smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccco1 161093065 QTKUCEQYSIPTIF-AGIUHOORSA-N 236.359 2.803 70 20 BFID CC[C@H](NCC(C)C)c1ccc(F)cn1 161304369 BIEBRZVRRDWQKY-NSHDSACASA-N 210.296 2.917 70 20 BFID C[C@H]1CCC[C@H](CNc2ncccn2)C1 217921804 GNRMXCOEERZJLE-QWRGUYRKSA-N 205.305 2.715 70 20 BFID CCN(CCCN1CCCCC1)C(C)C 160649351 BXNWIBLMADSQFL-UHFFFAOYSA-N 212.381 2.593 70 20 BFID CCC1(C(=O)NC2CC=CC2)CCCC1 160882271 GIUPWKBEXORHAQ-UHFFFAOYSA-N 207.317 2.792 70 20 BFID C[C@H]1CC[C@H](CC(=O)Nc2cccc(F)n2)C1 160915210 JBBAAENNWSGUOW-UWVGGRQHSA-N 236.290 2.986 70 20 BFID CN(CC[C@H]1CCCN1C)CC1CCCC1 161503303 HYWLOVNEYDUYGI-CQSZACIVSA-N 224.392 2.593 70 20 BFID CC[C@H](COC)NCCc1cc(C)cc(C)c1 159508476 HEIVOJRZMQMKHA-OAHLLOKOSA-N 235.371 2.861 70 20 BFID Cc1nccn1CC(=O)CCC1CCCC1 160485237 PUXAKSGBVASELY-UHFFFAOYSA-N 220.316 2.731 70 20 BFID Cc1ccccc1CN(C)Cc1c(C)n[nH]c1C 160529124 RIFIJSLSQVCBON-UHFFFAOYSA-N 243.354 2.967 70 20 BFID Cc1ccc(C[C@H](NCC(C)(C)O)C2CC2)cc1 160661463 UQVMOYFUEKVQGD-HNNXBMFYSA-N 247.382 2.677 70 20 BFID CC(C)CCN(C(=O)[C@H]1CCCCO1)C1CC1 160911271 SFSIRQZBAUWJFX-CYBMUJFWSA-N 239.359 2.593 70 20 BFID COC[C@H](NC[C@H]1CCc2ccccc21)C(C)C 160993057 YWMMHKAICHAUSK-ZBFHGGJFSA-N 247.382 2.977 70 20 BFID CCCCCNC(=O)C1(CCOCC)CCC1 161096794 IPINMOCWEUPDRG-UHFFFAOYSA-N 241.375 2.890 70 20 BFID CC[C@@H](C)OCC(=O)N(C)c1ccc(F)cc1 159650745 BCFUZHGBWYELKR-SNVBAGLBSA-N 239.290 2.604 70 20 BFID CC[C@@H](COC)NC[C@@H]1CCc2ccccc21 161000965 SBUZNEWLSZDZEE-KBPBESRZSA-N 233.355 2.731 70 20 BFID CCCCNC(=O)N1CCCC[C@@H](SC)C1 161123990 OIXOZQDNPIFQDO-LLVKDONJSA-N 244.404 2.714 70 20 BFID COc1cc(NCc2cccn2C)ccc1F 159927514 HXBFOBGBMGOOFC-UHFFFAOYSA-N 234.274 2.785 70 20 BFID Fc1cncc(CNCc2cccs2)c1 160124634 LCVKLRCLRDVEOO-UHFFFAOYSA-N 222.288 2.572 70 20 BFID C[C@H](SC[C@@H]1CCCO1)C(=O)OC(C)(C)C 217792038 JBYMPTGKNVFCJV-UWVGGRQHSA-N 246.372 2.629 70 20 BFID Cc1cccc([C@@H]2CCCN2CC2CC2)n1 159926067 YTJLZOVBPPMPMR-AWEZNQCLSA-N 216.328 2.937 70 20 BFID CCCCOC(=O)[C@@H](C)Sc1ccncc1 159973397 GUNLMYXEDXEKDC-SNVBAGLBSA-N 239.340 2.906 70 20 BFID CCC(N)(CC)CNC(=O)C[C@H](C)CC(C)C 160517297 XZJSFISROITQRL-GFCCVEGCSA-N 242.407 2.692 70 20 BFID CCc1ccc(CN2C[C@@H]3C[C@H]3C2)cc1 218063594 HSTGWVLGCSGJHA-KBPBESRZSA-N 201.313 2.701 70 20 BFID CCC(CC)CNC(=O)N(CC)C(C)C 160579678 PJNMDZPSAZAAQH-UHFFFAOYSA-N 214.353 2.863 70 20 BFID CC(C)[C@H](N[C@H]1CCC[C@H](N(C)C)C1)C1CC1 161125716 LMQVSIBZKREOBS-KKUMJFAQSA-N 238.419 2.883 70 20 BFID Cn1cc(C(=O)NC2CC=CC2)c2ccccc21 160873165 JHAFLYXCYYYJDK-UHFFFAOYSA-N 240.306 2.627 70 20 BFID CC[C@H]1CCCC[C@H]1N(C)C(=O)c1cnccn1 161147827 NBNVYIJJXIFFOF-WCQYABFASA-N 247.342 2.517 70 20 BFID CC(C)c1cccc(CS(=O)(=O)Cl)c1 216745479 WTPABKROFOGPAZ-UHFFFAOYSA-N 232.732 2.879 70 20 BFID CCc1ncnc(NCC(C)(C)C)c1F 217987744 HHNBIIMVNLKGBX-UHFFFAOYSA-N 211.284 2.636 70 20 BFID CN(CCc1nccs1)C(=O)OC(C)(C)C 159628233 DMXVFGUGZRKZCP-UHFFFAOYSA-N 