318.396 2.037 10 40 DECB COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(O)c(O)c2)c1 1577494 MWQFECMIRHKTMK-KZULUSFZSA-N 317.385 2.361 10 40 DECB C[C@@H](N/C=C1/C(=O)NC(=O)N(C(C)(C)C)C1=O)c1ccccc1 1881162 LLHBQQYQBGAJLK-COVOJHCQSA-N 315.373 2.098 10 40 DECB CNc1ccc(N2CCOCC2)c2c1C(=O)c1ccccc1C2=O 4094881 OKLCLQOCBGGDQL-UHFFFAOYSA-N 322.364 2.340 10 40 DECB N[C@H](C(=O)O)c1cc(Br)cc(Br)c1O 72197169 REEZKJGKRLPPPA-LURJTMIESA-N 324.956 2.002 10 40 DECB CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C\c1cccs1 13388898 NTIXBGDKWDEMOT-RAXLEYEMSA-N 321.398 2.457 10 40 DECB CN1C(=O)C(=Cc2ccc(C(F)(F)F)cc2)C(=O)N(C)C1=O 3243023 FHBOSCDFSNZXHW-UHFFFAOYSA-N 312.247 2.139 10 40 DECB O=C(NC1=NN(c2ccccc2)C(=O)C1)c1cccc([N+](=O)[O-])c1 344705 NNGHWPIQPQHOKQ-UHFFFAOYSA-N 324.296 2.075 10 40 DECB COc1cc2c(cc1OC)[C@@H](c1ccc(O)c(O)c1)CNC2 24717645 RQKOOXXZCUXSQS-CYBMUJFWSA-N 301.342 2.350 10 40 DECB COc1ccccc1/C=C1/SC(=S)N(CCC(=O)O)C1=O 1449241 JFEIZQQPGKDPTD-DHZHZOJOSA-N 323.395 2.371 10 40 DECB CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2437063 XTGUPMZDWXYAEP-CBFJXKFUSA-N 310.400 2.090 10 40 DECB C[C@@H](Cn1ccnc1)NC(=O)/C=C/c1ccc2c(c1)CCCN2C 58367681 UJUUDEHZNCTEEP-VFADXPBXSA-N 324.428 2.484 10 40 DECB Cc1nc(O)c2c(n1)CN(Cc1ccc3c(c1)CCCN3C)CC2 19576611 ZPKIXWAKMVBWCB-UHFFFAOYSA-N 324.428 2.431 10 40 DECB CC(C)=C1SC(=S)N(CC(=O)Nc2ccc(O)cc2)C1=O 10386589 RYRJPDGLYMWCSF-UHFFFAOYSA-N 322.411 2.485 10 40 DECB COc1ccc(N2CCN(C(=O)c3ccccc3N)CC2)cc1 386719 XRRJWBZNFFRWBK-UHFFFAOYSA-N 311.385 2.240 10 40 DECB CCCn1nnnc1CN(Cc1ccc(N(C)C)cc1)C1CC1 71811041 OVGPFFSZADCFPM-UHFFFAOYSA-N 314.437 2.314 10 40 DECB Cc1ccc(C(=O)N2CCC(c3cnn(C)c3)CC2)c(O)c1O 97059348 JRBCVAFTAXCKGY-UHFFFAOYSA-N 315.373 2.160 10 40 DECB COc1ccc2cc3[n+](cc2c1O)CCc1cc(O)c(O)cc1-3 685936001 AWADIQNNYPZANL-UHFFFAOYSA-O 310.329 2.476 10 40 DECB CC(C)c1ccc(NC=C2C(=O)N(C)C(=S)N(C)C2=O)cc1 5836371 FVKNKWAISPHEDQ-UHFFFAOYSA-N 317.414 2.321 10 40 DECB O[C@@H](CN1CCCc2cc(OC(F)F)ccc21)Cn1cccn1 95381622 KKPDFEJQBYXXDS-ZDUSSCGKSA-N 323.343 2.298 10 40 DECB COc1ccc(N2CCC(N(C)C(=O)[C@H]3CCCO3)CC2)cc1 65608956 SMOTXEWCYUIFFO-QGZVFWFLSA-N 318.417 2.301 10 40 DECB CCN(CC)C(=O)c1cccc(/N=N/c2c(N)n[nH]c2N)c1 55104230 XWOGCIVZMMOWSW-ISLYRVAYSA-N 301.354 2.472 10 40 DECB COc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)ccc1C 9310528 UZVFCPNUMMZQJS-IZZDOVSWSA-N 323.395 2.289 10 40 DECB CCOc1ccccc1/C=C1/SC(=S)N(CC(=O)O)C1=O 967111 CPKVKZNOKHWUPD-YRNVUSSQSA-N 323.395 2.371 10 40 DECB O=C1NC(=S)N=C(O)/C1=C/c1ccc(Cl)c([N+](=O)[O-])c1 1580993 OXSPNEMHGWXEAV-UHFFFAOYSA-N 311.706 2.003 10 40 DECB COc1ccc(N(CCC(N)=O)C[C@H](O)c2ccccc2)cc1 8705056 SLJRMAQWPQAOLP-KRWDZBQOSA-N 314.385 2.111 10 40 DECB Cc1cccc(/C=C2\SC(N3CCN(C)CC3)=NC2=O)c1 6867173 JSIDIHHVPDGIMP-KAMYIIQDSA-N 301.415 2.213 10 40 DECB CNC[C@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 97162627 XMXTUUKHHMRBEY-MRXNPFEDSA-N 321.440 2.094 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3O)C2=O)cc1 4704559 VMUVOOZHUQBADT-GXDHUFHOSA-N 322.320 2.367 10 40 DECB CC(C)CC(=O)NN1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5552779 YJMMYMKAGDVQCH-YFHOEESVSA-N 309.416 2.293 10 40 DECB COc1ccc(N2CCN([C@@H](CN)c3ccco3)CC2)cc1 19795781 KVLBJBLIMUFLET-INIZCTEOSA-N 301.390 2.110 10 40 DECB Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 48289890 CYTDBEBTBUWUTE-UHFFFAOYSA-N 315.373 2.092 10 40 DECB CN1C(=O)N/C(=C/c2ccc(N3CCCCC3)cc2F)C1=O 409194110 OAQNEBKEZIKOCB-NTEUORMPSA-N 303.337 2.339 10 40 DECB Cn1cc([C@@H]2OCC[C@H]2CNCc2ccc3c(c2)CCO3)cn1 89755310 WBAQSRNLYPCBRO-MAUKXSAKSA-N 313.401 2.222 10 40 DECB COc1ccc(S(=O)(=O)Nc2ccc(F)cc2)c2nonc12 32579209 MSDDUJPQZHXGSI-UHFFFAOYSA-N 323.305 2.171 10 40 DECB CCCOc1ccc2ccccc2c1C=C1C(=O)NC(=O)NC1=O 408800248 LCGAOXGVOZSESQ-UHFFFAOYSA-N 324.336 2.378 10 40 DECB Cc1cc(NC(=O)NCCCSc2nccs2)n(C)n1 84101906 SCFGBTCHYCTJGT-UHFFFAOYSA-N 311.436 2.489 10 40 DECB COC(=O)c1cc(NS(=O)(=O)c2ccccc2C)ccc1O 365550 VZUAQFHKGFGVDF-UHFFFAOYSA-N 321.354 2.288 10 40 DECB CCCN/C=C1\C(=O)NC(=O)N(c2cccc3ccccc23)C1=O 408526211 BAKSYYJINDMJNS-SDNWHVSQSA-N 323.352 2.306 10 40 DECB CC(=O)O[C@@]12C=C[C@](OC(C)=O)(CCc3ccc(o3)CC1)O2 6761528 GXKCEGADIFAOCH-HOTGVXAUSA-N 306.314 2.264 10 40 DECB O=C(O)CCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 4155249 WTUGSUBIJLXAFU-UHFFFAOYSA-N 323.304 2.265 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 5967730 XTGUPMZDWXYAEP-YIXGCBLDSA-N 310.400 2.090 10 40 DECB [O]C1=C(O)[C@@H](c2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O)c21 1560403809 JAIRBQSLXRZPMS-OAHLLOKOSA-N 319.245 2.005 10 40 DECB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\N1CCN(C)CC1 13372526 WOJACCQMFCJQGY-PTNGSMBKSA-N 318.808 2.194 10 40 DECB C[C@@H]1CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)[C@H]1O 15219149 WWVNIBVFNYKUQY-RBHXEPJQSA-N 322.316 2.424 10 40 DECB biogenic O=C(Cc1ccc2c(c1)OCCCO2)c1ccc(O)c(O)c1O 241872 VIMZUXAZRCQPHN-UHFFFAOYSA-N 316.309 2.390 10 40 DECB biogenic CCN1C(=O)N/C(=C/c2cc(C)n(-c3ccncc3)c2C)C1=O 4516923 LLLNKTBEFVCDFM-XNTDXEJSSA-N 310.357 2.402 10 40 DECB Nc1ccc(CN(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)cc1 575419971 BVSUMLOQLZKVHW-OAHLLOKOSA-N 320.414 2.051 10 40 DECB CC[C@H](NC[C@H]1CC[C@H](C(=O)N(C)C)O1)c1ccccc1O 157030056 YRHARCRSXURZOW-IVMMDQJWSA-N 306.406 2.069 10 40 DECB CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2)C(N)=O)cc1 17023004 LQTPQUHUPWEKPE-VBKFSLOCSA-N 309.369 2.009 10 40 DECB CN(C)C(=O)[C@@H]1CC[C@@H](N=[N+]=[N-])[C@@H](NC(=O)OC(C)(C)C)C1 169449499 LVJZCKRMMBTVNC-MXWKQRLJSA-N 311.386 2.447 10 40 DECB CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCCC2)cc1 408718408 MMAUQRZYGZNWJC-UHFFFAOYSA-N 317.433 2.162 10 40 DECB CCOC1=NN(c2ccccc2)C(=O)/C1=C\NCc1ccncc1 100250002 HGQGRVWIHJVCJC-SSZFMOIBSA-N 322.368 2.452 10 40 DECB CC[C@H](NC[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1ccccc1O 248588722 YRHARCRSXURZOW-INWMFGNUSA-N 306.406 2.069 10 40 DECB c1cc2c(cc1CN1COc3cc4c(cc3C1)OCO4)OCO2 54982270 AQMTUFLHVLIFAS-UHFFFAOYSA-N 313.309 2.496 10 40 DECB CCN1CCN(c2ccc(CNC(=O)NC(C)C)cc2F)CC1 65590114 JJSBZFIGBHEECA-UHFFFAOYSA-N 322.428 2.175 10 40 DECB Nc1ccc(-[n+]2ccccc2)c2c1C(=O)c1ccccc1C2=O 4728974 BRKNAQUKBKAXKT-UHFFFAOYSA-O 301.325 2.321 10 40 DECB Cc1ccnc(NC=C2C(=O)OC3(CCCCC3)OC2=O)c1 101268513 NPGCZSVHVMOZLF-UHFFFAOYSA-N 302.330 2.446 10 40 DECB Cc1ccc2c(c1S(=O)(=O)O)C(=O)c1ccccc1C2=O 3845300 ODDGHYYRPVOYEK-UHFFFAOYSA-N 302.307 2.017 10 40 DECB biogenic Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1[N+](=O)[O-] 5342776 VHXNJKCCJUHBCW-UHFFFAOYSA-N 308.315 2.410 10 40 DECB CS(=O)(=O)N1N=C(c2ccccc2O)C[C@@H]1c1ccco1 19815972 JQZZGAJZFHFZMR-GFCCVEGCSA-N 306.343 2.096 10 40 DECB O=C1NC(=S)N=C(O)/C1=C/c1ccc(Br)s1 17029253 FOPCKFPCCBEILD-UHFFFAOYSA-N 317.189 2.265 10 40 DECB Nc1ccc(CN(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)cc1 575419970 BVSUMLOQLZKVHW-HNNXBMFYSA-N 320.414 2.051 10 40 DECB CC1=CC2=NC(=O)/C(=C/c3ccc(Br)o3)C(=N)N2O1 13540515 AXBARBTZUKCRHB-WGEBMYLSSA-N 322.118 2.492 10 40 DECB CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)C)cc1 408718267 GYLFMCALEKPQOJ-UHFFFAOYSA-N 319.449 2.311 10 40 DECB CC(C)(C)NC(=S)N1CCN(c2ccc3c(c2)OCO3)CC1 408586373 OECZTCBNGDTBTM-UHFFFAOYSA-N 321.446 2.210 10 40 DECB Cc1n[nH]cc1CN[C@H](C)c1ccc(N2CCOCC2)cc1 65463743 BFRBWTPHYFTEQA-CYBMUJFWSA-N 300.406 2.406 10 40 DECB Cc1nc2n(n1)[C@H](c1c(O)ccc3ccccc13)C=C(C(=O)O)N2 102278430 VVZXQXCKAVYSQK-ZDUSSCGKSA-N 322.324 2.429 10 40 DECB Cc1cc(C)c(O)c(CN2CCC[C@H]2CN2CCOCC2)c1 95974172 MCJHFAFTCAKULH-KRWDZBQOSA-N 304.434 2.306 10 40 DECB O=C1NC(=O)C(=Cc2ccc(Cc3cccc(F)c3)cc2)C(=O)N1 408873198 OIRFZZDEPXTGDL-UHFFFAOYSA-N 324.311 2.166 10 40 DECB CCOc1cc(/C=C2\C(=N)N3N=CSC3=NC2=O)ccc1O 4592707 SYVBFRUOBYCSOO-JBOWNUKZSA-N 316.342 2.040 10 40 DECB CCOc1cccc([C@H]2NC(N)=Nc3nc4ccccc4n32)c1O 7125605 YWUGJACHBRMFKG-HNNXBMFYSA-N 323.356 2.237 10 40 DECB CC(C)CCN1C(=O)/C(=C\N2CCOCC2)SC1=S 9420630 OIYHSVQHMVUDBJ-PKNBQFBNSA-N 300.449 2.066 10 40 DECB C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(O)c(O)c1 1768063 IBCZJCQDLOHBPI-APPDUMDISA-N 303.358 2.058 10 40 DECB CCN(CC)c1ccc(CNCCCN2CCOCC2)cc1 6869673 ZAYUVQAWMUFAKO-UHFFFAOYSA-N 305.466 2.345 10 40 DECB CCOc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1 12504543 FDOAJULQLDZKDQ-XFFZJAGNSA-N 323.395 2.371 10 40 DECB COC(=O)c1cccc(NC(=S)NCc2ccccn2)c1 225329913 ASYFVXNYJDCNDT-UHFFFAOYSA-N 301.371 2.355 10 40 DECB COC(=O)c1ccc(C(=O)OC)c(-n2c(C)cc(C=O)c2C)c1 9264027 FYEHNVSPVPKOQF-UHFFFAOYSA-N 315.325 2.480 10 40 DECB CCCCNC(=S)N1CCN(c2ccc(OC)cc2)CC1 4216814 INPKKRXAULOHHI-UHFFFAOYSA-N 307.463 2.492 10 40 DECB Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cccn3C)C2=O)c1 4592216 OGPIYXSDUSLRPV-XNTDXEJSSA-N 323.352 2.308 10 40 DECB COC(=O)CN1C(=O)/C(=C\c2sccc2C)SC1=S 1238556 PUFOOHMCUGQYKW-WEVVVXLNSA-N 313.425 2.431 10 40 DECB CCCCCOc1ccc(C=C2C(=O)NC(=S)NC2=O)cc1 408737377 NFEZEWVWAUOREH-UHFFFAOYSA-N 318.398 2.170 10 40 DECB COCC1=NNC(=O)/C1=C/Nc1cc(Cl)cc(Cl)c1 95921750 RXMMHDHTEPBBGK-BJMVGYQFSA-N 300.145 2.421 10 40 DECB C[C@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccccc1O 69599624 WVYHTPIUPMDZPK-ZDUSSCGKSA-N 318.417 2.484 10 40 DECB CCN(C)c1ccc(CNC(=O)CCn2cc(C)cn2)cc1F 78912082 SXQSZRZABBXMRP-UHFFFAOYSA-N 318.396 2.493 10 40 DECB CN1N=C(C(F)(F)F)/C(=C/Nc2ccc([N+](=O)[O-])cc2)C1=O 100271383 SHKUTDMBLUQFLD-TWGQIWQCSA-N 314.223 2.281 10 40 DECB CC(C)c1ccc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1 59139215 CQBPNSOMQCJLCF-UHFFFAOYSA-N 302.399 2.409 10 40 DECB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(N(C)CC)cc1 182773 WNWBRPAUERVSQI-OAHLLOKOSA-N 317.389 2.334 10 40 DECB CN1/C(=C\C=C2/C(=O)NC(=O)N=C2O)Sc2ccccc21 33662044 OGGLNMQWLOMUTJ-YRNVUSSQSA-N 301.327 2.203 10 40 DECB CN1C(=O)/C(=C/c2ccc(N3CCOCC3)cc2)SC1=S 193405423 SVLZKNWRRVMEAX-RAXLEYEMSA-N 320.439 2.354 10 40 DECB Cc1ccc(C(=O)N2CCC(n3cccn3)CC2)c(O)c1O 97059134 DICTUCDYUHNFNU-UHFFFAOYSA-N 301.346 2.080 10 40 DECB CCN1C(=O)C(=C/C=C/c2ccco2)C(=O)N(CC)C1=S 481062 ZNPAAXBUUDAILM-FNORWQNLSA-N 304.371 2.215 10 40 DECB CCN1C(=O)C(=CNc2ccc(C)cc2)C(=O)N(CC)C1=S 8484639 CIMKYSQKJPILNO-UHFFFAOYSA-N 317.414 2.286 10 40 DECB CC(=O)N1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)SC1=S 408719773 