242.344 2.553 70 20 BFID Cc1ccc(C)c(CN(C)C[C@H]2CCC[C@@H]2O)c1 159717636 VSSWYWSBSPDTQP-ZBFHGGJFSA-N 247.382 2.896 70 20 BFID CCOCCCN1CCC[C@H]1C1CCC1 160456528 WQADQMABYACJJB-ZDUSSCGKSA-N 211.349 2.678 70 20 BFID CS[C@H](C)CC(=O)Nc1nc(C)cs1 160244116 YSPLSOOAWHRNBU-SSDOTTSWSA-N 230.358 2.532 70 20 BFID C[C@@H](NC(=O)NC1(C)CCC1)c1cccc(O)c1 161198069 QJYYLCVNQCHQME-SNVBAGLBSA-N 248.326 2.695 70 20 BFID O=S(=O)(F)[C@H](c1ccccc1)C(F)(F)F 258256918 NACIWVOQEAQFDQ-SSDOTTSWSA-N 242.193 2.589 70 20 BFID CCC1(CC)[C@H](N[C@@H](C)CCOC)C[C@H]1OC 160110634 WXGRTSBZIJACFC-YNEHKIRRSA-N 243.391 2.595 70 20 BFID Cc1ccc([S@@](=O)Cc2nccs2)cc1 160629328 JVVFLBXFXMXYAQ-OAHLLOKOSA-N 237.349 2.759 70 20 BFID CN(Cc1cccn1C)C(=O)C1CCCCCC1 160392001 SDSFRDMNXIEYIF-UHFFFAOYSA-N 248.370 2.954 70 20 BFID CCCN(CCO)Cc1cc(C)c(C)cc1C 161192462 YVSKANBBOCRBOB-UHFFFAOYSA-N 235.371 2.816 70 20 BFID CCCCCC[C@H](C)S(=O)(=O)Cl 104533632 XXUMKDIHMSLPKL-QMMMGPOBSA-N 212.742 2.914 70 20 BFID Cc1cc(NC(=O)C2CCCCCC2)c[nH]c1=O 159550393 NWFLJJYYBOCKJU-UHFFFAOYSA-N 248.326 2.592 70 20 BFID CCCCO[C@@H](C)C(=O)N[C@@H]1CCC[C@@H]1CC 159589610 IPHRWSWJBWEBTP-RWMBFGLXSA-N 241.375 2.887 70 20 BFID CC[C@H](C)OCC(=O)N(C1CC1)[C@H](C)C(C)C 161014862 NBHVZMWKMSPLDY-NWDGAFQWSA-N 241.375 2.837 70 20 BFID Cc1nccn1CCCN(C)CC1CCCC1 161503170 QRTVYTXOZUPWJK-UHFFFAOYSA-N 235.375 2.704 70 20 BFID CC[C@H](COC)NC/C=C\c1ccccc1 217648603 MNYDGNUCGFTOHD-JKEYDSJLSA-N 219.328 2.714 70 20 BFID CC[C@H]1CN(C(=O)CCC(C)(C)C)C[C@@H](C)O1 159775550 DOXHTUFJDZJMMZ-NEPJUHHUSA-N 241.375 2.839 70 20 BFID CN(Cc1cncs1)Cc1ccccc1F 160725638 PDZIOSWBEDYNKT-UHFFFAOYSA-N 236.315 2.914 70 20 BFID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(OC)c(N)c1 161198790 IKEBSYNSQZQWPQ-QMTHXVAHSA-N 248.326 2.652 70 20 BFID CCc1ccc2nc([C@H](C)Cl)[nH]c(=O)c2c1 57772153 RHNGTOBSMIPBCT-ZETCQYMHSA-N 236.702 2.785 70 20 BFID CC[C@@H](C)[C@@H](C)NC(=O)NC1(C)CCC1 159970115 KKSXVJOTMMDGQV-NXEZZACHSA-N 212.337 2.663 70 20 BFID CC[C@@H]1CCCC[C@H]1CS(=O)(=O)Cl 307128612 XAIIWNAHVAYVEU-BDAKNGLRSA-N 224.753 2.771 70 20 BFID CN(Cc1cccn1C)C(=O)CC1=CCCCC1 160811456 XTIYRKBRYOPLCG-UHFFFAOYSA-N 246.354 2.874 70 20 BFID CC1(C)C(CNC(=O)NC2CCCC2)C1(C)C 160670020 KRPMXMUZNSFEEU-UHFFFAOYSA-N 238.375 2.910 70 20 BFID C[C@H](NC[C@@H](C)C1CC1)c1ccccn1 160889250 GOJYUPPRFPZSGY-MNOVXSKESA-N 204.317 2.778 70 20 BFID CCCCNC(=O)NC[C@@H]1CCC[C@@H](C)C1 218001431 GNJFFEYPEGAKKL-VXGBXAGGSA-N 226.364 2.912 70 20 BFID Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCC1CC1 160464470 AHBKJRWFRDDBQT-GHMZBOCLSA-N 235.352 2.686 70 20 BFID COCCN(CCC1CCCC1)CC(F)F 160554756 PRKBXEMUVLIZEV-UHFFFAOYSA-N 235.318 2.780 70 20 BFID Cc1ccc2c(c1)N(Cc1ccccn1)CC2 159816826 WOMGCHVBPAVZJU-UHFFFAOYSA-N 224.307 2.953 70 20 BFID Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCCO2)cc1 160956899 VWDCFTIFRXTRJC-TZMCWYRMSA-N 247.338 2.741 70 20 BFID CC[C@@H](COC)NCCc1cc(C)cc(C)c1 159508348 HEIVOJRZMQMKHA-HNNXBMFYSA-N 235.371 2.861 70 20 BFID C[C@@H]1CCCN(Cc2cc(O)cc(F)c2)C1 159813466 POBLFPHLVAJLNV-SNVBAGLBSA-N 223.291 2.763 70 20 BFID COc1cccc(CCNc2cccc(F)n2)c1 218121051 FEVFYBUYGVWWHB-UHFFFAOYSA-N 246.285 2.884 70 20 BFID CC/C=C(\C)C(=O)NCC1(O)CCCCCC1 218236730 CFNZGWAZWQLDFP-XYOKQWHBSA-N 239.359 2.544 70 20 BFID CC[C@H](c1ccccc1)S(=O)(=O)Cl 60008448 CLVIZCPYUDDZIV-SECBINFHSA-N 218.705 2.706 70 20 BFID CC[C@@H]1CCCC[C@H]1S(=O)(=O)Cl 111723406 ZVNDFHAFYPTWDV-HTQZYQBOSA-N 210.726 2.524 70 20 BFID CCCCNC(=S)N[C@H](C)CC(C)C 159574038 GUFMCOMRDYTWPW-SNVBAGLBSA-N 216.394 2.685 70 20 BFID C[C@H]1[C@H](C)CCN1C(=O)C[C@@H](C)c1ccncc1 161246769 PANYLVKIKAHCIK-UPJWGTAASA-N 246.354 2.832 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)[C@@H](C)C1CC1 159540733 FFVVPJNIEQMGPO-JBLDHEPKSA-N 209.333 2.727 70 20 BFID CC[C@@H]1CCC[C@H]1NC(=O)c1ccoc1C 159782064 MPQLBPAWMMKUEY-ZYHUDNBSSA-N 221.300 2.897 70 20 BFID Cc1nc(NC(=O)C2CC=CC2)cc(C2CC2)n1 160227457 MZHCPASIGBGUPL-UHFFFAOYSA-N 243.310 2.567 70 20 BFID CS[C@H](C)CC(=O)NC[C@@H]1Cc2ccccc21 160290362 JQICHLXJEWKYOW-PWSUYJOCSA-N 249.379 2.584 70 20 BFID CC(C)C(=O)Nc1cccc(OCCF)c1 160441244 MZJUYMHEFDEOMQ-UHFFFAOYSA-N 225.263 2.629 70 20 BFID CCCCCC(=O)N(C)Cc1cccn1C 160668485 BKMTUGNQHIIDNG-UHFFFAOYSA-N 222.332 2.564 70 20 BFID CC1CC(Nc2ccc(C(F)(F)F)nn2)C1 161055927 DEUDFWWZVOMBGF-UHFFFAOYSA-N 231.221 2.706 70 20 BFID CCC[C@H](C(=O)OCC)c1ccccn1 161257504 SBSHYJDIQDMECK-JTQLQIEISA-N 207.273 2.528 70 20 BFID CC1=CCN(C(=O)c2cccnc2Cl)CC1 160194921 MLBSMPFQRMFLDI-UHFFFAOYSA-N 236.702 2.527 70 20 BFID CC(C)(C)OC(=O)CN1CC[C@@H]2CCCC[C@@H]21 159607965 KQIDJGIQFMYOBC-RYUDHWBXSA-N 239.359 2.593 70 20 BFID CCC(C)(C)C(=O)OC[C@H]1CCC[C@@H](O)C1 217796654 CXERZLKKEUPKNT-WDEREUQCSA-N 228.332 2.517 70 20 BFID CCOC(=O)[C@@H]1C[C@H]1c1sccc1C 159363573 VLYVAOSUDBUWNY-RKDXNWHRSA-N 210.298 2.723 70 20 BFID CC(C)C[C@@H](N)C(=O)N[C@H](C)CCC(C)(C)C 159768266 SRQZPEMSWRQNDV-VXGBXAGGSA-N 242.407 2.691 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)c1ccoc1C 159782187 MPQLBPAWMMKUEY-CMPLNLGQSA-N 221.300 2.897 70 20 BFID CCN1CCCC[C@@H]1CN[C@@H](C)c1ccco1 161193392 OAHJNZUTBCBVOP-QWHCGFSZSA-N 236.359 2.805 70 20 BFID CCCc1nc(CN2CC[C@@H]3CCCC[C@@H]32)no1 159707625 QFCCYIVSDOMMMS-RYUDHWBXSA-N 249.358 2.787 70 20 BFID CCOc1ccccc1CS[C@@H](C)CO 160731234 OPYNNXRKSXKYGR-JTQLQIEISA-N 226.341 2.699 70 20 BFID CO[C@H](C)[C@H](C)Nc1cccc(-c2ccn[nH]2)c1 161230509 UBUOVOIDYCTRNH-WDEREUQCSA-N 245.326 2.912 70 20 BFID CSC[C@@H](C)N[C@H](C)c1ccc(F)cn1 161453082 WDGGLCNOVQIENW-RKDXNWHRSA-N 228.336 2.623 70 20 BFID CCc1ccccc1NC(=O)N[C@@]1(C)CCOC1 159524551 BQJVMZMYHJZNTD-AWEZNQCLSA-N 248.326 2.550 70 20 BFID COCCSc1nc(C(C)(C)C)ns1 159771700 CYBDQZKDGRPMLA-UHFFFAOYSA-N 232.374 2.574 70 20 BFID CC[C@@H](NCC(C)(C)O)c1cc(F)ccc1F 160605876 DUDSIJDOVPLYNH-GFCCVEGCSA-N 243.297 2.776 70 20 BFID