RIUCDFCRXKMXJU-UXBLZVDNSA-N 308.340 2.343 10 40 DECB Cc1ccc(Cl)cc1NC(=O)C[C@H]1SC(=S)NC1=O 34926784 PIKMXCRJIWYGJW-SECBINFHSA-N 314.819 2.494 10 40 DECB COc1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1C 33700474 QPXZENIUTUBWOT-RVDMUPIBSA-N 308.337 2.465 10 40 DECB C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 4813892 NOXFPQYJWMPYFL-VSUWBIFXSA-N 309.368 2.067 10 40 DECB CO/C=C1\SC(=S)N(c2ccc(NC(C)=O)cc2)C1=O 5663562 SAKPORDJRLFASA-XFFZJAGNSA-N 308.384 2.498 10 40 DECB Cc1c(C(=O)O)cccc1-c1ccc(/C=C2/NC(=O)NC2=O)o1 27910515 DVTHIIQZOVTJDC-KPKJPENVSA-N 312.281 2.134 10 40 DECB O=CN1N=C(c2ccc(O)cc2)C[C@H]1c1ccc2c(c1)OCO2 66091594 PJURZYLLEKARDD-HNNXBMFYSA-N 310.309 2.428 10 40 DECB OC1(CNCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 66991689 DAWWEOFAXSCBEF-UHFFFAOYSA-N 322.424 2.447 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1 437126 NBOYFLJLFHYRSJ-GXDHUFHOSA-N 309.281 2.056 10 40 DECB COc1ccc(N2CCN(C(=O)c3csc(C)n3)CC2)cc1 62634828 UEUIRJQQEGKVSK-UHFFFAOYSA-N 317.414 2.423 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C\c3ccc(C)o3)S2)CC1 19848449 AYAXXJNQSVDCMI-JLHYYAGUSA-N 305.403 2.196 10 40 DECB [N-]=[N+]=CC(=O)[C@H](Cc1ccccc1)NC(=S)Nc1ccccc1 100702722 WJFGAQHVPVUPEW-HNNXBMFYSA-N 324.409 2.454 10 40 DECB COc1cccc([C@H]2NCCc3cc(O)c(O)cc32)c1OC 3703467 GWNMBOJDROASRW-MRXNPFEDSA-N 301.342 2.350 10 40 DECB COc1ccc2ccc(O)c(CN3CCC(C(N)=O)CC3)c2c1 23381983 GIGGXJMCDSXYOR-UHFFFAOYSA-N 314.385 2.251 10 40 DECB CCn1cccc1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O 408932459 CEFHQMXHWKORGU-SDNWHVSQSA-N 309.325 2.174 10 40 DECB O=C(NCCc1ccc(O)c(O)c1)c1noc2c1CCCCC2 156390731 APLMNKOQQQVQMD-UHFFFAOYSA-N 316.357 2.327 10 40 DECB CCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccn2C)SC1=S 4482974 AOEJRFGNFVCDHD-NGPGYTDTSA-N 324.427 2.480 10 40 DECB CCC[C@H](NCc1c(O)ccc2c(C)cc(=O)oc12)C(=O)O 4540323 WHUNYSQHNABNEU-LBPRGKRZSA-N 305.330 2.150 10 40 DECB CC(=O)NN1C(=O)/C(=C\C=C\c2ccccc2)SC1=S 17729025 PMRIEMUVJGBERB-LRELXJSQSA-N 304.396 2.495 10 40 DECB O=S(=O)(Nc1ccc(F)cc1F)c1cccc2nonc12 14254700 MBBJVWFGBMCFDX-UHFFFAOYSA-N 311.269 2.302 10 40 DECB O=C1NC(=O)C(=CNc2ccc(Nc3ccccc3)cc2)C(=O)N1 6923356 IJXRSDUOZQPDBC-UHFFFAOYSA-N 322.324 2.092 10 40 DECB O=C1/C(=C\c2ccc(F)cc2F)SC(=S)N1CCO 80344944 OIGSNLKBBGOLTR-BJMVGYQFSA-N 301.339 2.158 10 40 DECB O=C1/C(=C/c2cccnc2)SC(=S)N1C[C@H]1CCCO1 12625395 TUOBXANTKCVYMU-HBZGRHIISA-N 306.412 2.462 10 40 DECB CCOc1ccc(O)c([C@@H]2NC(N)=Nc3nc4ccccc4n32)c1 9609914 PGIFCNWTSQQGKA-OAHLLOKOSA-N 323.356 2.237 10 40 DECB O=C(c1ccccc1NCc1ccccc1O)N1CCOCC1 349804 OWWXZGYSJYYIAC-UHFFFAOYSA-N 312.369 2.477 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C/NNc2ccccc2)C(O)=NC1=S 17207135 QPQYPPBJTAAHTE-QSARLWQPSA-N 318.402 2.369 10 40 DECB COc1cc(CN2CCN(C(C)=O)CC2)c(O)c(C(C)(C)C)c1 25703570 RWMHMICLNTXJPW-UHFFFAOYSA-N 320.433 2.362 10 40 DECB C/C(NCCO)=C1/C(=O)N(c2ccccc2)N=C1c1ccccc1 4999675 UIZMGJOIYDJEFK-VKAVYKQESA-N 321.380 2.293 10 40 DECB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\N[C@H](C)C(=O)O 19201730 FHIBZFFQXHUEPQ-JBBGTMGVSA-N 307.737 2.009 10 40 DECB CCNC(=O)[C@H](C)NC(=O)c1ccc(-n2c(C)ccc2C)cc1 24956941 XJOQGTCUYUJJPM-AWEZNQCLSA-N 313.401 2.349 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccn2)SC1=S 2447600 BWPIWQOPSCJTLZ-SBMLRHLQSA-N 308.384 2.146 10 40 DECB C[C@@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccccc1O 69599629 WVYHTPIUPMDZPK-CYBMUJFWSA-N 318.417 2.484 10 40 DECB NC(=O)[C@@H]1CCCN(c2ccc(CNCc3cccnc3)cc2)C1 54179196 MTMBPNQFEVKYJI-QGZVFWFLSA-N 324.428 2.073 10 40 DECB O=C(C[C@H]1SC(=S)NC1=O)Nc1ccc(F)c(Cl)c1 34926778 MSCURPURCLNKMR-MRVPVSSYSA-N 318.782 2.324 10 40 DECB CN(C)c1ccc(CNC(=O)CCNC(=O)C(C)(C)C)cc1F 79320622 UMBIAHXSVLEHDQ-UHFFFAOYSA-N 323.412 2.060 10 40 DECB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccccc1 408850608 PIUCAECRYSQGDS-GXDHUFHOSA-N 310.284 2.492 10 40 DECB CCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5374591 CPIHATWVNJETDT-CBFJXKFUSA-N 310.400 2.469 10 40 DECB CCCn1cc(/C=C2\C(=O)N=C(O)N(C)C2=O)c2ccccc21 1271952 AKMLIQOIZFAZQX-UKTHLTGXSA-N 311.341 2.347 10 40 DECB C[C@H]1CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)[C@H]1O 15219154 WWVNIBVFNYKUQY-QPFGOUBPSA-N 322.316 2.424 10 40 DECB biogenic CN(Cc1ccc(N(C)C)cc1)CN1C(=O)c2ccccc2C1=O 22366572 DUGQSSWGFGHRDT-UHFFFAOYSA-N 323.396 2.438 10 40 DECB CN1C(=O)C(=Cc2c(F)cccc2Cl)C(=O)N(C)C1=S 59139326 CZRATZAZPAFIEM-UHFFFAOYSA-N 312.753 2.078 10 40 DECB CCN1C(=O)/C(=C/c2cc(C)n(C3CC3)c2C)C(=O)NC1=S 555541 VZNMMPBFRBGRTJ-MDWZMJQESA-N 317.414 2.086 10 40 DECB O=C(O)CCc1c2ccc(=O)c(O)c-2oc2c(O)c(O)ccc12 3954336 OCMFSQMNSIPSJS-UHFFFAOYSA-N 316.265 2.032 10 40 DECB aggregator,in-vitro COC(=O)CN1C(=O)/C(=C/c2cccc(F)c2)SC1=S 1238472 IOBCGILPFWTPKF-POHAHGRESA-N 311.359 2.200 10 40 DECB CCN1C(=O)C(=Cc2ccccc2F)C(=O)N(CC)C1=S 6757838 PHSGPHWFXHDIMS-UHFFFAOYSA-N 306.362 2.205 10 40 DECB CC[C@H](N[C@H](CC)C(=O)N1CCOCC1)c1ccccc1O 156281656 PAMWLEVGISPLRR-LSDHHAIUSA-N 306.406 2.070 10 40 DECB COc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(C)c1 34702717 YPMXBQJIOVAZSM-WJDWOHSUSA-N 308.337 2.465 10 40 DECB O=C1/C(=C/c2cccc(F)c2)SC(=S)N1N1CCOCC1 13814782 MLQMKIJFYDHASV-XFXZXTDPSA-N 324.402 2.274 10 40 DECB CN(C)c1ccc2nc3c(nc2c1)C(=O)c1ccccc1C3=O 352343 JLVBJRSXUWWYHG-UHFFFAOYSA-N 303.321 2.471 10 40 DECB biogenic CC1=C2[C@H](CCS2(=O)=O)[C@@H]2C(=O)c3ccccc3C(=O)[C@H]2C1 504629730 UVXXXOSBZCSZQB-RDBSUJKOSA-N 316.378 2.410 10 40 DECB biogenic CCc1nnc(NC=C2C(=O)OC3(CCCCC3)OC2=O)s1 23127174 PUKBLISFTOQOPM-UHFFFAOYSA-N 323.374 2.157 10 40 DECB CN1C(=O)/C(=C/c2cc3c(cc2[N+](=O)[O-])OCO3)SC1=S 974909 GGVKJFWPSARSFS-KMKOMSMNSA-N 324.339 2.155 10 40 DECB CCCCCCN1C(=O)N=C(O)/C(=C/NN2CCCCC2)C1=O 6782978 NHURXBNYOXGHSZ-SEYXRHQNSA-N 322.409 2.360 10 40 DECB Oc1ccc2ccncc2c1CN1CCC2(CC1)OCCO2 26611233 NCLHLYDPQSAXPJ-UHFFFAOYSA-N 300.358 2.279 10 40 DECB COCCCN1C(=O)/C(=C\c2ccccc2)C(C(=O)OC)=C1C 408976747 RYJLLPYRIDROIT-QINSGFPZSA-N 315.369 2.396 10 40 DECB CC(C)NC(=O)C1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 69586220 HXCJANWLMVWZQL-UHFFFAOYSA-N 321.377 2.037 10 40 DECB O=c1oc2c(CN3CCOCC3)c(O)ccc2c2c1CCCC2 19789532 PCZHTJNPPCHGQF-UHFFFAOYSA-N 315.369 2.210 10 40 DECB aggregator O=c1oc2c(CNC[C@@H]3CCCO3)c(O)ccc2c2c1CCC2 6661393 SPZPQOHURIETNL-NSHDSACASA-N 315.369 2.256 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3C)C2=O)cc1C 409095025 AVWGFOSISUMLKX-XNTDXEJSSA-N 323.352 2.308 10 40 DECB COc1ccc2nc(/N=N/c3c(N)nc(N)nc3O)sc2c1 18059242 XGIOVDHEOFGYLS-VHEBQXMUSA-N 317.334 2.380 10 40 DECB CCN(CC)c1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1 102243578 RQEFXSQIDZCFBF-CQSZACIVSA-N 313.361 2.108 10 40 DECB COC(=O)CN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1205279 XHCFTTPOODTGGE-POHAHGRESA-N 311.359 2.200 10 40 DECB COc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1OC 4501885 JPZRVBRDRPGYIW-UHFFFAOYSA-N 318.325 2.458 10 40 DECB CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCCOC 521395816 XVFUFIITIPSZLO-UHFFFAOYSA-N 323.389 2.101 10 40 DECB O=C1NC(=O)C(=Cc2ccc(Oc3ccccc3)cc2)C(=O)N1 5604124 YNPOPDBTLJFFRF-UHFFFAOYSA-N 308.293 2.228 10 40 DECB CCOc1cc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)ccc1O 41078435 NRFZDAMXPWXQTI-QRBAAVRYSA-N 313.313 2.241 10 40 DECB COc1cccc(/C=C2\C(=O)NN(c3ccc(F)cc3)C2=O)c1 176889 BMXPJZMXJXORAZ-XNTDXEJSSA-N 312.300 2.296 10 40 DECB CCOc1ccc(/N=N/c2c(=O)[nH]n3c(=O)cc(C)[nH]c23)cc1 102506967 WLZJRJPXYRHPRM-ISLYRVAYSA-N 313.317 2.438 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)o1 33385767 PWEZDEWIFUSBBL-UKTHLTGXSA-N 302.330 2.383 10 40 DECB C[N+]1(C)CCc2cc(O)c(O)cc2[C@@H]1Cc1ccc(O)c(O)c1 1711020 GVPVDOISXSALCI-AWEZNQCLSA-O 316.377 2.425 10 40 DECB in-vitro O=C(NN1C(=O)CSC1=S)c1cccc2ccccc12 1465645 SPDNKWNEGGASQR-UHFFFAOYSA-N 302.380 2.345 10 40 DECB CCN(CC)c1ccc(N/C=C2\C(=O)N(C)C(=O)N=C2O)cc1 102690758 ZQCAYJAQHNJJMU-RAXLEYEMSA-N 316.361 2.377 10 40 DECB CN1CCCc2cc(CNC(=O)CCc3cnn(C)c3)ccc21 58770314 QTYYVDGJLIEYCV-UHFFFAOYSA-N 312.417 2.052 10 40 DECB CCN1C(=O)/C(=C/c2ccc(Cl)s2)C(=O)NC1=S 409393699 ZCNJDKQJHZCWOJ-FNORWQNLSA-N 300.792 2.048 10 40 DECB CCc1cnccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 97377738 ZNNGBEGIJURURD-NSHDSACASA-N 300.358 2.416 10 40 DECB O=C1/C(=C\c2cccnc2)SC(=S)N1C[C@H]1CCCO1 33429600 TUOBXANTKCVYMU-LAPSENCUSA-N 306.412 2.462 10 40 DECB O=C(NCCc1ccc(O)c(O)c1)c1c(F)ccc(F)c1F 184959752 WTHAATIAMIEJFC-UHFFFAOYSA-N 311.259 2.488 10 40 DECB COc1ccc(N2CCOCC2)c(NC(=O)C(F)(F)F)c1 7496649 YLPZKTCEHYCLCH-UHFFFAOYSA-N 304.268 2.033 10 40 DECB [N-]=[N+]=CC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21 96330817 DLDGJOVHMQKZMI-UHFFFAOYSA-N 321.336 2.395 10 40 DECB CCOC(=O)c1cc(NS(=O)(=O)c2ccccc2)ccc1O 365527 SVKRYDPEFIPNRA-UHFFFAOYSA-N 321.354 2.370 10 40 DECB Cc1cccc(-n2c(C)cc(C(=O)NCCCC(N)=O)c2C)c1 46973321 HHXYMCKJPNKIQQ-UHFFFAOYSA-N 313.401 2.398 10 40 DECB Cc1ccc(C(=O)NN2C(=O)CSC2=S)c(Cl)c1 5243629 DINQTNLAHBMFBF-UHFFFAOYSA-N 300.792 2.154 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1ccc(Oc2ccccc2)cc1 5604125 YIYCGYXIDCCILN-UHFFFAOYSA-N 324.361 2.393 10 40 DECB CC(=O)NS(=O)(=O)c1ccc(/N=N/N2CCCCCC2)cc1 100084919 QIORWLRIECTVGV-BMRADRMJSA-N 324.406 2.386 10 40 DECB Cc1cc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)no1 60058914 MQRFNKUCMDUJIP-UHFFFAOYSA-N 302.378 2.391 10 40 DECB CC(=O)Oc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 409409929 XVUSGHGJUKRNEX-WJDWOHSUSA-N 322.320 2.073 10 40 DECB CCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 57465348 BPRIRDBHFDXXLH-UHFFFAOYSA-N 305.422 2.105 10 40 DECB Oc1ccc(CCNc2ncc(Br)cn2)cc1O 95407821 SHYLAPWPNSXXIG-UHFFFAOYSA-N 310.151 2.305 10 40 DECB Cn1cc(CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc21 156656371 BIFORHGDHMYMSP-UHFFFAOYSA-N 324.380 2.491 10 40 DECB COC(=O)CN1C(=O)/C(=C\c2ccc(OC)cc2)SC1=S 1101218 GWQMDTXXGVOOMR-YRNVUSSQSA-N 323.395 2.069 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccncc3)C2=O)cc1C 408819810 RXQMJZFICOPLQI-XNTDXEJSSA-N 321.336 2.365 10 40 DECB CCN1CCN(Cc2c(O)ccc3c(=O)c(Cl)coc23)CC1 41515065 GRXWHIXWFWPQSK-UHFFFAOYSA-N 322.792 2.290 10 40 DECB CN1C(=O)/C(=C\c2nc3ccccc3c(=O)n2C)c2ccccc21 3901127 OGIYQUBZUJJKRA-KAMYIIQDSA-N 317.348 2.451 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3ccccc3)S2)CC1 