C[C@@H]1CCC[C@@H](CNC(=O)[C@@H]2CC2(C)C)C1 160781957 WUKHQAOWVBUDKI-UTUOFQBUSA-N 223.360 2.975 70 20 BFID O=C(N[C@@H]1CCCc2sccc21)c1ccon1 159870756 LIUNICYWARXFCX-SECBINFHSA-N 248.307 2.544 70 20 BFID CCCCC(=O)Nc1nnc(-c2ccc(C)o2)[nH]1 160240452 IGJYJEFHMKPIOH-UHFFFAOYSA-N 248.286 2.502 70 20 BFID CC1(C)C[C@@H]1C(=O)N(Cc1ccncc1)C1CC1 160523834 OSNWKEPPOCXOBQ-CYBMUJFWSA-N 244.338 2.619 70 20 BFID Cn1ccnc1CN1CCCc2cccc(F)c21 160746909 NCRPUKLWVRZXRG-UHFFFAOYSA-N 245.301 2.512 70 20 BFID C[C@H]1CCC[C@@H](CNc2ncccn2)C1 217921664 GNRMXCOEERZJLE-WDEREUQCSA-N 205.305 2.715 70 20 BFID CCCC1CCC(S(=O)(=O)Cl)CC1 88251325 AUYBBDZCZWQFAG-UHFFFAOYSA-N 224.753 2.914 70 20 BFID CC[C@H](NCc1cn2c(C)cccc2n1)C1CC1 160341235 BOUWUKJVJAMBJW-AWEZNQCLSA-N 243.354 2.921 70 20 BFID CC(C)(C)CCCC(=O)N[C@@H]1CCC[C@@H](N)C1 161477299 ILDHFHKAIWPGRR-VXGBXAGGSA-N 240.391 2.589 70 20 BFID CC[C@@H](CSC)N[C@H]1CCOC(C)(C)C1 217328353 ODBNGNFRCYRMSB-QWRGUYRKSA-N 231.405 2.675 70 20 BFID COCC(C)(C)c1nc(-c2ccsc2)no1 161374440 OGBJDZAUDSGMFG-UHFFFAOYSA-N 238.312 2.722 70 20 BFID CN1CCC[C@@H]1CCN(C1CCCC1)C1CC1 161377911 GCSIUJRBQWEPLP-CYBMUJFWSA-N 236.403 2.878 70 20 BFID CC(C)(C)Oc1ccc(S(=O)(=O)Cl)cc1 105379584 YLCJRBOWAKPRSV-UHFFFAOYSA-N 248.731 2.791 70 20 BFID CCCCNC(=O)[C@H](C)N(CC)C[C@@H](C)CC 160548165 BTBMLECFSSNPBQ-STQMWFEESA-N 242.407 2.659 70 20 BFID CC1(Nc2ccc(C(F)(F)F)nn2)CCC1 161057421 KBBDDRUGLVJMBA-UHFFFAOYSA-N 231.221 2.850 70 20 BFID CC[C@@H](NCCc1ccc2c(c1)OCO2)C1CC1 161148494 SKZGKWCZZRXUPV-CYBMUJFWSA-N 247.338 2.736 70 20 BFID CCCN(CCN(CC)CC)Cc1ccco1 161169180 IVCUSYDSLAFAKL-UHFFFAOYSA-N 238.375 2.833 70 20 BFID CCCCn1nc(C2CC2)nc1C1CC1 161446350 FMROGOJGRSNRSP-UHFFFAOYSA-N 205.305 2.833 70 20 BFID C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2cccn2C)C1 160505112 WCRRFZFPLDFPRD-CHWSQXEVSA-N 248.370 2.810 70 20 BFID C/C=C(/C)C(=O)Oc1ccc2ccc(=O)oc2c1 217075197 SOCBFHXQOGEBLJ-OQFOIZHKSA-N 244.246 2.665 70 20 BFID CCc1ncnc(N[C@H]2CC=CCC2)c1F 218025562 BRLNHETXBXTTLR-VIFPVBQESA-N 221.279 2.699 70 20 BFID CC[C@@H](c1ccccc1)S(=O)(=O)Cl 60008446 CLVIZCPYUDDZIV-VIFPVBQESA-N 218.705 2.706 70 20 BFID CC[C@H](NCCC(C)(C)C)[C@H]1CCCO1 159756808 GUSXOPCWWBMXQE-NWDGAFQWSA-N 213.365 2.970 70 20 BFID Cc1cnccc1CN[C@@H](C)CC(C)C 160591229 SVLBRAYQRINZIC-LBPRGKRZSA-N 206.333 2.914 70 20 BFID CC[C@@H]1CC[C@H](C)N1C(=O)NCC(F)(F)F 161488050 HHBPPBNUYOXTRR-JGVFFNPUSA-N 238.253 2.521 70 20 BFID CC1=CCN(c2ccc(Cl)cn2)CC1 160054034 MLGXEIQHHOQICF-UHFFFAOYSA-N 208.692 2.891 70 20 BFID C1CCC(CCN2CC[C@H](N3CCCC3)C2)C1 160336398 WYWAFQZVGFDABO-HNNXBMFYSA-N 236.403 2.737 70 20 BFID O=S(=O)(Cl)c1cc(F)cc(C(F)F)c1 1503886534 IXNLLRQLQIRNMQ-UHFFFAOYSA-N 244.621 2.691 70 20 BFID CC1(C)CCC(CC(=O)NCC(F)F)CC1 159420435 CQICKMJHXPYKRG-UHFFFAOYSA-N 233.302 2.974 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)Cc1ccc(C)nc1 159664101 FXSXACQSDZHKPP-UONOGXRCSA-N 246.354 2.627 70 20 BFID Cc1cccc(C(=O)NC2(C)CCC2)c1F 