19842449 BQHKIMCTDZTGPR-OWBHPGMISA-N 301.415 2.294 10 40 DECB COc1cc(/N=N/c2c(N)nc(N)nc2O)c(OC)cc1Cl 104125408 OZGLQXRHIBTCJP-VHEBQXMUSA-N 324.728 2.433 10 40 DECB CN1CCC(N(C)C(=O)/C=C/c2ccc(N(C)C)cc2)CC1 69417024 ACLUFDJWNIZBLB-JXMROGBWSA-N 301.434 2.318 10 40 DECB O=C(NCc1ccc(N2CCNCC2)c(F)c1)c1ccsc1 195542859 SYEXDXSIVCEYNR-UHFFFAOYSA-N 319.405 2.227 10 40 DECB COc1ccc(N2CCN(C(=O)c3ccc(N)cc3)CC2)cc1 225324179 VCJYJJCREPTUCB-UHFFFAOYSA-N 311.385 2.240 10 40 DECB COC(=O)C1=C(C)NC(=O)/C1=C\c1cc([N+](=O)[O-])ccc1Cl 573233 QSCXIWKVDQTOOR-POHAHGRESA-N 322.704 2.208 10 40 DECB CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3C)C2=O)cc1 506537 GPIKYSGLIOACCP-RVDMUPIBSA-N 323.352 2.254 10 40 DECB CNC(=O)CSc1ncc(-c2ccccc2)n1CCOC 44085855 VTSRXSGXILWGGG-UHFFFAOYSA-N 305.403 2.035 10 40 DECB CC1=C2[C@@H](CCS2(=O)=O)[C@@H]2C(=O)c3ccccc3C(=O)[C@@H]2C1 16028718 UVXXXOSBZCSZQB-MJBXVCDLSA-N 316.378 2.410 10 40 DECB biogenic CCCN(Cc1ccccc1O)C(=O)CCCNC(=O)OC 78697564 XXNPDDCDCPVPOQ-UHFFFAOYSA-N 308.378 2.267 10 40 DECB CC(C)(C)/N=[N+](\[O-])C(Br)(Br)[N+](=O)[O-] 30822899 LHRPVFIUKYTUDY-HJWRWDBZSA-N 318.953 2.425 10 40 DECB CCC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373957 YLLBLJSNJRCKPS-UEUZTHOGSA-N 324.427 2.480 10 40 DECB CC1(C)[C@@H]2CC[C@]1(C(=O)N1CCc3ccccc3C1)C(=O)C2=O 100261940 UIEXPJLYCJLADP-AUUYWEPGSA-N 311.381 2.146 10 40 DECB Cc1nc(S/C(=C\c2ccc(N(C)C)cc2)C(=O)O)n[nH]1 409189501 PUDXUYLUJBYRPM-WQLSENKSSA-N 304.375 2.397 10 40 DECB Cc1cc(N2CCCC2)c(F)cc1/C=C1/C(=O)NC(=O)N=C1O 33632263 HGQBAQYBUOEOEE-UHFFFAOYSA-N 317.320 2.324 10 40 DECB Cc1ccc2c(c1)NC=C(C(=O)N1CCCCCC1)S2(=O)=O 67340734 LQMQMYYWDMYBOX-UHFFFAOYSA-N 320.414 2.438 10 40 DECB O=S(=O)(O)c1ccc(O)c(/N=N\c2ccc(O)cc2O)c1 104181039 NOYGQBBPVKLDQU-YPKPFQOOSA-N 310.287 2.466 10 40 DECB O=C1N[C@@H](c2ccc(N3CCOCC3)cc2)Nc2ccccc21 9378711 YRPKYMUJTIQXDH-KRWDZBQOSA-N 309.369 2.377 10 40 DECB COc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 5392684 QYLHLIGARONIMV-UHFFFAOYSA-N 305.315 2.032 10 40 DECB CN1CCCc2cc(CNC[C@H]3CNc4ccnn4C3)ccc21 58308833 UMPBXADGUNVZJN-HNNXBMFYSA-N 311.433 2.097 10 40 DECB CCOc1ccc(/C=C2\C(=O)NC(C)=C2C(=O)OC)cc1OC 14406507 XRYXJQCUQQMFBT-WQLSENKSSA-N 317.341 2.054 10 40 DECB Cc1ccc(N2NC(=O)/C(=C/c3ccc4c(c3)OCO4)C2=O)cc1 4579452 FGFGJUUMGYANSW-ZSOIEALJSA-N 322.320 2.185 10 40 DECB COc1ccc(N2CCN(C(=O)c3c(C)noc3C)CC2)cc1 2744161 KYQYTCFFJGAYSB-UHFFFAOYSA-N 315.373 2.262 10 40 DECB CN(C)c1ccc(CNc2ccc(S(N)(=O)=O)cc2)cc1 3852427 LTKHAOIYRFOKFS-UHFFFAOYSA-N 305.403 2.012 10 40 DECB biogenic CCn1cccc1/C=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O 14133196 KLRGMXLJPGRYPY-SDNWHVSQSA-N 323.352 2.483 10 40 DECB COC(=O)C1=C(C)N(C)C(=O)/C1=C\c1ccc(OC)cc1OC 5465374 ZAHMBSCKHOQENK-JYRVWZFOSA-N 317.341 2.006 10 40 DECB CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(N(C)C)cc1 4044805 DVNKEEHUUWGAFQ-OAHLLOKOSA-N 317.389 2.334 10 40 DECB O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccoc1 72273083 BHLOGVYFBSYFJU-UHFFFAOYSA-N 314.385 2.418 10 40 DECB Cc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2O)c(O)c1 36622475 KRVNHFREQLCMMA-UHFFFAOYSA-N 302.286 2.244 10 40 DECB CN1CCCc2cc(CNC(=O)[C@H]3CC[C@H](CN)CC3)ccc21 257243748 IIKHLWJUMHZCLJ-KOMQPUFPSA-N 315.461 2.450 10 40 DECB COC(=O)CCCN1C(=O)/C(=C\c2ccco2)SC1=S 9444409 RUPWYDCAIDVXPC-CSKARUKUSA-N 311.384 2.434 10 40 DECB O=C1c2ccccc2C(=O)c2c1cccc2N1CCC(O)CC1 4168929 HFQNWIQUEFDDMG-UHFFFAOYSA-N 307.349 2.423 10 40 DECB COC(=O)Cc1c(C)c2ccc(O)c(CNC(C)C)c2oc1=O 6759594 PCINQOLYIBZNDY-UHFFFAOYSA-N 319.357 2.021 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccccc1[N+](=O)[O-] 409400177 PWBRMMRYNDALBQ-RAXLEYEMSA-N 309.281 2.056 10 40 DECB CCN1C(=O)C(=Cc2ccc(C)cc2)C(=O)N(CC)C1=S 5715883 BGROLBHYNKOLNM-UHFFFAOYSA-N 302.399 2.374 10 40 DECB CCOC(=O)CN1C(=O)/C(=C/c2cccc(O)c2)SC1=S 1277111 DCYJGWJEGUHXIB-XFFZJAGNSA-N 323.395 2.157 10 40 DECB COc1ccc(N2CCC(N(C)C(=O)[C@@H]3CCCO3)CC2)cc1 65608954 SMOTXEWCYUIFFO-KRWDZBQOSA-N 318.417 2.301 10 40 DECB CC[C@@H](N/C=C1/C(=O)N(c2ccc(C)c(C)c2)N=C1C)C(=O)O 19143466 PYFYJWOIQJWQMC-AAWPKVBNSA-N 315.373 2.363 10 40 DECB CC(=O)Oc1cccc(C=C2C(=O)OC3(CCCC3)OC2=O)c1 58866179 JUFYPQLVBHYWPG-UHFFFAOYSA-N 316.309 2.366 10 40 DECB CCN1C(=O)N/C(=C/c2ccc(N3CCCC3)cc2OC)C1=O 4702429 JYZWLCZCPNVKHF-GXDHUFHOSA-N 315.373 2.208 10 40 DECB COc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1 4992961 HXMNESRWCWOUHE-GXDHUFHOSA-N 314.341 2.100 10 40 DECB CCOC(=O)C1(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 73132591 RYEAVUYNNXBDBH-UHFFFAOYSA-N 316.401 2.029 10 40 DECB Nc1ccc(OCCN2CCN(Cc3ccccc3)CC2)cc1 19731863 GLFYKMFOANURLS-UHFFFAOYSA-N 311.429 2.465 10 40 DECB CC(=O)N1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 5291173 WSSWKRIWZCKGDT-VZUCSPMQSA-N 307.352 2.163 10 40 DECB O=C(C[C@H]1SC(=S)NC1=O)Nc1cccc2ncccc12 34926908 DJMOOLRSLMJDNZ-LLVKDONJSA-N 317.395 2.080 10 40 DECB O=Cc1ccc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)cc1 5374997 JVNJPCCBXJBAPU-XFFZJAGNSA-N 321.379 2.175 10 40 DECB COc1ccc(N2CCCN(C(=O)CN(C)C(C)C)CC2)cc1 65625977 RHNZBOIBGDXXJU-UHFFFAOYSA-N 319.449 2.074 10 40 DECB Cc1cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)c(C)n1C(C)C 408967064 RZCQXROOGSZOOS-UHFFFAOYSA-N 319.430 2.285 10 40 DECB O=C(C[C@@H]1SC(=S)NC1=O)Nc1ccc(Cl)cc1 34926777 VIUXOSNNRSNLAX-QMMMGPOBSA-N 300.792 2.185 10 40 DECB C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 4813891 NOXFPQYJWMPYFL-FSEMZKDTSA-N 309.368 2.067 10 40 DECB O=C1CCCN1CCc1nc(-c2ccc(O)c(O)c2)cs1 30447837 ZMQWFRODCJMPCP-UHFFFAOYSA-N 304.371 2.386 10 40 DECB CCN1C(=O)C(=Cc2ccc(OC)cc2)C(=O)N(CC)C1=S 6438620 IWUQJRLXDAEWOS-UHFFFAOYSA-N 318.398 2.074 10 40 DECB CCN1C(=O)NC(=O)/C(=C\c2ccc(OC)c3ccccc23)C1=O 555367 KWANANVPMBQEBU-GXDHUFHOSA-N 324.336 2.330 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C\c3ccccc3)S2)CC1 19948343 BQHKIMCTDZTGPR-WYMLVPIESA-N 301.415 2.294 10 40 DECB CS(C)(=O)=Nc1cccc2c1C(=O)c1cccc(N)c1C2=O 34592556 BLKZKJRBXGQBDZ-UHFFFAOYSA-N 314.366 2.403 10 40 DECB CCOc1cc(N2CCN(C)CC2)c([N+](=O)[O-])cc1OCC 9378863 QQCPNMLNLBMDCS-UHFFFAOYSA-N 309.366 2.144 10 40 DECB Cc1ccc(N2NC(=O)/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)cc1 5751401 UDGCXOBIXOVSQB-GDNBJRDFSA-N 323.308 2.365 10 40 DECB CN(C)c1ccc(CNCCN[C@H]2CCOC(C)(C)C2)cc1 20676664 WPIQFWRPJWBNMR-INIZCTEOSA-N 305.466 2.389 10 40 DECB O=c1oc2c(CNC[C@H]3CCCO3)c(O)ccc2c2c1CCC2 6661394 SPZPQOHURIETNL-LLVKDONJSA-N 315.369 2.256 10 40 DECB COc1ccc(N2CCCN(Cc3nc(C)no3)CC2)cc1 52466819 LPMUUNUEZVQDQB-UHFFFAOYSA-N 302.378 2.099 10 40 DECB [N-]=[N+]=CC(=O)C[C@@H](c1ccccc1)N1C(=O)c2ccccc2C1=O 4837209 YBJMNLJKEMVPAC-INIZCTEOSA-N 319.320 2.284 10 40 DECB CCN(Cc1ccc(N(C)C)cc1)C(=O)c1n[nH]cc1[N+](=O)[O-] 95978109 OSHIZGXNNVGWDF-UHFFFAOYSA-N 317.349 2.046 10 40 DECB c1cnc(-n2ccnc2)c(CNCc2ccc3c(c2)CCO3)c1 48234823 QJKDMLSZNJOVRI-UHFFFAOYSA-N 306.369 2.492 10 40 DECB CCn1c(-c2ccc(OC)cc2)cnc1SCC(=O)NC 44085626 ARBVGSZISBOTAZ-UHFFFAOYSA-N 305.403 2.417 10 40 DECB COc1ccc(N2CCN(C(=O)c3scnc3C)CC2)cc1 46566533 ATUJQDYXYHDUKK-UHFFFAOYSA-N 317.414 2.423 10 40 DECB O=S(=O)(c1cccc2nsnc12)N1CCc2ccccc21 171177 JAVLOGBQHADBOA-UHFFFAOYSA-N 317.395 2.443 10 40 DECB O=C(NCc1ccc(N2CCCC2)cc1)Nc1nncs1 43127658 DIYRLWJQGASRKW-UHFFFAOYSA-N 303.391 2.460 10 40 DECB COc1ncccc1NC(=O)NCc1ccc(N(C)C)cc1 40121649 SGZYCMVNOCHEPC-UHFFFAOYSA-N 300.362 2.478 10 40 DECB CCN(CC)c1ccc(CN(C)c2ccc3nnnn3n2)cc1 24990229 NGZJDNGXWZUXGZ-UHFFFAOYSA-N 311.393 2.002 10 40 DECB COc1ccc(N2CCN([C@H](C)c3nnc(C)o3)CC2)cc1 71819418 GYVMPQPTANVZQA-GFCCVEGCSA-N 302.378 2.270 10 40 DECB Cc1cc(CNC(=O)CCc2cnn(C)c2)ccc1N(C)C 71896280 PBRMAOZBASDFSG-UHFFFAOYSA-N 300.406 2.044 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)o1 13774720 PKLBYWFWXRKLCI-DHZHZOJOSA-N 314.272 2.394 10 40 DECB CCOC(=O)c1ccc(N(C=O)CCC(=O)CN=[N+]=[N-])cc1 104063354 YWCIXTAINBWCMV-UHFFFAOYSA-N 304.306 2.096 10 40 DECB c1cnnc(N2CCC[C@H]2CNCc2ccc3c(c2)CCO3)c1 75132737 KQTRJAIXFGRXIA-INIZCTEOSA-N 310.401 2.170 10 40 DECB COc1cc(/C=C2\SC(N3CCCC3)=NC2=O)ccc1O 12436534 TTXLVZDOGASQDD-LCYFTJDESA-N 304.371 2.467 10 40 DECB COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c(O)c2)cc1 1673164 JORBZMDJMACPKC-XIKOKIGWSA-N 317.385 2.361 10 40 DECB COc1ccc(NC(=O)COc2ccc(N)cc2)c(OC)c1 31895856 KQNQFOCSPPQFGU-UHFFFAOYSA-N 302.330 2.304 10 40 DECB O=C(NCc1ccc(N2CCSCC2)cc1)c1ccon1 84403199 DXGXSMQICKWAHC-UHFFFAOYSA-N 303.387 2.158 10 40 DECB O=C(NCCc1ccccn1)NCc1ccc(N2CC=CC2)cc1 101242641 GLXUYTFHSHOQEG-UHFFFAOYSA-N 322.412 2.500 10 40 DECB CC[C@H](N/C=C1\C(=O)N(c2ccc(C)c(C)c2)N=C1C)C(=O)O 101513697 PYFYJWOIQJWQMC-MZLJFPOFSA-N 315.373 2.363 10 40 DECB COc1ccc(N(C)CC(=O)Nc2ccncc2)cc1OC 78806514 YWLKBCOKFNFVKH-UHFFFAOYSA-N 301.346 2.174 10 40 DECB CC[C@H](C)N1C(=O)/C(=C\Nc2ccc(F)cc2)C(=O)NC1=S 9288224 SIHMCNQLGUFWBM-RILYUOAZSA-N 321.377 2.163 10 40 DECB CCCN1C(=O)/C(=C\c2ccccc2O)C(C(=O)OC)=C1C 574473 ISOPDEOTCGYWQM-RAXLEYEMSA-N 301.342 2.475 10 40 DECB COCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 96431775 JDEXJEJYGUSQEZ-LLVKDONJSA-N 314.332 2.019 10 40 DECB CCc1nnsc1C(=O)N(C)Cc1ccc(N(C)C)cc1 27380182 ZFJGPCIAYDJFJO-UHFFFAOYSA-N 304.419 2.439 10 40 DECB CN(C)c1ccc(CNC(=O)Cc2cn3ccsc3n2)cc1 9337587 NSPPUAFKRDSQDT-UHFFFAOYSA-N 314.414 2.321 10 40 DECB CC(=O)N1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S 5291166 IBRYIIBNUORDJX-UXBLZVDNSA-N 308.340 2.343 10 40 DECB O=C(C1CC1)N1CCC(NCc2ccc3c(c2)CCO3)CC1 43288603 PSSFOEIZELWXAQ-UHFFFAOYSA-N 300.402 2.112 10 40 DECB CN(Cc1ccccc1O)C(=O)NCCc1cn2ccccc2n1 45426156 KBXDCGNYMGTLDJ-UHFFFAOYSA-N 324.384 2.424 10 40 DECB Cc1nnc2ccc(NCCCSc3nccs3)nn12 89740967 NHAUCSCFRAPFIX-UHFFFAOYSA-N 306.420 2.484 10 40 DECB O=C1NC(=S)NC(=O)C1=C/C=C/C=C1/C=Cc2ccccc2N1 5338555 FPILZTINLSWJBP-OBBGFGQDSA-N 323.377 2.023 10 40 DECB Cc1ccc(C(=O)NCCCc2c(C)nn(C)c2C)c(O)c1O 97079821 FBQWFTXNYUQEGS-UHFFFAOYSA-N 317.389 2.119 10 40 DECB COc1ccc(NC(=O)CCN2C(=O)[C@H](C)SC2=S)cc1 11635899 HRRRDXSVKZFCGP-VIFPVBQESA-N 324.427 2.273 10 40 DECB COc1ccc(C(=O)NCc2ccc(N(C)C)cc2)c(O)c1 18214905 UAENUISPSXCKAI-UHFFFAOYSA-N 300.358 2.397 10 40 DECB CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(N(C)C)cc1 310649 PLEMTSLQRFXHHP-OAHLLOKOSA-N 317.389 2.286 10 40 DECB Cc1ccc(N2CCC[C@@H](NCc3ccc4c(c3)CCO4)C2)nn1 69926769 LXOSBEYVNPICFA-QGZVFWFLSA-N 324.428 2.479 10 40 DECB Oc1cc2c(cc1CN1CCN(c3ccccc3)CC1)OCO2 3570052 GPOVXGHECNCLEZ-UHFFFAOYSA-N 312.369 2.443 10 40 DECB CCCOc1ccc(C=C2C(=O)NC(=S)NC2=O)cc1Cl 408872941 LOTAPXUABFUOSU-UHFFFAOYSA-N 324.789 2.043 10 40 DECB CN1C(=O)/C(=C/c2cc3ccccc3[nH]c2=O)SC1=S 9007802 VKHHEXXRDLWKEE-XFFZJAGNSA-N 302.380 2.359 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccncc2)SC1=S 1856694 VRGPCICABMEWHR-BRNRAETOSA-N 322.411 2.392 10 40 DECB Cc1ccc(CN(CC(N)=O)c2ccc3c(c2)OCCO3)s1 69530435 MUHGRWRXBWDKTB-UHFFFAOYSA-N 318.398 2.320 10 40 DECB CN(C)c1ccc(CNS(=O)(=O)c2cccc(F)c2)cc1 17333443 BOCFAWGCRNXIIS-UHFFFAOYSA-N 308.378 2.370 10 40 DECB O=C(C[C@@H]1SC(=S)NC1=O)Nc1cccc2ncccc12 34926909 DJMOOLRSLMJDNZ-NSHDSACASA-N 317.395 2.080 10 40 DECB NC(=O)C[C@H](Nc1c2ccccc2nc2ccccc12)C(=O)O 5529512 NLWSHVQOMAJEGR-AWEZNQCLSA-N 309.325 2.129 10 40 DECB CCN(CC)c1ccc(/C=C2/C(=O)N(C)C(=S)N=C2O)o1 1275909 SCBRRCUPHCIRBK-CSKARUKUSA-N 307.375 2.223 10 40 DECB C[C@]12CC[C@@H]3[C@H](CC(=O)C(=O)[C@@]3(C)CCC(=O)O)[C@@H]1CC[C@@H]2O 5029303 ISJZFODWNJRYCF-OBRBTBCZSA-N 322.401 2.203 10 40 DECB Cc1ccc(NC(=O)C[C@@H]2SC(=S)NC2=O)cc1Cl 34926783 LLTBXHATQMWXEG-VIFPVBQESA-N 314.819 2.494 10 40 DECB Cc1ccc(C)n1-c1ccc(C(=O)Nc2nccn(C)c2=O)cc1 80793796 MMLBCFKIZTWSQR-UHFFFAOYSA-N 322.368 2.440 10 40 DECB C[C@@]1(CCC(=O)O)C(=O)C(=O)C[C@H]2[C@@H]1CC[C@@]1(C)[C@@H](O)CC[C@@H]21 5029304 ISJZFODWNJRYCF-PJHLMXOESA-N 322.401 2.203 10 40 DECB O=C(C[C@H]1SC(=S)NC1=O)Nc1ccc(Cl)cc1 34926776 VIUXOSNNRSNLAX-MRVPVSSYSA-N 300.792 2.185 10 40 DECB Cc1cc(O)ccc1NS(=O)(=O)c1ccc2nc(O)oc2c1 28580305 MXDBRPYOEXXQET-UHFFFAOYSA-N 320.326 2.348 10 40 DECB COc1ccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c2ccccc12 5659751 XVZYYUIDTQTPQX-UHFFFAOYSA-N 324.336 2.282 10 40 DECB CN(C)c1ccc2c(c1)CN(C(=O)c1c[nH]cn1)[C@@H]2c1cnco1 96086993 PYNDPSHPGVKAOG-INIZCTEOSA-N 323.356 2.209 10 40 DECB Cc1cc(/C=C2/NC(=O)NC2=O)c(C)n1-c1ccc(N(C)C)cc1 447519 MOVDKJOHPSYMSP-MHWRWJLKSA-N 324.384 2.340 10 40 DECB COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(O)c(O)c2)c1 1577491 MWQFECMIRHKTMK-SGTLLEGYSA-N 317.385 2.361 10 40 DECB O=C1N=C(O)/C(=C/NC2CC2)C(=O)N1c1ccccc1Cl 103118035 LSFALJCYFCSOTO-CLFYSBASSA-N 305.721 2.399 10 40 DECB COC(=O)CN1C(=O)/C(=C/c2ccc(C)s2)SC1=S 409199909 FOPXPEQNIJKNIY-UITAMQMPSA-N 313.425 2.431 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1ccc(-c2ccccc2)s1 13678249 GXFALXCCPVRBRJ-UHFFFAOYSA-N 314.391 2.329 10 40 DECB C[C@@H](Cn1cccn1)NCc1ccc(N2CCOCC2)c(F)c1 69372213 ADWKQBLANOPAPR-AWEZNQCLSA-N 318.396 2.037 10 40 DECB COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc1 235355 PITKDZCHBCHKFH-PTNGSMBKSA-N 322.320 2.362 10 40 DECB CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)NCCO 100423186 YJXWYEJNOJWUCK-VBKFSLOCSA-N 317.389 2.054 10 40 DECB CCCC12CN3CC(C)(CN(C1)C3c1ccc(O)cc1O)C2=O 19322269 QIWUZRLMUZFCGZ-UHFFFAOYSA-N 316.401 2.103 10 40 DECB CNC(=O)COC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 3349711 FXSYKCLPBZPYNU-UHFFFAOYSA-N 304.321 2.136 10 40 DECB CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)OCO3)CC1 72220858 RCVBLTREIOKTLM-UHFFFAOYSA-N 306.362 2.472 10 40 DECB Cc1ccc2nonc2c1S(=O)(=O)Nc1ccc(F)cc1 32579216 JKIMUHOPCLPXGZ-UHFFFAOYSA-N 307.306 2.471 10 40 DECB CN(C)c1ccc(CNC(=O)NCc2cccnc2)cc1F 58264643 ZHNUUWIJFMJMDI-UHFFFAOYSA-N 302.353 2.286 10 40 DECB CS(=O)(=O)c1ccc(NNC(=S)Nc2ccccc2)cc1 47439207 QEBDWTZOCHJSOB-UHFFFAOYSA-N 321.427 2.404 10 40 DECB COc1cccc([C@H]2NC(=N)Nc3nc4ccccc4n32)c1O 1408256 RCEVEHXPTRNDTP-AWEZNQCLSA-N 309.329 2.247 10 40 DECB COCCN1C(=O)/C(=C/c2cc(C)n(C)c2C)SC1=S 409129861 STITUKGJDXDZMH-WQLSENKSSA-N 310.444 2.490 10 40 DECB COc1ccc(NS(=O)(=O)c2cccc3nonc23)c(C)c1 14223724 VMGFDXABWHPUHM-UHFFFAOYSA-N 319.342 2.341 10 40 DECB CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=S)N(C)C1=O 6440115 DDHFHVIVKRGHJV-QSARLWQPSA-N 318.398 2.120 10 40 DECB O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCC1CCC1 71888776 APAAGAWXQPXOGA-RMKNXTFCSA-N 300.402 2.453 10 40 DECB CC1=C(C(=O)OC(C)C)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1 123914 MVIYDBUSZUWTLF-HNNXBMFYSA-N 317.389 2.332 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccn2)SC1=S 1300713 OEINKKZULXLWMF-BRNRAETOSA-N 322.411 2.392 10 40 DECB O=C1N=C(O)/C(=C/NC2CC2)C(=O)N1c1cccc(Cl)c1 103088575 MSGHAKBRTKQIHN-XFFZJAGNSA-N 305.721 2.399 10 40 DECB COCCN1C(=O)c2ccccc2N[C@H]1c1ccc(O)c(O)c1 25310152 KEZSSFMVCGIJMN-MRXNPFEDSA-N 314.341 2.311 10 40 DECB COc1cccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)c1 4992969 BGNSBICKGDMBLK-GXDHUFHOSA-N 314.341 2.100 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C/NC(C)(C)C)C2=O)cc1C 100949972 WPOFIJBIJWPKPG-LCYFTJDESA-N 315.373 2.158 10 40 DECB COCCN1C(=O)/C(=C\c2cccc(C)c2)C(C(=O)OC)=C1C 14414403 YFTYQGVVFFAXTG-PTNGSMBKSA-N 315.369 2.314 10 40 DECB CN(C)c1ccc(CNCCN[C@@H]2CCOC(C)(C)C2)cc1 20676659 WPIQFWRPJWBNMR-MRXNPFEDSA-N 305.466 2.389 10 40 DECB COc1cc(N2CCN[C@@H]3CCCC[C@@H]32)cc(OC)c1OC 225713994 KBZCKJLNPPQHBR-KGLIPLIRSA-N 306.406 2.433 10 40 DECB O=C(O)[C@@H]1Nc2c(O)cc(Cl)c([N+](=O)[O-])c2[C@@H]2C=CC[C@H]12 4539517 WGUAPOVFDKLQGB-GOZTUDAPSA-N 310.693 2.492 10 40 DECB biogenic,in-vitro CN(C[C@@H]1CCCO1)C(=O)NCc1ccc2c(c1)CCCN2C 72242375 JJDUSRPBFUEVCM-INIZCTEOSA-N 317.433 2.389 10 40 DECB CCc1cc(=O)oc2c(C)c(O)c(CN3CCN(C)CC3)cc12 20649447 GCQQJTYIHUMFQK-UHFFFAOYSA-N 316.401 2.117 10 40 DECB COc1ccc(C(=O)C(=O)c2ccc(OC)c(O)c2)cc1O 95115802 YDXGJZKMUKDLDH-UHFFFAOYSA-N 302.282 2.181 10 40 DECB O=C1NC(=S)S/C1=C/c1ccc(N2CCOCC2)c(F)c1 409133509 UIPCDNQGDYPPFJ-XYOKQWHBSA-N 324.402 2.151 10 40 DECB C[C@@H]1CN(c2ccc(CNC(=O)C3CC3)cc2F)C[C@@H](C)O1 55529573 ZGNRYCAZOFXTIV-VXGBXAGGSA-N 306.381 2.466 10 40 DECB Cc1cnn(CCC(=O)NCc2ccc(N(C)C)c(C)c2)c1 78912545 ZQRNCZVHTNADTA-UHFFFAOYSA-N 300.406 2.272 10 40 DECB C[C@H]1CN(C2=NC(=O)/C(=C/c3ccccc3O)S2)C[C@@H](C)O1 13784896 WXAKZNMWICFPFG-FGLUKDLVSA-N 318.398 2.472 10 40 DECB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 310062 SIKOKKFZANGTCL-UHFFFAOYSA-N 322.298 2.124 10 40 DECB c1ccc(-n2cnnc2CNCc2ccc3c(c2)CCO3)cc1 48366382 CTKWPXOVFUXZQT-UHFFFAOYSA-N 306.369 2.492 10 40 DECB COCCNC(=O)N(Cc1ccco1)Cc1ccccc1O 65594301 UQYPKUNWCKPPII-UHFFFAOYSA-N 304.346 2.343 10 40 DECB CN(Cc1ccccc1O)C(=O)Cn1ccc(C(F)(F)F)n1 79110724 KGTFMNRQWAJGNC-UHFFFAOYSA-N 313.279 2.266 10 40 DECB COc1ccc(N(C)Cc2ccc(C(N)=O)cc2)cc1OC 58419415 AWCOWZWDKNDJHK-UHFFFAOYSA-N 300.358 2.439 10 40 DECB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccccc1O 5774258 KPSKGFCZTAFHBN-JLHYYAGUSA-N 308.293 2.059 10 40 DECB COCC1=NNC(=O)/C1=C\Nc1cc(Cl)cc(Cl)c1 13394496 RXMMHDHTEPBBGK-YHYXMXQVSA-N 300.145 2.421 10 40 DECB COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2)c1 72271099 JZFJMXXFEBBCOH-LLVKDONJSA-N 314.341 2.217 10 40 DECB N=C1/C(=C/c2ccco2)C(=O)N=C2SC(C(F)(F)F)=NN12 507644 HGRXOGALGDRSAM-JYXXCXAHSA-N 314.248 2.461 10 40 DECB [N-]=[N+]=CC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 80881200 WLGLEWHRLFWXLX-INIZCTEOSA-N 323.352 2.394 10 40 DECB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\NCCCC(=O)O 19143474 XQJQBHIXXAZZON-GDNBJRDFSA-N 315.373 2.364 10 40 DECB COc1cc(OC)c(/N=N/c2c(N)nc(N)nc2O)cc1Cl 16952177 AVOQLKIMZMKCBQ-VHEBQXMUSA-N 324.728 2.433 10 40 DECB CC(=O)N1c2ccccc2[C@]2(O)[C@@H]1SC1=[N+]2CCCCC1 479932 INCGYHPVJAEXLI-HOTGVXAUSA-N 303.407 2.256 10 40 DECB O=C(NCCc1ccc(O)c(O)c1)c1ccn(C2CCCC2)n1 95446628 VQSFRFZVXBISPK-UHFFFAOYSA-N 315.373 2.382 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CCNC(=O)OCC 69615872 XDFCVKZXLSNBKK-UHFFFAOYSA-N 308.378 2.267 10 40 DECB O=C(CSc1nnc2n1CCCCC2)c1ccc(O)c(O)c1 6097601 FEMRLPPWWFKNAG-UHFFFAOYSA-N 319.386 2.391 10 40 DECB COc1c(CNCc2ccc3c(c2)CCCN3C)c(C)nn1C 58331262 IJFLFPNMSBROBZ-UHFFFAOYSA-N 314.433 2.409 10 40 DECB COc1ccc([C@@H]2NCCc3cc(O)c(O)cc32)c(OC)c1 4724923 UQDIDFQFKYQBNN-KRWDZBQOSA-N 301.342 2.350 10 40 DECB C[C@H]1CN2CCC[C@H]2CN1Cc1ccc(N2CCOCC2)cc1 72324450 MQMBPUANXYJSSL-LPHOPBHVSA-N 315.461 2.192 10 40 DECB Cc1n[nH]cc1CNCc1ccc(N2CCC(CO)CC2)cc1 97160016 JXLLXMGPWSYDTG-UHFFFAOYSA-N 314.433 2.217 10 40 DECB Nc1ccc(Cn2ccc3c4c(N)nc(N)nc4ccc32)cc1 17110288 LNEWNMFMWDBAKM-UHFFFAOYSA-N 304.357 2.379 10 40 DECB O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(O)nn1 58357314 UQIFFGIEPKMQSU-UHFFFAOYSA-N 312.373 2.103 10 40 DECB CCN(CC)S(=O)(=O)N(CC)Cc1ccc(N(C)C)cc1 58557344 SVSJIDFCINLOEU-UHFFFAOYSA-N 313.467 2.161 10 40 DECB CCOC(=O)c1ccc(N/C=C2\SC(=S)NC2=O)cc1 584906245 IZOHJQQNEMBGQF-YFHOEESVSA-N 308.384 2.265 10 40 DECB COc1ccc([C@@H]2NCCc3cc(O)c(O)cc32)cc1OC 3727929 JROWMMCJPNPOEB-KRWDZBQOSA-N 301.342 2.350 10 40 DECB biogenic CN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)C(=O)NC1=S 5879173 VKXQYRWTQGNRPN-XBXARRHUSA-N 315.181 2.250 10 40 DECB O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/Nc1ccccc1 7366937 JIWWXAULDDRSAV-SDNWHVSQSA-N 323.377 2.430 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=C/C=C\c1ccc([N+](=O)[O-])o1 5572743 JKHXYYXAKJRYHD-ARJAWSKDSA-N 319.269 2.498 10 40 DECB COc1ccnc(NCc2ccc(N3CCOCC3)c(F)c2)n1 52456995 ZXGZAJHYZQCXJE-UHFFFAOYSA-N 318.352 2.073 10 40 DECB O=C1c2ccc(S(=O)(=O)O)cc2C(=O)c2c(Cl)cccc21 4091246 UJMQCUZUODEOSA-UHFFFAOYSA-N 322.725 2.362 10 40 DECB COc1ccc(CCNC(=O)Cc2ccc(N)cc2)cc1OC 20185701 UVJKYXCWYPUIKB-UHFFFAOYSA-N 314.385 2.187 10 40 DECB CN1C(=O)/C(=C/c2nc3ccccc3c(=O)n2C)c2ccccc21 33248108 OGIYQUBZUJJKRA-SDNWHVSQSA-N 317.348 2.451 10 40 DECB O=C1/C(=C\c2ccccc2)SC(=S)N1CN1CCOCC1 20083356 PCPGDHZLCBLCAF-JLHYYAGUSA-N 320.439 2.178 10 40 DECB N#CCOc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 35128888 JYZCYZGOVLTYHQ-VBKFSLOCSA-N 319.320 2.050 10 40 DECB CN1C(=O)S/C(=C/c2ccc(N3CCOCC3)c(F)c2)C1=O 409130040 LSWQPJLHZORBSZ-UKTHLTGXSA-N 322.361 2.328 10 40 DECB O=C(C1CCC1)N1CCCN(c2ccc3c(c2)OCCO3)CC1 72339581 NGFUIFXZNNBQNB-UHFFFAOYSA-N 316.401 2.297 10 40 DECB COC(=O)CCN1C(=O)/C(=C\c2cccc(O)c2)SC1=S 5719871 IPKNTYUQSXGVIV-DHZHZOJOSA-N 323.395 2.157 10 40 DECB COc1ccc(/C=C2/SC(=O)N(CCC(N)=O)C2=S)cc1 1799986 VVNPUVNMYVSRIO-DHZHZOJOSA-N 322.411 2.408 10 40 DECB O=C(NN1C(=O)CSC1=S)c1cccc(C(F)(F)F)c1 36611942 GBQSCAHZADGHRJ-UHFFFAOYSA-N 320.317 2.211 10 40 DECB CCC12CN3CC(CC)(CN(C1)C3c1ccc(O)c(O)c1)C2=O 19324320 ATIVYVFFXXBZOZ-UHFFFAOYSA-N 316.401 