160017266 JGGSYTGBSVBGKC-UHFFFAOYSA-N 221.275 2.807 70 20 BFID CC(C)[C@H](C)CC(=O)N(C)Cc1cccn1C 160394199 PMOUMNDEIWWSCT-GFCCVEGCSA-N 236.359 2.666 70 20 BFID CCCC[C@@H](CC)CC(=O)NC[C@@H](O)C(C)C 159747207 ORZARKQJJZWWLH-CHWSQXEVSA-N 243.391 2.726 70 20 BFID Cc1ccc(/C=C/C(=O)NCC2(C3CC3)CC2)o1 159935086 AFKGLPSUFDOXLN-VOTSOKGWSA-N 245.322 2.908 70 20 BFID Cc1ccc(CS(=O)(=O)Cl)c(Cl)c1 106908439 FAOOBULGDWOSTB-UHFFFAOYSA-N 239.123 2.717 70 20 BFID CCCC(=O)N(C)c1ccc(OC)c(F)c1 159465514 GAKHHOQMSOCAAB-UHFFFAOYSA-N 225.263 2.597 70 20 BFID CC[C@@H](NCCC(C)(C)O)c1nc(C)cs1 159662419 MZOUAOGSPKZPSS-SNVBAGLBSA-N 242.388 2.653 70 20 BFID Oc1cc(F)cc(CN2CCCCC2)c1 159814802 FXJWYZYUNNZCEF-UHFFFAOYSA-N 209.264 2.517 70 20 BFID CCCN(CCSCC)CC(F)F 159915729 HQTLJNMVGKTTCS-UHFFFAOYSA-N 211.321 2.717 70 20 BFID COCC(C)(C)C(=O)Nc1cscc1C 161176405 JWPBACRWOIOEQW-UHFFFAOYSA-N 227.329 2.668 70 20 BFID COc1ccc2cc([B-](F)(F)F)ccc2c1 203316496 DEORJSGGOBVQLI-UHFFFAOYSA-N 224.998 2.903 70 20 BFID O=S(=O)(Cl)[C@H](c1ccccc1)C1CC1 88251299 DJMIKWJDHIFCES-SNVBAGLBSA-N 230.716 2.706 70 20 BFID Cc1cc(C)c(C(=O)NCC2(C3CC3)CC2)o1 160013327 YMFJMLRQWUOXTD-UHFFFAOYSA-N 233.311 2.816 70 20 BFID Cc1[nH]c2ccccc2c1C(=O)NC1CC=CC1 160826636 CCZGLZPGVPBJJG-UHFFFAOYSA-N 240.306 2.925 70 20 BFID O=C(CC1CC1)N1CCc2c(F)cccc2C1 160938647 ZJYBBOAMTJTSTL-UHFFFAOYSA-N 233.286 2.511 70 20 BFID C1CC(CN[C@H]2C[C@H]3CC[C@H]2C3)CCS1 161444585 CUPBNKCWKWQMBJ-AVGNSLFASA-N 225.401 2.908 70 20 BFID COC[C@H](C)N[C@@H]1CCCc2cc(F)ccc21 159549347 QGUFFEREWNINNU-IINYFYTJSA-N 237.318 2.828 70 20 BFID CC[C@H](C)CNC(=O)c1ccc(F)cc1C 159861009 YMMJLTIMWAOZFT-VIFPVBQESA-N 223.291 2.910 70 20 BFID CCc1cccc(NC(=O)c2cc(C)ncn2)c1 161192355 MOZBCVDTYXBCMF-UHFFFAOYSA-N 241.294 2.600 70 20 BFID CC[C@H](C)C(=O)NCc1ccc(F)cc1F 217382338 ZWJJQTBIELHTRE-QMMMGPOBSA-N 227.254 2.627 70 20 BFID CCC(CC)CN[C@@H]1CCOC(C)(C)C1 160449579 ANSCHEKUNDWNGQ-GFCCVEGCSA-N 213.365 2.970 70 20 BFID CC[C@H](C)CN(CC)[C@@H](C)C(=O)N(CC)CC 160587930 SPKCTLGMMMDWHB-STQMWFEESA-N 242.407 2.611 70 20 BFID O=C(CN1C[C@H]2CCC[C@@H]2C1)c1ccccc1F 160022215 YKFVQWIAAHPLAD-VXGBXAGGSA-N 247.313 2.740 70 20 BFID CCOC(=O)CN[C@@H](c1ccccc1)C(C)(C)C 159487863 VYRFBPGPGQMWOL-AWEZNQCLSA-N 249.354 2.927 70 20 BFID C[C@H]1CCCN(C(=O)N(C)Cc2ccccc2)C1 160304873 JSAKJYZGBIDLIT-ZDUSSCGKSA-N 246.354 2.970 70 20 BFID CC[C@@H](NC(=O)C(C)(C)C)c1c(C)noc1C 160539385 DHTDBRYVBJUTOK-SNVBAGLBSA-N 238.331 2.905 70 20 BFID 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CC(C)CCc1ccc(S(=O)(=O)F)cc1 238854022 MCYRJKOMHQIQLM-UHFFFAOYSA-N 230.304 2.933 70 20 BFID CC(C)CCN(C)CCCN1CCCCC1 160636096 AGDWGCZCRAJZDE-UHFFFAOYSA-N 226.408 2.840 70 20 BFID CCCCCNC(=O)c1ccc(Cl)o1 218186942 VMJASSAKDRNLEM-UHFFFAOYSA-N 215.680 2.853 70 20 BFID Cc1ccoc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 159632994 UUSVIAGJGHRCBK-BNOWGMLFSA-N 247.338 2.635 70 20 BFID Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)C2)cc1 159771315 BQAYHAZYJAWOLT-YPMHNXCESA-N 217.312 2.913 70 20 BFID C[C@H]1CCC[C@H](C(=O)N(C)Cc2ccncc2)C1 159519445 XDKSNWQGXDWBLI-JSGCOSHPSA-N 246.354 2.866 70 20 BFID CC(C)(O)CN[C@H]1CCC[C@@H]1c1ccccc1 160612644 UAGXLSNMPQFLAH-KGLIPLIRSA-N 233.355 2.683 70 20 BFID CCCS(=O)(=O)N[C@@H](C)C1CCCCCC1 160676000 VJVSGECNMCAOTK-NSHDSACASA-N 247.404 2.675 70 20 BFID CN1CCC[C@H]1CCN(C1CCCC1)C1CC1 161378047 GCSIUJRBQWEPLP-ZDUSSCGKSA-N 236.403 2.878 70 20 BFID Cc1cccc(C)c1CS[C@@H]1CCN(C)C1=O 161387034 CNHBEFHEEYFJIA-CYBMUJFWSA-N 249.379 2.767 70 20 BFID CC(C)CN(C)Cc1cc(O)cc(F)c1 159816457 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C[C@H](NCCc1ccco1)c1cscn1 161138881 PSPVXNRGDDHWGY-VIFPVBQESA-N 222.313 2.629 70 20 BFID CC[C@@H]1CCCC[C@H]1NCCCc1cnn(C)c1 161422310 OZVWYSPFXBMRSF-HUUCEWRRSA-N 249.402 2.911 70 20 BFID Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1cn[nH]c1 161450567 HWZGBDMXDJHDEI-ZJUUUORDSA-N 247.323 2.522 70 20 BFID CC(=O)CCC(=O)Nc1cc(F)cc(Cl)c1 218083392 QUOHPKVCCQFYDD-UHFFFAOYSA-N 243.665 2.787 70 20 BFID COc1ccc(C(=O)NCC2(C3CC3)CC2)cc1 159932655 YGRVCYUMIVRKED-UHFFFAOYSA-N 245.322 2.615 70 20 BFID CCc1cc(N[C@H]2CCOC(C)(C)C2)nc(C)n1 159997115 PDSWVLVGXQTGTB-LBPRGKRZSA-N 249.358 2.717 70 20 BFID Cc1ccsc1CCCC(=O)NCC1CC1 160463932 UJFVFGCTYQPVFT-UHFFFAOYSA-N 237.368 2.905 70 20 BFID Cc1cc(C(=O)N[C@@H](C)CCCC(C)C)ncn1 161431400 QXHQKJFHLBPAGJ-NSHDSACASA-N 249.358 2.730 70 20 BFID CCC[C@@H]1CN(C(=O)C(C)(CC)CC)CCO1 159392948 NUUZHVMHQIKWFY-GFCCVEGCSA-N 241.375 2.840 70 20 BFID CC[C@H](C)[C@@H](C)Nc1cc(C(=O)OC)ccn1 218125027 CPTZWBVNWUHMLJ-VHSXEESVSA-N 236.315 2.715 70 20 BFID O=S(=O)(Cl)Cc1csc2ccccc12 105294655 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CC[C@H](O)CCN[C@H]1CCC[C@@H](CC)C1 217870864 JWYYBRAPFNXYJZ-AGIUHOORSA-N 213.365 2.706 70 20 BFID Cc1ccc([C@H](C)S(=O)(=O)Cl)cc1 88251435 BTUUGCRDBWOPGW-QMMMGPOBSA-N 218.705 2.625 70 20 BFID CC(C)(C)C(=O)NCCc1cc2ccccc2[nH]1 159617815 YLSUBMIEZKQUSR-UHFFFAOYSA-N 244.338 2.873 70 20 BFID CSC[C@@H](C)Nc1nc2ccccc2[nH]1 160552225 NWRSETBBZUBFBU-MRVPVSSYSA-N 221.329 2.726 70 20 BFID C[C@H](N(C)C[C@@H](O)C(C)(C)C)C(C)(C)C 216949672 BYOFCTYQMAACOJ-WDEREUQCSA-N 215.381 2.760 70 20 BFID COC[C@@H](NCCc1cc(C)cc(C)c1)C1CC1 159519146 PHQWBEIXMGBAQB-MRXNPFEDSA-N 247.382 2.861 70 20 BFID CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C)ccn1 159875169 XTDZZCJUODNGCJ-GWCFXTLKSA-N 218.300 2.765 70 20 BFID C[C@H](Cc1ccccc1F)NCC1CC1 161006589 WKHGGNXHTJBKQS-SNVBAGLBSA-N 207.292 2.756 70 20 BFID C[C@@H]1CCC[C@H](CNc2cnccn2)C1 217920687 OFJOZDFYSZYEJW-MNOVXSKESA-N 205.305 2.715 70 20 BFID O=S(=O)(Cl)CCCCc1ccccc1 104534943 STNOVOXCNZFDME-UHFFFAOYSA-N 232.732 2.578 70 20 BFID CN(Cc1ccccc1)CC(C)(C)NCC1CC1 159406081 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160953060 NJYJBJYIPBBORB-UHFFFAOYSA-N 233.340 2.724 70 20 BFID