2.103 10 40 DECB O=C1NN=C(C(F)(F)F)/C1=C\NCc1ccccc1Cl 100408807 VGANXPBHMNRFFE-SOFGYWHQSA-N 303.671 2.362 10 40 DECB Cc1ccc(N2C(=O)/C(=C/c3ccncc3)C(=O)NC2=S)cc1 408820073 SYNRNMDEZNOTQC-GXDHUFHOSA-N 323.377 2.221 10 40 DECB O=C1NN=C(C(F)(F)F)/C1=C/NCc1ccc(Cl)cc1 95932660 WJMPCDZDSDNJDC-TWGQIWQCSA-N 303.671 2.362 10 40 DECB CCOc1ccccc1NC1=NC(=O)/C(=C/C(=O)OC)S1 3225411 GZOHCKTZHPLYRP-FLIBITNWSA-N 306.343 2.184 10 40 DECB O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1N1CCOCC1 12492112 MRYJVGSSCZLCJM-XFXZXTDPSA-N 324.402 2.274 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccn2)SC1=S 1300715 OEINKKZULXLWMF-ZJRUKIMVSA-N 322.411 2.392 10 40 DECB COc1cccc(NC(=O)NCCc2ccc(O)c(O)c2)c1 72285614 MGQUPFSNGICNEM-UHFFFAOYSA-N 302.330 2.471 10 40 DECB NC(=O)NCc1cc(Br)cc(Br)c1O 1729538 BOAZRFJRXMQOES-UHFFFAOYSA-N 323.972 2.086 10 40 DECB CN(C)Cc1noc2c1C[C@@H](NCc1ccc(F)cc1O)CC2 2055730287 VJBZSAQSSOFBBP-ZDUSSCGKSA-N 319.380 2.228 10 40 DECB COc1ccc(NC(=S)NNc2nc(C)cc(C)n2)cc1 1447481 PTQRRRVCKBIEAB-UHFFFAOYSA-N 303.391 2.416 10 40 DECB Cc1ccc(F)c(NS(=O)(=O)c2cccc3nonc23)c1 13948423 NJZNLWVWLWZXHF-UHFFFAOYSA-N 307.306 2.471 10 40 DECB C[C@@]1(CCC(=O)O)C(=O)C(=O)C[C@H]2[C@@H]1CC[C@]1(C)[C@@H](O)CC[C@@H]21 5029306 ISJZFODWNJRYCF-AEXPAOHESA-N 322.401 2.203 10 40 DECB O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc(O)cc2)ccc1F 20024726 PQTMIJBPKVEXRI-UHFFFAOYSA-N 312.278 2.240 10 40 DECB C[C@@H]1CN(C2=NC(=O)/C(=C/c3ccccc3O)S2)C[C@@H](C)O1 4549322 WXAKZNMWICFPFG-QOWMEECXSA-N 318.398 2.472 10 40 DECB O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1 101236056 YAVGKNXASCCFQC-UHFFFAOYSA-N 321.380 2.318 10 40 DECB CCN1C(=O)/C(=C\c2ccccc2OC)C(C(=O)OC)=C1C 59435693 FASWMFNZDMSBAX-RAXLEYEMSA-N 301.342 2.388 10 40 DECB COC(=O)C(C)(C)NC(=O)c1cc(C)n(-c2ccccn2)c1C 75646521 XXYMWNTZFBSNPG-UHFFFAOYSA-N 315.373 2.171 10 40 DECB O=S1(=O)N=C(CSc2nccs2)Nc2ccccc21 69421083 JHRKURKOHJDCBQ-UHFFFAOYSA-N 311.413 2.448 10 40 DECB COC(=O)c1ccc(N/C=C2\C(=O)NN=C2c2ccccc2)cc1 100281611 RVMAVZRHQGFWRN-PTNGSMBKSA-N 321.336 2.303 10 40 DECB COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C=O)c2C)c1 2584088 VXWAFFKYYPGUPG-UHFFFAOYSA-N 315.325 2.480 10 40 DECB CCc1c(C(=O)NCc2ccc(N(C)C)c(F)c2)cnn1C 71844156 ADXWZNBVHRFBOZ-UHFFFAOYSA-N 304.369 2.118 10 40 DECB CCCC12CN3CC(C)(CN(C1)C3c1ccc(O)c(O)c1)C2=O 19322286 FGCFPQWRBDNSNX-UHFFFAOYSA-N 316.401 2.103 10 40 DECB biogenic CCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5374592 CPIHATWVNJETDT-SBMLRHLQSA-N 310.400 2.469 10 40 DECB O=C1c2cccc(S(=O)(=O)O)c2C(=O)c2cccc(Cl)c21 4783161 BJZJPUSHTCPALE-UHFFFAOYSA-N 322.725 2.362 10 40 DECB CN1C(=O)S/C(=C/c2ccc(N3CCOCC3)cc2)C1=O 4622116 GPJXNTUEOHJRGG-JLHYYAGUSA-N 304.371 2.189 10 40 DECB O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccoc1 408961516 MTWPHLRPRADLFD-KPKJPENVSA-N 300.245 2.085 10 40 DECB COC(=O)c1cc2ccccc2c(CN2CCOCC2)c1O 23701614 VSGQCVFXLBSYHD-UHFFFAOYSA-N 301.342 2.164 10 40 DECB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccncc1 10906794 ONWWCUVYNRVIPY-UHFFFAOYSA-N 311.385 2.190 10 40 DECB COC(=O)CCCN1C(=O)/C(=C/c2ccccn2)SC1=S 40888588 JAJSIANHCPCOMT-LUAWRHEFSA-N 322.411 2.236 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(N2CCCC2)o1 33438728 UHFILINHYQNIPS-QINSGFPZSA-N 323.352 2.341 10 40 DECB C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1ccc2c(c1)CCO2 78898028 XSMUKCWOTJELQR-GUYCJALGSA-N 314.429 2.358 10 40 DECB C#CCOc1ccccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 107793096 DDGPBYXEVSYPAC-SSZFMOIBSA-N 318.332 2.160 10 40 DECB Cc1nnc([C@@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)o1 95978521 SNCFWEFGVGMOEE-CYBMUJFWSA-N 316.405 2.408 10 40 DECB CN(C)C(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O 95477468 HSURKALKTUDEBW-UHFFFAOYSA-N 318.332 2.417 10 40 DECB O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccco1 5124227 XJUWAYOSEKJPQV-NTMALXAHSA-N 300.245 2.085 10 40 DECB CN(C)C(=O)c1ccc(NC(=S)NCc2ccccn2)cc1 225330787 LKMRDDRLYFMMFQ-UHFFFAOYSA-N 314.414 2.270 10 40 DECB Cc1cc(C(=O)NC2=NCCS2)c(C)n1-c1ccccn1 84081353 OHPFKLDGHYDCFH-UHFFFAOYSA-N 300.387 2.322 10 40 DECB CCCCCc1[nH]nc(C(=O)OC)c1/N=N/N1CCOCC1 104119093 AAKAOEQFXCFXKB-ISLYRVAYSA-N 309.370 2.260 10 40 DECB COc1ccc(/C=C2\C(=O)NN(c3ccc(F)cc3)C2=O)cc1 368319 LINXJZUGPQVKNT-XNTDXEJSSA-N 312.300 2.296 10 40 DECB Cc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)o1 255923 PNCNVDQFUZRLCP-JYRVWZFOSA-N 314.272 2.394 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3ccc(O)cc3)S2)CC1 19842084 QWAPFOOAKZYIRB-KAMYIIQDSA-N 317.414 2.000 10 40 DECB COc1ccc(N2CCN(C(=O)c3ccccc3O)CC2)cc1 69158127 LKKAUKIOAKKPKI-UHFFFAOYSA-N 312.369 2.363 10 40 DECB COC(=O)COc1ccc(/C=C2/SC(=S)N(C)C2=O)cc1 39402849 XNDBLANARJESOT-YRNVUSSQSA-N 323.395 2.069 10 40 DECB CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(C(N)=O)c1 23082191 PYNNPNGINSOORQ-UHFFFAOYSA-N 311.385 2.124 10 40 DECB Nc1ccc(Nc2ccc(S(=O)(=O)O)cc2[N+](=O)[O-])cc1 38171474 IQXPRPSTZKBYER-UHFFFAOYSA-N 309.303 2.167 10 40 DECB O=c1oc2c(O)c(O)ccc2cc1-c1nc(=O)c2ccccc2[nH]1 2087160228 WPICIFYZBLWKRR-UHFFFAOYSA-N 322.276 2.108 10 40 DECB O=S(=O)(O)c1ccc(/N=N/N2CCOCC2)c2ccccc12 1770798 IWBGQCRUYKSWJY-FOCLMDBBSA-N 321.358 2.417 10 40 DECB CC(C)OC(=O)CN1C(=O)/C(=C/c2cccnc2)SC1=S 1276875 FGOQWACTGVHVNC-WDZFZDKYSA-N 322.411 2.234 10 40 DECB O=C1NCCCC[C@H]1NCc1cc(Cl)cc(Cl)c1O 36977297 QATZZPFQEUBNRL-LLVKDONJSA-N 303.189 2.457 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccncc3)C2=O)cc1 59426727 FBLFCIHMLOAKHC-GXDHUFHOSA-N 307.309 2.056 10 40 DECB CCO/C(C)=C1\C(=O)N(c2ccc(F)cc2)N=C1CC(=O)OC 10493869 YOXQKXHBAGEVID-GDNBJRDFSA-N 320.320 2.402 10 40 DECB CCOC(=O)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 23624807 TUBJQRGKYSBIBO-UHFFFAOYSA-N 304.390 2.155 10 40 DECB C[C@H]1CN(c2ccc(CNC(=O)C3CC3)cc2F)C[C@@H](C)O1 55529569 ZGNRYCAZOFXTIV-TXEJJXNPSA-N 306.381 2.466 10 40 DECB Cc1cc(C(=O)OCC(=O)N(C)C)c(C)n1-c1ccc(F)cc1 3341860 UBASAKWAWFZWGG-UHFFFAOYSA-N 318.348 2.478 10 40 DECB CCCN1C(=O)/C(=C\c2cccc(O)c2)C(C(=O)OC)=C1C 409204421 HBORBFFOBBGKAP-UVTDQMKNSA-N 301.342 2.475 10 40 DECB CCOc1cccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c1 33622279 PDSOOZJVHBSURE-XFFZJAGNSA-N 323.395 2.371 10 40 DECB Cc1nnc([C@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)o1 95978522 SNCFWEFGVGMOEE-ZDUSSCGKSA-N 316.405 2.408 10 40 DECB COc1ccc(O)c([C@H](C)NC(=O)Cc2c(C)n[nH]c2C)c1 188449725 BDZIFECQBDHYPS-VIFPVBQESA-N 303.362 2.161 10 40 DECB Cc1c(CC(=O)NCCC(C)C)c(=O)oc2c(O)c(O)ccc12 4089781 XOJWWMKOYKYTKU-UHFFFAOYSA-N 319.357 2.217 10 40 DECB biogenic O=C(C[C@H]1SC(=S)NC1=O)Nc1ccccc1Cl 34926772 WRGDYDXZXJONIS-MRVPVSSYSA-N 300.792 2.185 10 40 DECB Cc1ccc(S(=O)(=O)Nc2ccc(N)cc2)cc1[N+](=O)[O-] 3885614 FFXVSOSQRKGZPH-UHFFFAOYSA-N 307.331 2.286 10 40 DECB C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1ccc2c(c1)CCO2 78898031 XSMUKCWOTJELQR-CXAGYDPISA-N 314.429 2.358 10 40 DECB C[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)c1cccnc1 97098048 MUZSBNGQRFCNTP-NEPJUHHUSA-N 300.358 2.344 10 40 DECB CN1C(=O)C(=Cc2ccccc2C(F)(F)F)C(=O)N(C)C1=O 3205233 OIUADHLXMNLLSV-UHFFFAOYSA-N 312.247 2.139 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1cccc([N+](=O)[O-])c1 58866116 DEVGWAKYXIEJOO-UHFFFAOYSA-N 303.270 2.349 10 40 DECB CN1C(=O)/C(=C\c2ccc[nH]2)C(=O)N(c2ccccc2)C1=S 4814875 XDXLSMIWNAJOQW-JLHYYAGUSA-N 311.366 2.188 10 40 DECB COc1ccc2ccc(O)c(CN3CCCC[C@H]3C(N)=O)c2c1 9913899 OHJSCHWDBKYKJT-INIZCTEOSA-N 314.385 2.394 10 40 DECB CCC[C@H]1C(=O)N2C(N(C)C)=Nc3ccc(C)cc3N2C1=O 5349 MPHPHYZQRGLTBO-LLVKDONJSA-N 300.362 2.064 10 40 DECB biogenic,world O=C(C[C@@H]1SC(=S)NC1=O)Nc1ccc(F)c(Cl)c1 34926779 MSCURPURCLNKMR-QMMMGPOBSA-N 318.782 2.324 10 40 DECB O=S(=O)(Nc1ccc2c(c1)OCO2)c1ccc(F)cc1F 7051988 YSAXXCDPVIODIZ-UHFFFAOYSA-N 313.281 2.494 10 40 DECB CC(C)c1nc2n(n1)C[C@@H](NCc1ccc3c(c1)CCO3)CC2 69897629 XAFPRBGKKDUYCY-HNNXBMFYSA-N 312.417 2.441 10 40 DECB CCN1C(=O)NC(=O)/C(=C\c2c(OC)ccc3ccccc23)C1=O 555359 QDZHFHBXMNFVQQ-GXDHUFHOSA-N 324.336 2.330 10 40 DECB CCc1cccc(C)c1NC(=O)C[C@H]1SC(=S)NC1=O 34926846 KYLYLGOZTIFNGM-SNVBAGLBSA-N 308.428 2.403 10 40 DECB CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1O 32109844 UOQNJMYRZUMGHB-UVTDQMKNSA-N 324.336 2.252 10 40 DECB O=C1c2ccccc2C(=O)c2c1ccc(S(=O)(=O)O)c2Cl 5776387 HDBFDCXVVJUUBM-UHFFFAOYSA-N 322.725 2.362 10 40 DECB COc1cccc(/C=C2/C(=O)NN(c3ccc(C)cc3)C2=O)c1 15188225 SGPYPXKSPMCUET-WJDWOHSUSA-N 308.337 2.465 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373952 JPPQJXVBHSEXAJ-ZFZMKPAXSA-N 310.400 2.090 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1ccc([N+](=O)[O-])cc1 58866249 XJRJQWBOJYUQPM-UHFFFAOYSA-N 303.270 2.349 10 40 DECB CC[C@H](NC(=O)[C@@H](C)N1CCSCC1)c1ccccc1O 95976929 RAKOZVPKWARMHI-OCCSQVGLSA-N 308.447 2.397 10 40 DECB CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(N(C)C)cc1 310647 PLEMTSLQRFXHHP-HNNXBMFYSA-N 317.389 2.286 10 40 DECB O=C(CCNCc1cc([N+](=O)[O-])ccc1O)N1CCCCCC1 71792580 NRFOPTBGKJYEHS-UHFFFAOYSA-N 321.377 2.183 10 40 DECB O=C(Nc1cccc(Cl)c1)NN1C(=O)CSC1=S 3135994 BMTAYWRPOFSGRH-UHFFFAOYSA-N 301.780 2.237 10 40 DECB O=C(O)CCCN1C(=O)/C(=C/c2ccncc2)SC1=S 1247099 MRCAWGPDHXLKBL-NTMALXAHSA-N 308.384 2.148 10 40 DECB CCCC[N+]1=C2SCCCN2C[C@@]1(O)c1ccc(OC)cc1 3280985 IREHVHSBJLUJJX-QGZVFWFLSA-N 321.466 2.461 10 40 DECB COC(=O)CCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 54360746 YTGVJFATXPTHNX-FLIBITNWSA-N 323.395 2.157 10 40 DECB COCCCNC(=O)CSc1ncc(-c2ccccc2)n1C 7129192 AMHYJFJUNYQULS-UHFFFAOYSA-N 319.430 2.332 10 40 DECB CCOc1ccccc1/C=C1\SC(N2CCOCC2)=NC1=O 12852989 BJMYCCFORNCNFZ-KAMYIIQDSA-N 318.398 2.388 10 40 DECB Cc1c(Cl)cccc1NC(=O)C[C@@H]1SC(=S)NC1=O 34926781 REVJUYPUAWWLJH-VIFPVBQESA-N 314.819 2.494 10 40 DECB O=C1N=C(N2CCCCC2)S/C1=C1/C(=O)Nc2ccccc21 275834 MBKHHQCWPKMAPD-OUKQBFOZSA-N 313.382 2.465 10 40 DECB CN(C)c1ccc(CNC(=O)NCc2nccs2)cc1F 58292509 QJSUXDUGQQHGDT-UHFFFAOYSA-N 308.382 2.348 10 40 DECB CN1CCCc2cc(CNC(=O)/C=C/c3cnn(C)c3)ccc21 65566584 ZOEMUFSINVJTCR-SOFGYWHQSA-N 310.401 2.132 10 40 DECB Cn1ccc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)c1 5373930 WRISBMJUDJLVLI-JXMROGBWSA-N 310.400 2.091 10 40 DECB CCOC(=O)[C@H]1CCCN(Cc2cc(C)cc(OC)c2O)C1 89983568 CVGLKAHNDJUTCO-ZDUSSCGKSA-N 307.390 2.484 