CCC[C@@H](C)NC(=O)c1ccc(OC)cc1F 218445174 HYZWLSYJPANJDQ-SECBINFHSA-N 239.290 2.753 70 20 BFID CC1(C)C[C@H](Nc2cccc(F)n2)CCO1 160670727 KTTFCZCOZYSMEU-SECBINFHSA-N 224.279 2.590 70 20 BFID COCC(C)(C)C(=O)N1CC[C@@H](C)C[C@@H](C)C1 161463277 OBAXFGKDSZADQS-VXGBXAGGSA-N 241.375 2.554 70 20 BFID Cc1nc(NC(=O)C2CCCC2)cc(C2CC2)n1 159961937 NMWINVHZUZMIAB-UHFFFAOYSA-N 245.326 2.791 70 20 BFID C[C@@H]1CCC[C@H](C(=O)NCc2nccs2)C1 160741966 KXYOURYHWRASLR-ZJUUUORDSA-N 238.356 2.586 70 20 BFID CCSCCN(C)Cc1csc(C)n1 159721650 PINYBFKONILZPU-UHFFFAOYSA-N 230.402 2.636 70 20 BFID COc1cc(NC[C@H]2CCCOC2)ccc1F 160001783 USNPDWGVDYXVHJ-SNVBAGLBSA-N 239.290 2.673 70 20 BFID Cn1cnnc1CSCC1CCCCC1 161042496 OXIBDQKYLZVLIQ-UHFFFAOYSA-N 225.361 2.629 70 20 BFID CCc1ncnc(NCC2(C3CC3)CC2)c1F 218077940 AQGMBMVEQHEWKJ-UHFFFAOYSA-N 235.306 2.780 70 20 BFID CCc1noc(C)c1CSCc1ccon1 159808624 UDUMTKAHZBEDRC-UHFFFAOYSA-N 238.312 2.967 70 20 BFID 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160721381 PKOLRAWIXRBVMT-LLVKDONJSA-N 220.316 2.760 70 20 BFID CC[C@H]1CCCC[C@@H]1N(C)C(=O)C1CC1 160782855 YULCMTUKYJEUEA-JQWIXIFHSA-N 209.333 2.824 70 20 BFID CCc1ccccc1C(=O)N[C@@H](C)CC 160073921 RGWQDRZPJFHRLH-JTQLQIEISA-N 205.301 2.777 70 20 BFID Cc1cccc([C@H](C)NC(=O)C(C)C)c1 160324701 QNPIEOAJNDSBAQ-NSHDSACASA-N 205.301 2.828 70 20 BFID O=C(NC1CC=CC1)c1c(F)cccc1Cl 160867984 YRZBWSYXJBREQZ-UHFFFAOYSA-N 239.677 2.928 70 20 BFID Cc1ccc(NC(=O)[C@@H]2CCCCO2)c(F)c1 159574032 GHEGNFAIBFCYFZ-LBPRGKRZSA-N 237.274 2.642 70 20 BFID CCc1ccc([C@@H]2CCCCCN2C(N)=O)o1 160804605 KGOLJTOURYODMP-NSHDSACASA-N 236.315 2.838 70 20 BFID O=C(NCC1(C2CC2)CCC1)N[C@@H]1C=CCCC1 160268471 XTTGFVLHNHEEDI-CYBMUJFWSA-N 248.370 2.975 70 20 BFID COCCCN(C)C(=O)C(C)(C)C1CCCC1 161298850 JBZMSWUGKDOVJW-UHFFFAOYSA-N 241.375 2.698 70 20 BFID Cc1ccsc1[C@@H](F)CS(=O)(=O)Cl 1537958995 SSLXOSPBZLODPA-LURJTMIESA-N 242.724 2.636 70 20 BFID COCCCN(C)C(=O)C1CCC(C)(C)CC1 159409731 SRRAQBKUNWMOFE-UHFFFAOYSA-N 241.375 2.698 70 20 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MTDJIPNWHCSQFB-IJLUTSLNSA-N 213.365 2.826 70 20 BFID Cc1nc2c(S(=O)(=O)Cl)cccc2s1 104552053 VLWQNWSNCAAZHW-UHFFFAOYSA-N 247.728 2.532 70 20 BFID CC(C)CNC(=O)NCC(C(C)C)C(C)C 217765560 AZWFYAUMPUKRLF-UHFFFAOYSA-N 228.380 2.870 70 20 BFID C[C@H]1CCC[C@@H](C(=O)N(C)Cc2ccncc2)C1 159519695 XDKSNWQGXDWBLI-GXTWGEPZSA-N 246.354 2.866 70 20 BFID Cc1cccc(NCc2nnc3n2CCCC3)c1 217317321 CDUPLHNTIIZAOQ-UHFFFAOYSA-N 242.326 2.535 70 20 BFID CCc1cccc(NC(=O)[C@@H]2CCCCO2)c1 159594687 HWBACVLHSDEPAF-ZDUSSCGKSA-N 233.311 2.757 70 20 BFID COC(=O)CN(c1cc(C)ccc1C)C(C)C 160448692 RXWAOZOISIGBED-UHFFFAOYSA-N 235.327 2.691 70 20 BFID CC[C@H]1CCCCN1Cc1nccn1CC 160670552 VPSOQBYQCQPAEP-LBPRGKRZSA-N 221.348 2.668 70 20 BFID CN(CCCN1CCCC1)CC1CCCC1 161503799 NKLVMEFTYZJZCT-UHFFFAOYSA-N 224.392 2.594 70 20 BFID CC(C)CCNC(=O)N1CC[C@H](C)[C@H](C)C1 159657376 JAFIBJKEASBCTD-NWDGAFQWSA-N 