10 40 DECB CNC(=O)N[C@H](c1ccc(F)cc1)c1cc2c(cc1O)OCO2 1587925 RMLIHUMSCWMAFD-OAHLLOKOSA-N 318.304 2.278 10 40 DECB CCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373954 YLLBLJSNJRCKPS-VUBLIPMDSA-N 324.427 2.480 10 40 DECB NC(=O)c1cccc(C(=O)NCc2ccc(N3CCCC3)cc2)c1 36396797 NYYRFXGCVGGOLW-UHFFFAOYSA-N 323.396 2.316 10 40 DECB CCCN(Cc1ccccc1O)C(=O)CN(C)c1cnccn1 66096404 STQFQEOKPGBCMJ-UHFFFAOYSA-N 314.389 2.057 10 40 DECB COC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCCC2 38866 PKDXWVDJPOIGCX-UHFFFAOYSA-N 311.359 2.217 10 40 DECB CC1(S(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O 216710091 PLCNMUPYOIFZJO-UHFFFAOYSA-N 300.335 2.298 10 40 DECB CCN1C(=O)C(=Cc2ccc(F)cc2)C(=O)N(CC)C1=S 6144881 XEPQGXHCCANEPR-UHFFFAOYSA-N 306.362 2.205 10 40 DECB CC(=O)Nc1ccc(O)c(C(=O)N(C)Cc2ccccc2O)c1 55285969 SMWLXQLYSXSDPZ-UHFFFAOYSA-N 314.341 2.328 10 40 DECB CC(C)Oc1ccccc1C=C1C(=O)N(C)C(=S)N(C)C1=O 408905375 XZZLURWUUYHUMN-UHFFFAOYSA-N 318.398 2.073 10 40 DECB Cc1cc2c(cc1/C=C1/C(=O)NN(c3ccccc3)C1=O)OCO2 33783407 OXUVTSVXDUIWIU-ZSOIEALJSA-N 322.320 2.185 10 40 DECB CCCN1C(=O)/C(=C\c2cc(Cl)ccc2O)C(=O)N(C)C1=O 575443083 WAEKNAPGSIGQFW-FLIBITNWSA-N 322.748 2.260 10 40 DECB C[N+]1(C)CCc2cc(O)c(O)cc2[C@H]1Cc1ccc(O)c(O)c1 3954348 GVPVDOISXSALCI-CQSZACIVSA-O 316.377 2.425 10 40 DECB in-vitro CCCCc1cc(=O)oc2c(CN[C@@H](C)C(=O)O)c(O)ccc12 2114956 YPVZAWAHOALPCU-JTQLQIEISA-N 319.357 2.404 10 40 DECB biogenic Cc1n[nH]c(C)c1CNCc1ccc(N2CCOCC2)c(F)c1 65473762 JRYNXKXJBCSAFS-UHFFFAOYSA-N 318.396 2.292 10 40 DECB Cc1ccc(OCC(=O)NCCc2ccc(O)c(O)c2)c(C)c1 89614248 XRAIRABESTYJBK-UHFFFAOYSA-N 315.369 2.452 10 40 DECB CCN1C(=O)/C(=C\c2ccc(OCC(=O)O)cc2)SC1=S 5857842 BJDXFCQSCIUNGO-YRNVUSSQSA-N 323.395 2.371 10 40 DECB CCOc1cc2c(cc1/C=C1\SC(=S)NC1=O)OCO2 409107126 QGHLRYYQRAQRKO-WCIBSUBMSA-N 309.368 2.303 10 40 DECB CCN1C(=O)N/C(=C/c2cc(C)n(-c3ccccn3)c2C)C1=O 4516845 PVAQFGFLHOQWLM-GXDHUFHOSA-N 310.357 2.402 10 40 DECB Cc1cc(=O)oc2c(CN3CCC(C(=O)O)CC3)c(O)ccc12 1082565383 TWVRATRSOGRFMV-UHFFFAOYSA-N 317.341 2.104 10 40 DECB CC(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 14256760 XUUINFMSWUGPNP-UHFFFAOYSA-N 317.326 2.226 10 40 DECB C[C@H](N/C=C1/C(=O)NC(=O)N(C(C)(C)C)C1=O)c1ccccc1 2361501 LLHBQQYQBGAJLK-KBICQTFXSA-N 315.373 2.098 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C\NNc2ccccc2)C(O)=NC1=S 38182606 QPQYPPBJTAAHTE-WJEYQPDNSA-N 318.402 2.369 10 40 DECB Cc1cc(NC(=O)NCc2ccc(N3CC=CC3)cc2)n(C)n1 101225445 DIAVYGACSSUVAH-UHFFFAOYSA-N 311.389 2.426 10 40 DECB COc1cc(N2CCN[C@H]3CCCC[C@H]32)cc(OC)c1OC 218836252 KBZCKJLNPPQHBR-UONOGXRCSA-N 306.406 2.433 10 40 DECB CNC[C@@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 97162626 XMXTUUKHHMRBEY-INIZCTEOSA-N 321.440 2.094 10 40 DECB C[C@H]1CN(c2ccc(CNC(=O)C3CC3)cc2F)C[C@H](C)O1 55529571 ZGNRYCAZOFXTIV-RYUDHWBXSA-N 306.381 2.466 10 40 DECB COCCn1c(-c2ccc(OC)cc2)cnc1SCC(=O)O 4850407 LAURFSVZBQVTLB-UHFFFAOYSA-N 322.386 2.382 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3cccs3)S2)CC1 13547706 QNMVZWKWSCNMEA-BENRWUELSA-N 307.444 2.356 10 40 DECB CN1C(=O)NC(=O)/C(=C\c2ccc(-c3ccc(F)cc3)o2)C1=O 446824 COVHEPMKUOKWST-XYOKQWHBSA-N 314.272 2.177 10 40 DECB CC(C)C(=O)N[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2O)C1 69703761 XSUVCMOFBZRWGE-CYBMUJFWSA-N 321.377 2.037 10 40 DECB Cc1cc(O)nc2c(/N=N/c3ccc(C(=O)O)cc3)c(N)nn12 35185189 OOISSAOESLZDSO-ISLYRVAYSA-N 312.289 2.439 10 40 DECB CN1C(=O)/C(=C/c2ccc(C(C)(C)C)cc2)C(=O)NC1=S 408912896 IBMQOUPBGONBMM-FMIVXFBMSA-N 302.399 2.241 10 40 DECB N#CCOc1ccccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 33806875 WZYHRVMKPSMUKC-QINSGFPZSA-N 319.320 2.050 10 40 DECB COc1ccc(N2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1 58343390 NJLKCCDLHXWVRJ-UHFFFAOYSA-N 324.388 2.442 10 40 DECB CC[C@H](NC[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1ccccc1O 157029759 YRHARCRSXURZOW-DUVNUKRYSA-N 306.406 2.069 10 40 DECB COc1ccc(/C=C2\SC(NC(C)=O)=NC2=O)cc1Cl 409026943 JBBIBGQFRUESRY-WDZFZDKYSA-N 310.762 2.455 10 40 DECB CCOC(=O)COc1ccc(/C=C2\SC(=S)NC2=O)cc1 12413397 AXISFPMXIQSBTO-XFFZJAGNSA-N 323.395 2.117 10 40 DECB CN(C)c1ccc(CNC(=O)CSc2nncs2)cc1 12534204 UWZPELJRBGAXOZ-UHFFFAOYSA-N 308.432 2.013 10 40 DECB CN1C(=O)C(=Cc2ccc(-c3ccccc3)o2)C(=O)N(C)C1=O 4103817 PILZJLSRNNHUBZ-UHFFFAOYSA-N 310.309 2.380 10 40 DECB COc1ccc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 14589738 JRKPLTBLTYEYJJ-WEVVVXLNSA-N 313.353 2.479 10 40 DECB biogenic,in-vitro CN(C)c1ccc(N=Nc2ccc(S(=O)(=O)NN)cc2)cc1 256081139 YSSCSLXHGSTCDV-UHFFFAOYSA-N 319.390 2.320 10 40 DECB O=C1NC(=S)NC(=O)C1=Cc1cccc(Oc2ccccc2)c1 59502965 WWBVIEPDCLNTBS-UHFFFAOYSA-N 324.361 2.393 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=C/C=C/c1ccc([N+](=O)[O-])o1 1868639 JKHXYYXAKJRYHD-ONEGZZNKSA-N 319.269 2.498 10 40 DECB COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2)c1 72271098 JZFJMXXFEBBCOH-NSHDSACASA-N 314.341 2.217 10 40 DECB N/C=C1\C(=O)N(c2nc3ccccc3s2)N=C1C(F)(F)F 13895855 BHILJLHEMCRAML-WAYWQWQTSA-N 312.276 2.404 10 40 DECB CC[C@H](C)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 95433472 CRLKRCVKMJCSKE-AWEZNQCLSA-N 306.406 2.159 10 40 DECB COC(=O)c1ccc(C(=O)OC)c(-n2c(C)cc(CO)c2C)c1 223716782 BRCUJVTUNJKXOA-UHFFFAOYSA-N 317.341 2.160 10 40 DECB CCN1C(=O)C(=Cc2ccccc2OC)C(=O)N(CC)C1=S 341733 FKOINSJNZRGNDI-UHFFFAOYSA-N 318.398 2.074 10 40 DECB CN(C)c1ccc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)cc1 12550587 KNIJSHHJYLSBEI-MRXNPFEDSA-N 323.396 2.495 10 40 DECB COc1ccc(N2CCN(c3ccc(Cl)nn3)CC2)cc1 1325957 KDEYQNFHALQZCT-UHFFFAOYSA-N 304.781 2.465 10 40 DECB CCc1cc(=O)oc2c(CNCCOC)c(O)c(Cl)cc12 20572960 MBCAXGXRNXAWIV-UHFFFAOYSA-N 311.765 2.450 10 40 DECB Cc1nc2c(c(=O)[nH]1)CN(Cc1ccc3c(c1)CCCN3C)CC2 12145339 FVKDLBKHXDGSII-UHFFFAOYSA-N 324.428 2.019 10 40 DECB O=C1c2ccccc2C(=O)c2c(O)c3c(c(O)c21)CCC[C@H]3O 6583056 NVNRWHHTJDJRHF-LLVKDONJSA-N 310.305 2.243 10 40 DECB O=C1C(=Cc2ccccc2)SC(=S)N1CN1CCOCC1 2049236299 PCPGDHZLCBLCAF-UHFFFAOYSA-N 320.439 2.178 10 40 DECB NC(=O)CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 8706426 OEXUUFBMXGKPOE-ZDUSSCGKSA-N 317.414 2.307 10 40 DECB Cc1ccc(O)c(C(=O)NCc2cc([N+](=O)[O-])ccc2O)c1 36622531 CPSIMGDYMJLQJR-UHFFFAOYSA-N 302.286 2.244 10 40 DECB COCCN1C(=O)/C(=C\c2sccc2C)C(C(=O)OC)=C1C 2268962 NEROLBQXKRIVST-XFXZXTDPSA-N 321.398 2.376 10 40 DECB COCCCN/C(C)=C1\C(=O)N(c2ccc(OC)cc2)N=C1C 100423009 PLQZRRIUSFHSJJ-VBKFSLOCSA-N 317.389 2.318 10 40 DECB O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C/c1cccc(O)c1 12428829 UVSLSWVQZRLISI-GXDHUFHOSA-N 314.341 2.187 10 40 DECB COc1ccc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)cc1OC 13814315 YTCQCDGGQGUOJK-QRBAAVRYSA-N 313.313 2.154 10 40 DECB COc1ccc2nc(/N=N\c3c(N)nc(N)nc3O)sc2c1 104090948 XGIOVDHEOFGYLS-HNENSFHCSA-N 317.334 2.380 10 40 DECB CN1c2ccccc2C(=O)N[C@@H]1c1c[nH]nc1-c1cccnc1 11034655 HBQIJEQKMVIJBG-INIZCTEOSA-N 305.341 2.350 10 40 DECB Cc1cnn(CC(=O)NCc2ccc(N3CCCCC3)cc2)c1 69518908 FTQXJVVTWHPPHG-UHFFFAOYSA-N 312.417 2.498 10 40 DECB CCC12CN3CC(CC)(CN(C1)C3c1ccccc1O)C2=O 19320130 DFYNGHVHFGIPBD-UHFFFAOYSA-N 300.402 2.398 10 40 DECB biogenic Cc1ccc(C)n1-c1cccc(C(=O)N2CCn3cnnc3C2)c1 72346439 PKQVHLUSNHIZPZ-UHFFFAOYSA-N 321.384 2.342 10 40 DECB CN(C)c1ccc2c(c1)OCCN2Cc1cccc(C(N)=O)c1 72308888 WMXDQCKRFCYUGL-UHFFFAOYSA-N 311.385 2.251 10 40 DECB O=C(O)CN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S 1322430 PFEOKQKYEJFZNV-VZUCSPMQSA-N 318.379 2.454 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)s1 409393093 OYEODIXGGSTEQD-XYOKQWHBSA-N 313.338 2.118 10 40 DECB COc1ccc2nc(/N=N\c3c(N)nc(N)nc3N)sc2c1 104091019 RFBOHYDWXBWMSO-VXPUYCOJSA-N 316.350 2.257 10 40 DECB CC(C)(C)c1ccc(C(=O)NN2C(=O)CSC2=S)cc1 3220205 OOMMKGOHXSIYHC-UHFFFAOYSA-N 308.428 2.489 10 40 DECB O=S(=O)(O)c1ccc(/N=N/c2c(O)cc(O)cc2O)cc1 4804117 VZNWXPSRHNOUOI-BUHFOSPRSA-N 310.287 2.466 10 40 DECB COc1cn(-c2ccc(N)cc2)nc1C(=O)NCc1ccccc1 97673648 LSTAWLBJOSFZFO-UHFFFAOYSA-N 322.368 2.393 10 40 DECB O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc(N2CCCC2)o1 4815332 UHFILINHYQNIPS-NTCAYCPXSA-N 323.352 2.341 10 40 DECB O=C(C[C@@H]1SC(=S)NC1=O)Nc1cccc(Cl)c1 34926775 NCJQGCLPWORYJB-QMMMGPOBSA-N 300.792 2.185 10 40 DECB CC(=O)c1c2c(n3ccc(CO)cc13)C(=O)c1ccccc1C2=O 5545064 HDJIZGFDYJTXDK-UHFFFAOYSA-N 319.316 2.410 10 40 DECB C[C@H]1CC(=O)c2c(ccc3c2C(=O)c2cccc(O)c2C3=O)[C@@H]1O 6037371 WWVNIBVFNYKUQY-WNWIJWBNSA-N 322.316 2.424 10 40 DECB biogenic,in-vitro O=C1c2ccccc2C(=O)c2[nH]c(=O)c(-c3ccccc3)nc21 517560 JGIYRACXBRPHAP-UHFFFAOYSA-N 302.289 2.212 10 40 DECB biogenic Nc1c(O)cc(S(=O)(=O)O)c2cc(Br)ccc12 1669719 AHAGYMANUOUSRM-UHFFFAOYSA-N 318.148 2.137 10 40 DECB CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 8643369 ZUVZZNBYZGLVRK-YAEJEKNGSA-N 322.411 2.392 10 40 DECB CN1C(=O)[C@]2(NN=C(c3ccccc3O)S2)c2ccccc21 341797 MKCMWNNDSGMHED-INIZCTEOSA-N 311.366 2.220 10 40 DECB CN(C)CCN1C(=O)/C(=C/c2ccc(C=O)cc2)SC1=S 5375061 LRCIPAKTSASONU-LCYFTJDESA-N 320.439 2.262 10 40 DECB Cn1cc([C@H]2OCC[C@@H]2CNCc2ccc3c(c2)CCO3)cn1 89755312 WBAQSRNLYPCBRO-QAPCUYQASA-N 313.401 2.222 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3ccc(F)cc3)S2)CC1 19842457 IVCGYTBNXJAAAX-KAMYIIQDSA-N 319.405 2.434 10 40 DECB CCOC(=O)c1c(SC)nn2c(O)c(Cl)c(C)nc12 62710874 NDOIRBOIEHTFGU-UHFFFAOYSA-N 301.755 2.295 10 40 DECB CN(C)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)c(F)c1 96485775 BDBBKRIMPQPOJE-UHFFFAOYSA-N 318.348 2.275 10 40 DECB CN(C)C=C1C(=O)N(c2ccccc2)N(c2ccccc2)C1=O 16163101 FJSJIHHHWCVTCN-UHFFFAOYSA-N 307.353 2.427 10 40 DECB O=C(NCC1CC1)C1(NCc2cc(F)ccc2O)CCCC1 154569572 RIKNUVYGKIAGIQ-UHFFFAOYSA-N 306.381 2.460 10 40 DECB Cc1ccc(N2C(=O)/C(=C/c3ccc[nH]3)C(=O)NC2=S)cc1 9301851 VDTUFNIBDBOAJH-UKTHLTGXSA-N 311.366 2.154 10 40 DECB CC(C)c1nnc2n1C[C@@H](NCc1ccc3c(c1)CCO3)CC2 65473741 VORQUCYYPFSHSE-HNNXBMFYSA-N 312.417 2.441 10 40 DECB COc1ccc(N2CCN([C@@H](C)c3nnc(C)o3)CC2)cc1 71819419 GYVMPQPTANVZQA-LBPRGKRZSA-N 302.378 2.270 10 40 DECB CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NCCO 100423190 WQUWKAZIUUCGJH-PTNGSMBKSA-N 305.353 2.184 10 40 DECB CC1(C)C[C@@H]1C(=O)Nc1ccc(O)c(CN2CCOCC2)c1 151843022 LLEDAWLGNXVEKT-CQSZACIVSA-N 304.390 2.209 10 40 DECB CC1=C2[C@H](CCS2(=O)=O)[C@H]2C(=O)c3ccccc3C(=O)[C@H]2C1 504629723 UVXXXOSBZCSZQB-HZSPNIEDSA-N 316.378 2.410 10 40 DECB biogenic COc1cc(N2CCN[C@H]3CCCC[C@@H]32)cc(OC)c1OC 225714024 KBZCKJLNPPQHBR-KBPBESRZSA-N 306.406 2.433 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3cccc(O)c3)S2)CC1 19841925 QOOMGBURMIJYSP-KAMYIIQDSA-N 317.414 2.000 10 40 DECB NC(=O)[C@H]1CCCN(c2ccc(CNCc3cccnc3)cc2)C1 54179194 MTMBPNQFEVKYJI-KRWDZBQOSA-N 324.428 2.073 10 40 DECB CCOc1ccccc1N1C(=O)N=C(O)/C(=C/NC2CC2)C1=O 103225902 PLENWQRYEUJDDA-LUAWRHEFSA-N 315.329 2.144 10 40 DECB CCN1CCN(C2=NC(=O)/C(=C/c3ccccc3O)S2)CC1 19841929 MXVGPIGMEBUHIA-KAMYIIQDSA-N 317.414 2.000 10 40 DECB CCCN/C(C)=C1\C(=O)N(c2ccccc2)N=C1CC(=O)OC 17053257 GJYOQKUNHGPOPE-VBKFSLOCSA-N 315.373 2.226 10 40 DECB Cc1c(N)cc(N)c(/N=N/c2ccc(S(=O)(=O)O)cc2)c1N 5336550 ANIVSKARSHPNHO-ISLYRVAYSA-N 321.362 2.404 10 40 DECB COC(=O)c1c(C)oc2ccc(O)c(CN3CCOCC3)c12 19793994 JYGKEBQBPFRIKB-UHFFFAOYSA-N 305.330 2.066 10 40 DECB Cc1cc(C(=O)C(=O)O)c(C)n1-c1ccc2snnc2c1 4054630 XLBZPCCAZQOLIK-UHFFFAOYSA-N 301.327 2.366 10 40 DECB CNC(=O)/C(=C\c1ccc(N(C)C)cc1)NC(=O)c1ccccc1 4601159 MIJILFNTGRHNCB-GHRIWEEISA-N 323.396 2.270 10 40 DECB COC(=O)CCCN1C(=O)/C(=C/c2cccnc2)SC1=S 40888575 JDKMXFGZVACNQI-FLIBITNWSA-N 322.411 2.236 10 40 DECB O=C(O)C1=C[C@H](c2c(O)ccc3ccccc23)n2ncnc2N1 102243693 ABBGUAHUKUQAFQ-GFCCVEGCSA-N 308.297 2.120 10 40 DECB COC(=O)C1=C2CCCCCN2c2ccccc2S1(=O)=O 67172879 HHPIUOPDDFEXGK-UHFFFAOYSA-N 307.371 2.239 10 40 DECB COc1ccc(OC)c([C@@H]2NCCc3cc(O)c(O)cc32)c1 3727897 PUSFFDXPAONMDW-QGZVFWFLSA-N 301.342 2.350 10 40 DECB COc1ccccc1NS(=O)(=O)c1cccc2nonc12 13322595 BHLMQLDELYJQOH-UHFFFAOYSA-N 305.315 2.032 10 40 DECB CC1=NNC(=O)/C1=C/c1c(C)nn(-c2ccc(Cl)cc2)c1O 5276852 FLQKROPFSXNURY-KPKJPENVSA-N 316.748 2.429 10 40 DECB COCCOc1sc(C(=O)OC)c(O)c1Br 96511006 LGDWRBXEBUCKOB-UHFFFAOYSA-N 311.153 2.028 10 40 DECB O=c1c2ccccc2nc(/C=C/c2cccnc2)n1CCCO 3999608 BRAGKUJDIGCWQP-CMDGGOBGSA-N 307.353 2.344 10 40 DECB biogenic CCCN(Cc1ccccc1O)C(=O)CNC(=O)C1CCCC1 69419177 UIAXSDIKMQBZRH-UHFFFAOYSA-N 318.417 2.437 10 40 DECB COc1ccc(N(Cc2ccc(N)cc2)S(C)(=O)=O)cc1 225403462 ATIIACNHIMLILB-UHFFFAOYSA-N 306.387 2.244 10 40 DECB CC[C@@H](C)N1C(=O)/C(=C\Nc2ccccc2N)C(=O)N=C1S 103116484 QSWWUPNIJUNXPC-URLRMUCDSA-N 318.402 2.018 10 40 DECB CCOC(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 4593698 GHSLEXGHRNCVRA-CSKARUKUSA-N 311.384 2.434 10 40 DECB Cn1c(-c2ccc(O)c(O)c2)c(O)c(=O)c2ccc(F)cc21 72194246 CVRIRXXIRXCNJM-UHFFFAOYSA-N 301.273 2.461 10 40 DECB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\N[C@@H](C)C(=O)O 19201733 FHIBZFFQXHUEPQ-PPLKPFPSSA-N 307.737 2.009 10 40 DECB O=C(O)CCCN1C(=O)/C(=C/c2cccnc2)SC1=S 967133 OLKBAHLYXLYVPC-YFHOEESVSA-N 308.384 2.148 10 40 DECB Cc1cc(CNC(=O)CN(C)[C@@H]2CCSC2)ccc1N(C)C 97230257 KDHSCZJJWRQFAY-OAHLLOKOSA-N 321.490 2.115 10 40 DECB Cc1nn(-c2ccc(C(=O)O)cc2)c2c1C(=O)C(=O)C(C)(C)C2 26919689 NHQPCVMYFGNPMQ-UHFFFAOYSA-N 312.325 2.213 10 40 DECB CCN(CC)C(=O)C1CCN(Cc2cccc(OC)c2O)CC1 785863 UGRQZMNNXWLZJJ-UHFFFAOYSA-N 320.433 2.481 10 40 DECB O=C(NCc1ccccc1O)C(=O)Nc1cnc2ccccc2c1 71849863 QGVZAQAXBYIKDY-UHFFFAOYSA-N 321.336 2.195 10 40 DECB O=C(NCCc1ccc(O)c(O)c1)Nc1cccc([N+](=O)[O-])c1 72285616 MZAALJODQOUBJB-UHFFFAOYSA-N 317.301 2.370 10 40 DECB COc1ccc2c(c1)CCN2[C@H]1CCN(CC(F)(F)F)C1=O 95395030 FJSLNGYZZHJKNW-ZDUSSCGKSA-N 314.307 2.221 10 40 DECB COC(=O)CNC(=O)c1cc(C)n(-c2ccccc2OC)c1C 95476012 JETGTVISMQWTJU-UHFFFAOYSA-N 316.357 2.006 10 40 DECB CCCC[N+]1=C2SCCCN2C[C@]1(O)c1ccc(OC)cc1 3280986 IREHVHSBJLUJJX-KRWDZBQOSA-N 321.466 2.461 10 40 DECB Cc1ccc(CNC(=O)c2ccc(O)c(O)c2)c(N(C)C)c1 97235038 YCQDRRCQQVZCHF-UHFFFAOYSA-N 300.358 2.402 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2ccncc2)SC1=S 1856696 VRGPCICABMEWHR-ZJRUKIMVSA-N 322.411 2.392 10 40 DECB O=C1/C(=C/C2=Cc3ccccc3OC2)SC(=S)N1CCO 16904929 CQNVIDYCAVAYOG-JYRVWZFOSA-N 319.407 2.199 10 40 DECB Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)o1 13371870 PNCNVDQFUZRLCP-MDWZMJQESA-N 314.272 2.394 10 40 DECB COc1cc2c(cc1OC)[C@H](c1ccc(O)c(O)c1)CNC2 24717641 RQKOOXXZCUXSQS-ZDUSSCGKSA-N 301.342 2.350 10 40 DECB C[C@@]1(CCC(=O)O)C(=O)C(=O)C[C@@H]2[C@@H]3CC[C@H](O)[C@]3(C)CC[C@H]21 5029302 ISJZFODWNJRYCF-DJCAMSMUSA-N 322.401 2.203 10 40 DECB [N-]=[N+]=NCC(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2 102575577 LHGFQSHCZRMFMI-UHFFFAOYSA-N 300.318 2.323 10 40 DECB O=C(O)c1cc(O)c(O)c2c1CN(Cc1ccccc1)CO2 1679789 HVQVNOMFZASRIY-UHFFFAOYSA-N 301.298 2.148 10 40 DECB CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 1805085 DLJAWAOAHJQVKI-LKJZUNMESA-N 308.384 2.146 10 40 DECB Cc1ccc(C(=O)NCCCc2c(C)noc2C)c(O)c1O 97059723 BFNYYBBWHSMCAX-UHFFFAOYSA-N 304.346 2.374 10 40 DECB Nc1ccc(N2CCN(C(=O)C(Cl)(Cl)Cl)CC2)cc1 70461921 MJDMTAHDPNDXAB-UHFFFAOYSA-N 322.623 2.288 10 40 DECB O=C(NCc1ccccc1O)c1ccc(-c2ccco2)[nH]c1=O 84504894 JKBYWHHBONRLAT-UHFFFAOYSA-N 310.309 2.271 10 40 DECB CCOc1ccc(NC2=NC(=O)/C(=C\C(=O)OC)S2)cc1 4561644 QOIXWKKWHNDLIW-DHZHZOJOSA-N 306.343 2.184 10 40 DECB CC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 6428171 YNMQELQNGMXRFP-UHFFFAOYSA-N 308.289 2.208 10 40 DECB CCOC(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 34235411 YGUWRFUPGXSHNX-CYBMUJFWSA-N 308.378 2.268 10 40 DECB COCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 9189386 GZZNJWWRPUTLEY-FLIBITNWSA-N 324.383 2.442 10 40 DECB Cc1nn(C)c(C)c1CC(=O)NCc1ccc(N(C)C)c(F)c1 69367446 GPJHTANZFYCXIA-UHFFFAOYSA-N 318.396 2.101 10 40 DECB CCN1C(=O)/C(=C\c2cccc(OCC(=O)O)c2)SC1=S 5201089 GOQDEJWEFJREDF-YRNVUSSQSA-N 323.395 2.371 10 40 DECB Cc1cc(CNCc2ccc(N3CCOCC3)c(F)c2)on1 78553079 SBGWIAALWDSHPR-UHFFFAOYSA-N 305.353 2.249 10 40 DECB C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(C=O)cc2)SC1=S 5375004 YTTSECPNJVLURM-OITNDJBGSA-N 321.379 2.173 10 40 DECB CCCOC(=O)CN1C(=O)/C(=C/c2ccco2)SC1=S 1809440 WFRGNDZPESEOGH-YFHOEESVSA-N 311.384 2.434 10 40 DECB COc1ccccc1/C=C1\C(=O)NC(=O)N(C2CCCC2)C1=O 4992963 SWTPRIPVXZPABC-JLHYYAGUSA-N 314.341 2.100 10 40 DECB COc1cc(N[C@@H](C)c2ccc(N3CCOCC3)cc2)ncn1 65393885 VOTHFZCTIFUXEY-ZDUSSCGKSA-N 314.389 2.495 10 40 DECB CN1C(=O)N/C(=C/c2ccc(N3CCCCC3)c(F)c2)C1=O 409191680 KPGCJQXMJYCXBS-JLHYYAGUSA-N 303.337 2.339 10 40 DECB Cc1cc(C)n2ncc(C(=O)N(C)Cc3ccccc3O)c2n1 36390988 YXTHZVHPGLASRT-UHFFFAOYSA-N 310.357 2.324 10 40 DECB CC[C@H](N/C=C1/C(=O)N(c2ccc(C)c(C)c2)N=C1C)C(=O)O 19143470 PYFYJWOIQJWQMC-HNRFISLBSA-N 315.373 2.363 10 40 DECB CC1(C)[C@@]2(C(=O)NCc3ccc(F)cc3)CC[C@@]1(C)C(=O)C2=O 100260042 DZULUWDRKKFMHB-ROUUACIJSA-N 317.360 2.406 10 40 DECB CN1C(=O)[C@@]2(NN=C(c3ccccc3O)S2)c2ccccc21 341794 MKCMWNNDSGMHED-MRXNPFEDSA-N 311.366 2.220 10 40 DECB CCC[C@H](C)NC(=O)CN1CCN(c2ccc(OC)cc2)CC1 39561419 CUQYCLJGOCDMKX-HNNXBMFYSA-N 319.449 2.122 10 40 DECB CS(=O)(=O)N1N=C(c2ccccc2O)C[C@H]1c1ccco1 19815974 JQZZGAJZFHFZMR-LBPRGKRZSA-N 306.343 2.096 10 40 DECB Cc1nn(-c2ccccc2)c(O)c1/N=N/c1nnc(C(=O)O)[nH]1 96478244 YSBXKLAGNUUQJC-BMRADRMJSA-N 313.277 2.118 10 40 DECB CC(C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 9420693 CCURTYISGQJEOS-UHFFFAOYSA-N 322.364 2.399 10 40 DECB COCC1=NNC(=O)/C1=C/Nc1ccc(OC(F)(F)F)cc1 100375009 DISUEQCPNSSBIA-UXBLZVDNSA-N 315.251 2.013 10 40 DECB COC(=O)/C=C1/SC(c2nc3ccccc3nc2C)=NC1=O 16265141 DYTIOYVMJJCPKB-YRNVUSSQSA-N 313.338 2.015 10 40 DECB Cc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc(C)c1O 6233170 ZUKJOKHPIQXAAO-BJMVGYQFSA-N 323.395 2.295 10 40 DECB Cc1nnc(NC(=O)NCc2ccc(N(C)C)c(F)c2)s1 58515035 KQCDCVIECPDSAV-UHFFFAOYSA-N 309.370 2.373 10 40 DECB CC1=CN2C(=N)/C(=C/c3ccc([N+](=O)[O-])o3)C(=O)N=C2S1 4486885 RHGZIEVNZCTKMH-JGZRYLGSSA-N 304.287 2.355 10 40 DECB O=C(CSc1ncccc1C(=O)O)c1ccc(O)c(O)c1 8716966 CUODTAWCYUYGQR-UHFFFAOYSA-N 305.311 2.166 10 40 DECB CN(Cc1cc(Cl)cc(Cl)c1O)CN1C(=O)CCC1=O 31659452 VFNCBKYMKCKHHT-UHFFFAOYSA-N 317.172 2.237 10 40 DECB CN1C(=O)/C(=C/c2coc3ccc(O)cc3c2=O)SC1=S 2357442 ABPXOFUKBSBSGA-WCIBSUBMSA-N 319.363 2.330 10 40 DECB O=C1OC2(CCCC2)OC(=O)C1=Cc1ccc(O)c([N+](=O)[O-])c1 58866131 LLXNYOBQVPRBHS-UHFFFAOYSA-N 319.269 2.054 10 40 DECB CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc1 6541850 IJPKREMCYLZVEL-YWEFTTLKSA-N 318.398 2.120 10 40 DECB COC1(NC(=O)c2ccc(C)cc2)C(=O)c2ccccc2C1=O 226297944 LEMPNWSHSDELLR-UHFFFAOYSA-N 309.321 2.147 10 40 DECB CN(C)C(=O)[C@@H]1CC[C@@H](N=[N+]=[N-])[C@H](NC(=O)OC(C)(C)C)C1 299754549 LVJZCKRMMBTVNC-GMTAPVOTSA-N 311.386 2.447 10 40 DECB CC(=O)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 5383003 SVBXBQVRWTXNMF-UHFFFAOYSA-N 307.305 2.380 10 40 DECB N=C1/C(=C\c2ccco2)C(=O)N=C2SC(C(F)(F)F)=NN12 507643 HGRXOGALGDRSAM-IYHDPICYSA-N 314.248 2.461 10 40 DECB O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccco1 408912311 QHVBWAUVWNVMRZ-XYOKQWHBSA-N 300.245 2.085 10 40 DECB Cc1ccc(N2NC(=O)/C(=C/c3ccc(O)cc3)C2=O)cc1C 4997334 TYKCJFNBZINZHH-YBEGLDIGSA-N 308.337 2.470 10 40 DECB CC[C@H](C)Oc1ccccc1C=C1C(=O)N(C)C(=O)N(C)C1=O 408602960 PGYWUKPINWNUJN-NSHDSACASA-N 316.357 2.298 10 40 DECB CCOC(=O)c1ccc(/N=N/N2CCC[C@@H]2C(=O)NC)cc1 1409770 XWEHTDDTNBUTHF-OYLHUBKDSA-N 304.350 2.072 10 40 DECB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccnc1 24192795 VSQKNRHJJPZJTD-UHFFFAOYSA-N 311.385 2.190 10 40 DECB CCN(CC)c1ccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc1 102243576 RQEFXSQIDZCFBF-AWEZNQCLSA-N 313.361 2.108 10 40 DECB CC[C@@H](C)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 95433471 CRLKRCVKMJCSKE-CQSZACIVSA-N 306.406 2.159 10 40 DECB O=C1N=C(N2CCOCC2)S/C1=C\c1c[nH]c2ccccc12 19707918 GUPLQUHBDPWQOU-ZROIWOOFSA-N 313.382 2.470 10 40 DECB C[C@H](NN)c1cc(Br)cc(Br)c1O 199536003 RBPKKZYEEJHBPV-BYPYZUCNSA-N 309.989 2.442 10 40 DECB COc1ccc(/C=C2\SC(N3CCCC3)=NC2=O)cc1O 12371154 OODPHHWFEXAVTQ-LCYFTJDESA-N 304.371 2.467 10 40 DECB COc1cc(-c2oc3cc(O)c(O)cc3c(=O)c2O)ccc1O 21992187 KQBHOMRPRBEQFF-UHFFFAOYSA-N 316.265 2.291 10 40 DECB CCN1C(=O)C(=Cc2ccc(C)s2)C(=O)N(CC)C1=S 503641 ZCYWVVSMXSXIQA-UHFFFAOYSA-N 308.428 2.435 10 40 DECB O=C(O)CCN1C(=O)/C(=C/c2ccccc2O)SC1=S 3191944 HCAYBQDLEZXPGK-YFHOEESVSA-N 309.368 2.068 10 40 DECB O=C1NN=C(C(F)(F)F)[C@H]1/N=N/c1cccc([N+](=O)[O-])c1 100235337 HYNAGEZLFXNCHE-VWUPPOFCSA-N 301.184 2.095 10 40 DECB COc1ccc(CC2=[N+](C)CCc3cc(O)c(O)cc32)cc1O 1559572 LXAJUXGUPZXGAK-UHFFFAOYSA-O 314.361 2.042 10 40 DECB C#CCOc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 34713524 IWEVEMNNNUNBLK-LGMDPLHJSA-N 318.332 2.160 10 40 DECB COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1O 898959 QWUHUBDKQQPMQG-UHFFFAOYSA-N 316.265 2.291 10 40 DECB endogenous,in-man O=C1CSC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 5203306 ZIFOQLMUVLPGEM-UHFFFAOYSA-N 310.444 2.094 10 40 DECB O=C(Cc1ccc(F)cc1F)NCCc1ccc(O)c(O)c1 95446615 QJRGOFONOANPHS-UHFFFAOYSA-N 307.296 2.277 10 40 DECB CC(CO)(CO)Nc1ccc2noc3c2c1C(=O)c1ccccc1-3 542899 RODAVGRGKSXLBC-UHFFFAOYSA-N 324.336 2.194 10 40 DECB CCN1C(=O)/C(=C\c2cccc(OC)c2)C(C(=O)OC)=C1C 59435694 MZIFCVATPNCFFB-UVTDQMKNSA-N 301.342 2.388 10 40 DECB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/N1CCOCC1 101150144 XWLXHYRKDTVNSW-GXDHUFHOSA-N 305.765 2.279 10 40 DECB CC[C@H](OC1CCCCC1)C(=O)NN1C(=O)CSC1=S 95942114 LSYJMDMRIUVXMH-JTQLQIEISA-N 316.448 2.006 10 40 DECB Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(C)n1C 408784239 PQUIYJKYXMSFPL-XNTDXEJSSA-N 323.352 2.308 10 40 DECB CN1CCc2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc21 97373591 FRJPLPUCDQMWPF-UHFFFAOYSA-N 312.369 2.063 10 40 DECB CN(C)c1ccc(/C=C2\C(=O)NC(=O)N(C(C)(C)C)C2=O)cc1 492491 ZSBQIKGHBSJVEE-JLHYYAGUSA-N 315.373 2.013 10 40 DECB Cc1cc(O)c(CN2CCC(C(=O)NC3CC3)CC2)cc1C 58267505 NMZHRRPBBZFAGO-UHFFFAOYSA-N 302.418 2.500 10 40 DECB COc1ccc(CCN2C(=O)[C@@H](C)SC2=S)cc1OC 3615842 VJCUUIJOMOFSRV-SECBINFHSA-N 311.428 2.495 10 40 DECB CCOc1cc(/C=C2\C(=O)N(C)C(C)=C2C(=O)OC)ccc1O 408893968 PEFUZYOOPVWXDT-WQLSENKSSA-N 317.341 2.093 10 40 DECB Cc1ccc(N2NC(=O)/C(=C\c3ccccc3O)C2=O)cc1C 437488 GFENLIQQGWVUGL-XNTDXEJSSA-N 308.337 2.470 10 40 DECB CNc1cc([C@@H]2CN(c3ccc(OC)cc3)CCO2)nc(C)n1 72387799 GSSOZNQUAKNCQM-INIZCTEOSA-N 314.389 2.413 10 40 DECB CN(C)c1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1 344611 RZLJWBWOUSOSJL-FOWTUZBSSA-N 307.353 2.214 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc[nH]2)SC1=S 5374597 BWMXWQYIHRPZIZ-ABRRARGCSA-N 310.400 2.325 10 40 DECB O=C(O)/C=C\c1c2ccc(=O)c(O)c-2oc2c(O)c(O)ccc12 13099304 HVUVBNCTBKJHHZ-UTCJRWHESA-N 314.249 2.112 10 40 DECB in-vitro Cc1ccsc1/C=C1\C(=O)NC(=O)N(c2ccncc2)C1=O 409389855 CMERTLMRQOYPTH-DHZHZOJOSA-N 313.338 2.118 10 40 DECB COc1ccc(N2CCN(C(=O)N3CCCCC3)CC2)cc1 8714458 WCQTYQGBSMUBHD-UHFFFAOYSA-N 303.406 2.423 10 40 DECB CN1C(=O)C(=CNc2ccc3ccccc3c2)C(=O)N(C)C1=O 123780652 KOWXYMKEWBPQOP-UHFFFAOYSA-N 309.325 2.186 10 40 DECB CC1=C2[C@H](CCS2(=O)=O)[C@H]2C(=O)c3ccccc3C(=O)[C@@H]2C1 104305774 UVXXXOSBZCSZQB-MGPQQGTHSA-N 316.378 2.410 10 40 DECB O=C(COC(=O)c1cc(O)cs1)NCCc1ccc(F)cc1 69594180 KCIQFQQOSJVVLH-UHFFFAOYSA-N 323.345 2.109 10 40 DECB Cc1cc(CNC(=O)CCCC(=O)NC(C)C)ccc1N(C)C 79001682 XJHMDHKOIMVBNR-UHFFFAOYSA-N 319.449 2.372 10 40 DECB COCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 96431776 JDEXJEJYGUSQEZ-NSHDSACASA-N 314.332 2.019 10 40 DECB Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 55522264 BRKFRSHUTWWHEM-UHFFFAOYSA-N 318.348 2.494 10 40 DECB CN1CCc2cc(O)c(O)cc2[C@@H]1Cc1ccc(O)c(O)c1 56410 VHRSWCTVFBWHKE-ZDUSSCGKSA-N 301.342 2.281 10 40 DECB biogenic,in-vitro Cc1ccccc1/C=C1\C(=O)NC(=O)N(Cc2ccco2)C1=O 409372208 JLPNIAZNPPURTB-NTEUORMPSA-N 310.309 2.250 10 40 DECB O=C(NCCc1ccc(O)c(O)c1)Nc1ccc2c(c1)CCO2 79067902 MRFMNMYTHBRPEK-UHFFFAOYSA-N 314.341 2.397 10 40 DECB COc1ccc2cc(C=C3C(=O)N(C)C(=O)N(C)C3=O)ccc2c1 12750601 KVTYFVDZCPFTEB-UHFFFAOYSA-N 324.336 2.282 10 40 DECB Cc1cc(C)c(C=C2C(=O)N(C)C(=S)N(C)C2=O)c(C)c1 59139691 ICASYLDLMPAMNO-UHFFFAOYSA-N 302.399 2.211 10 40 DECB CCN1C(=O)/C(=C\c2cnn(-c3ccccc3)n2)SC1=S 14245371 VPXVTVKHNHPIIX-XYOKQWHBSA-N 316.411 2.488 10 40 DECB O=C1N=C(S)N(CCC2=CCCCC2)C(=O)/C1=C\NC1CC1 103114127 DSMCYKKUEROSMZ-RAXLEYEMSA-N 319.430 2.167 10 40 DECB O=C1/C(=C\c2cccc(F)c2)SC(=S)N1N1CCOCC1 2205908 MLQMKIJFYDHASV-FMIVXFBMSA-N 324.402 2.274 10 40 DECB CCn1cccc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2)C1=O 408931249 IYIOKSNZDLUBPE-RVDMUPIBSA-N 323.352 2.483 10 40 DECB Cn1nc(CNCc2ccc(O)cc2O)cc1C(F)(F)F 256054620 XAVHXBNMXKLMIP-UHFFFAOYSA-N 301.268 2.140 10 40 DECB Cc1cccc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)c1 409371002 CGKRZHSHAJDKGQ-NTEUORMPSA-N 310.309 2.250 10 40 DECB Cc1c(Cl)cccc1NC(=O)C[C@H]1SC(=S)NC1=O 34926780 REVJUYPUAWWLJH-SECBINFHSA-N 314.819 2.494 10 40 DECB COC(=O)CN1C(=O)/C(=C/c2sccc2C)SC1=S 1238557 PUFOOHMCUGQYKW-UITAMQMPSA-N 313.425 2.431 10 40 DECB COc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1O 4501855 WSXQYYLXUBNKPD-UHFFFAOYSA-N 304.298 2.155 10 40 DECB O=C(CN1CCSC1=O)NCc1ccc(N2CCCC2)cc1 40514252 CAGUCRSRNPDRRK-UHFFFAOYSA-N 319.430 2.072 10 40 DECB COc1ccc(OC)c([C@H]2NCCc3cc(O)c(O)cc32)c1 3727898 PUSFFDXPAONMDW-KRWDZBQOSA-N 301.342 2.350 10 40 DECB O=C1NCCCC[C@@H]1NCc1cc(Cl)cc(Cl)c1O 36977299 QATZZPFQEUBNRL-NSHDSACASA-N 303.189 2.457 10 40 DECB Cc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)c(=O)[nH]1 75118668 JHEJCMNNMBYEQT-UHFFFAOYSA-N 311.385 2.214 10 40 DECB CC(=O)Oc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)cc1 58866172 XITGKGYZGWDXTA-UHFFFAOYSA-N 316.309 2.366 10 40 DECB Cn1cc([C@H]2OCC[C@H]2CNCc2ccc3c(c2)CCO3)cn1 89755308 WBAQSRNLYPCBRO-YJBOKZPZSA-N 313.401 2.222 10 40 DECB CCCc1cc(=O)oc2c(CNCCC(=O)O)c(O)ccc12 35686310 LOERYZYCNMBUJE-UHFFFAOYSA-N 305.330 2.015 10 40 DECB CNC(=O)N[C@@H](c1ccc(F)cc1)c1cc2c(cc1O)OCO2 6378854 RMLIHUMSCWMAFD-HNNXBMFYSA-N 318.304 2.278 10 40 DECB CO/C=C1/SC(=S)N(c2ccc(NC(C)=O)cc2)C1=O 17125963 SAKPORDJRLFASA-YRNVUSSQSA-N 308.384 2.498 10 40 DECB O=C1CN(c2ccc(CNc3nc4ccccc4o3)cc2)CCN1 42110633 FLGAPTRWNGELBJ-UHFFFAOYSA-N 322.368 2.376 10 40 DECB CNC(=O)COC(=O)c1cc(C)n(-c2ccccc2C)c1C 4270288 LPRPLBWLLZPMDZ-UHFFFAOYSA-N 300.358 2.305 10 40 DECB CCC[C@@H]1C(=O)N2C(N(C)C)=Nc3ccc(C)cc3N2C1=O 2019585 MPHPHYZQRGLTBO-NSHDSACASA-N 300.362 2.064 10 40 DECB biogenic,world COc1ccc2nc3ccccc3c(NCCNCCO)c2c1 4428562 IZEJFFXRAQGQFA-UHFFFAOYSA-N 311.385 2.390 10 40 DECB CCc1oc2ccccc2c1C=C1C(=O)N(C)C(=O)N(C)C1=O 18909621 GGLPNCARTAAGTJ-UHFFFAOYSA-N 312.325 2.429 10 40 DECB O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccoc1 37485 UGUGTEYIZVDUAP-KPKJPENVSA-N 316.313 2.250 10 40 DECB COc1ccc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)cc1 12504549 RBFAZZXBOAKXHR-FLIBITNWSA-N 323.395 2.371 10 40 DECB CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccccn1 16134401 UVSJRXVUIGOBJF-UHFFFAOYSA-N 311.385 2.190 10 40 DECB COC(=O)C1=C(C)N(C(C)C)C(=O)/C1=C\c1ccccc1O 59959473 ICAYRXVRIXGGGN-LCYFTJDESA-N 301.342 2.473 10 40 DECB O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(F)cc1 1225837 DFSXHVPQRYCHCW-GXDHUFHOSA-N 310.284 2.492 10 40 DECB CCN1C(=O)C(=CNCC2CCCCC2)C(=O)N(CC)C1=S 8484601 WGHWIMALMVCIFE-UHFFFAOYSA-N 323.462 2.036 10 40 DECB O=C(C[C@H]1SC(=S)NC1=O)Nc1ccc2[nH]ccc2c1 34926910 QMDLQMQGVJDLLC-SNVBAGLBSA-N 305.384 2.013 10 40 DECB COc1ccc(N2CCN(C(=O)C(C)(C)C)CC2)c([N+](=O)[O-])c1 6186684 GTHZODBBOZTOMC-UHFFFAOYSA-N 321.377 2.298 10 40 DECB Cc1ccc(N2NC(=O)/C(=C\c3ccc(O)cc3O)C2=O)cc1C 59475175 KXRLRZFUFASHIV-OVCLIPMQSA-N 324.336 2.176 10 40 DECB CC1(C)[C@]2(C)CC[C@@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 28580588 DZULUWDRKKFMHB-MSOLQXFVSA-N 317.360 2.406 10 40 DECB O=C(NC1=NN(c2ccccc2)C(=O)C1)c1ccc([N+](=O)[O-])cc1 13955069 MWNACDYXGZOUAX-UHFFFAOYSA-N 324.296 2.075 10 40 DECB COc1ccc(N2CCN(Cc3noc(C4CC4)n3)CC2)cc1 53602561 DSTHNHWTFKIEAR-UHFFFAOYSA-N 314.389 2.278 10 40 DECB CC(C)c1nnc2n1C[C@H](NCc1ccc3c(c1)CCO3)CC2 65473739 VORQUCYYPFSHSE-OAHLLOKOSA-N 312.417 2.441 10 40 DECB Cc1cc(O)c(CN(C)[C@H]2CCS(=O)(=O)C2)cc1C(C)C 27165316 XLVUJEQMBRKVAJ-AWEZNQCLSA-N 311.447 2.443 10 40 DECB CC(C)CC(=O)NN1C(=O)/C(=C/c2cccn2C)SC1=S 5552647 MSPGATHPXUMKRY-FLIBITNWSA-N 323.443 2.304 10 40 DECB Cn1c(=O)cc2c3c(c(NCCO)ccc31)C(=O)c1ccccc1-2 1803022 ZVCXJUSEEODMTI-UHFFFAOYSA-N 320.348 2.154 10 40 DECB CCC12CN3CC(CC)(CN(C1)C3c1ccc(O)cc1O)C2=O 19323127 RTMVIRVYQKFXPB-UHFFFAOYSA-N 316.401 2.103 10 40 DECB biogenic CCCCCN1C(=O)/C(=C/N2CCOCC2)SC1=S 35485328 XGGBEOQMGPYQFM-KHPPLWFESA-N 300.449 2.211 10 40 DECB Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(O)cc3)C2=O)cc1 179637 GYUSCFXBCDVVCO-XNTDXEJSSA-N 322.320 2.367 10 40 DECB CCN(C)c1ccc(CNC(=O)Cc2cc(C)on2)cc1F 81365471 KCQOSBUJIHOPBN-UHFFFAOYSA-N 305.353 2.437 10 40 DECB CC(C)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccn(C)c2)SC1=S 5373966 KKZSENKQLYBNIV-CDCCAWJDSA-N 324.427 2.336 10 40 DECB O=C(O)[C@@H]1Nc2c(O)cc(Cl)c([N+](=O)[O-])c2[C@@H]2C=CC[C@@H]12 4539522 WGUAPOVFDKLQGB-OXOINMOOSA-N 310.693 2.492 10 40 DECB biogenic,in-vitro COC(=O)CCN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 5719870 YTGVJFATXPTHNX-DHZHZOJOSA-N 323.395 2.157 10 40 DECB CC[C@H](C(=O)O)N1C(=O)/C(=C/c2cccn2C)SC1=S 2437066 XTGUPMZDWXYAEP-SBMLRHLQSA-N 310.400 2.090 10 40 DECB COCCS(=O)(=O)Nc1ccccc1C(=O)c1ccccc1 192628819 KKUFVWQVBADILV-UHFFFAOYSA-N 319.382 2.306 10 40 DECB COc1ccc2c(c1)CCN2[C@@H]1CCN(CC(F)(F)F)C1=O 95395029 FJSLNGYZZHJKNW-CYBMUJFWSA-N 314.307 2.221 10 40 DECB CNC(=O)NC1CCN(c2ccc(OC(F)(F)F)cc2)CC1 66349828 PHGJDOKXGIGIEM-UHFFFAOYSA-N 317.311 2.483 10 40 DECB O=c1[nH]c2ccccc2c(=O)n1Cc1ccc(N2CCCC2)cc1 32929986 NKYJJYJPUPLJMM-UHFFFAOYSA-N 321.380 2.338 10 40 DECB O=C(O)[C@@H]1Nc2c(O)cc(Cl)c([N+](=O)[O-])c2[C@H]2C=CC[C@H]21 84465 WGUAPOVFDKLQGB-BAJZRUMYSA-N 310.693 2.492 10 40 DECB biogenic,in-vitro COc1ccc([C@H]2NCCc3cc(O)c(O)cc32)c(OC)c1 4724922 UQDIDFQFKYQBNN-QGZVFWFLSA-N 301.342 2.350 10 40 DECB CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1cnn(C)c1C 6674427 UVKYZQJMKZPWSE-OVCLIPMQSA-N 324.340 2.233 10 40 DECB CCNC(=O)COC(=O)c1cc(C)n(-c2ccccc2)c1C 3317900 MHEPFTDLZHRYOH-UHFFFAOYSA-N 300.358 2.387 10 40 DECB CN1CCCc2cc(CNC(=O)[C@H]3CC[C@H](CN)CC3)ccc21 100768860 IIKHLWJUMHZCLJ-FZNQNYSPSA-N 315.461 2.450 10 40 DECB COc1c(C=C2C(=O)N(C)C(=O)N(C)C2=O)ccc2ccccc12 75110276 AWKLZQHXLQBFHX-UHFFFAOYSA-N 324.336 2.282 10 40 DECB COc1ccc(/C=C2/SC(=S)N(CCC(=O)O)C2=O)cc1 966828 RBFAZZXBOAKXHR-DHZHZOJOSA-N 323.395 2.371 10 40 DECB CC1(C)[C@@H]2CC[C@]1(C(=O)NCc1ccc(F)cc1)C(=O)C2=O 100261952 RCPAVDBASIFGAJ-SJKOYZFVSA-N 303.333 2.016 10 40 DECB CCOc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 14256124 WZTBLSGLOCVKDP-UHFFFAOYSA-N 319.342 2.422 10 40 DECB COc1ccc(-c2ccc(CCC(=O)O)n2CC(=O)O)cc1 339393 CZSPARFVMBPFLL-UHFFFAOYSA-N 303.314 2.266 10 40 DECB