226.364 2.720 70 20 BFID O=C(Nc1ccc(Cl)cn1)NC1CCCC1 217584710 WJAZPFNZODLFAR-UHFFFAOYSA-N 239.706 2.799 70 20 BFID 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161338792 WWDFGALMWAEDRV-ZDUSSCGKSA-N 234.343 2.770 70 20 BFID Cc1nccc(NC(=O)N(C)C(C)C)c1Cl 159372645 XNDCEACIZUSFTQ-UHFFFAOYSA-N 241.722 2.916 70 20 BFID CSC[C@H](C)N[C@H](C)c1ccc(F)cn1 161452951 WDGGLCNOVQIENW-DTWKUNHWSA-N 228.336 2.623 70 20 BFID CC[C@H]1CCC[C@@H]1NC(=O)CC(F)(F)F 159523996 DGOHHXCEAOYATC-YUMQZZPRSA-N 223.238 2.634 70 20 BFID C[C@H]1C[C@@H](C)N(Cc2cc(O)cc(F)c2)C1 159853726 QMFHFKMLJWRABQ-VHSXEESVSA-N 223.291 2.762 70 20 BFID CC[C@]1(C)C[C@H]1C(=O)Nc1cccc2cn[nH]c12 160818558 MRQQSFDOWSNPDL-IINYFYTJSA-N 243.310 2.938 70 20 BFID COC[C@H](NCCc1cc(C)cc(C)c1)C1CC1 159519020 PHQWBEIXMGBAQB-INIZCTEOSA-N 247.382 2.861 70 20 BFID O=C(C1CCCCC1)N1[C@H]2C=CC[C@H]1CC2 218741482 NFSWAUGWUWLWMJ-STQMWFEESA-N 219.328 2.886 70 20 BFID Cc1ccccc1[C@H](C)S(=O)(=O)Cl 88251354 IVKDALWMBJQSDT-QMMMGPOBSA-N 218.705 2.625 70 20 BFID CC[C@H](c1ccncc1)N(C)C(=O)N(CC)CC 159741244 UPZDIKRYCSJLOT-CYBMUJFWSA-N 249.358 2.926 70 20 BFID CCOCCCN(C)c1ccccc1F 160020772 FIAOFAJZDMETFF-UHFFFAOYSA-N 211.280 2.689 70 20 BFID CC[C@@H]1CCCC[C@H]1N(C)C(=O)C1CC1 160782983 YULCMTUKYJEUEA-ZYHUDNBSSA-N 209.333 2.824 70 20 BFID COC(=O)c1cc(CSCCCF)oc1C 161057139 USSDCWRTNGJXTG-UHFFFAOYSA-N 246.303 2.967 70 20 BFID COC[C@H](C)N[C@H]1CCCc2cc(F)ccc21 159549619 QGUFFEREWNINNU-HZMBPMFUSA-N 237.318 2.828 70 20 BFID C[C@@H](CO)SC/C=C/c1ccccc1 160730983 KOLCJKIFMSVHPI-BWNDKRECSA-N 208.326 2.814 70 20 BFID CCC(C)(CC)C(=O)NCC[C@H]1CCCCO1 159462506 KWDAUCAZETYKQE-GFCCVEGCSA-N 241.375 2.888 70 20 BFID CCn1nccc1CNCc1ccc(F)c(C)c1 159915639 VJMLEYSYRXGGEH-UHFFFAOYSA-N 247.317 2.640 70 20 BFID CC1(C(=O)N2CCc3c(F)cccc3C2)CC1 160889012 LBENKNXTRNLQIA-UHFFFAOYSA-N 233.286 2.511 70 20 BFID Cc1nc(CN[C@@H](C)c2cscn2)cs1 161159085 SQPKNRJAICCLRF-ZETCQYMHSA-N 239.369 2.759 70 20 BFID CCC(C)(CC)C(=O)N(C)CC1CCOCC1 159409467 BJGSIYDXVMFYGZ-UHFFFAOYSA-N 241.375 2.698 70 20 BFID COc1cccc2c1CC[C@@H]2NC(=O)C(C)(C)C 160196567 QEBYNYXFCUUZPU-LBPRGKRZSA-N 247.338 2.845 70 20 BFID CC1(C)C[C@H]1CNc1ncnc2c1CCCC2 217804916 MODLMXINUBYOTP-JTQLQIEISA-N 231.343 2.813 70 20 BFID CCC[C@@H]1[C@H](C)CCCN1C(=O)[C@@H]1CCCO1 159458879 GKKUIOHPYCOJON-UPJWGTAASA-N 239.359 2.593 70 20 BFID CCCCCN1C(=O)CC[C@H](CCC)C1=O 159877298 NOVIDDXXOXDUTI-NSHDSACASA-N 225.332 2.742 70 20 BFID COc1cccnc1N[C@@H]1CC=CCC1 160245637 VXXHDKRJSQZCBK-SNVBAGLBSA-N 204.273 2.611 70 20 BFID CCOC(=O)c1coc(NCC(CC)CC)n1 159450939 ZMVOSKYEWCDOPF-UHFFFAOYSA-N 240.303 2.699 70 20 BFID C[C@H]1CCCN1Cc1cc(O)cc(F)c1 159821908 JWNYSKNZKPPLQS-VIFPVBQESA-N 209.264 2.516 70 20 BFID Cc1ccccc1CN(C)CC1=CCCOC1 160526591 XIVQJNICYIMLPG-UHFFFAOYSA-N 231.339 2.774 70 20 BFID CCOCCC1(CNC(=O)C(C)(C)C)CCC1 160604284 LEUPOTJYXBYQDK-UHFFFAOYSA-N 241.375 2.746 70 20 BFID C[C@H]1CCC[C@H](C(=O)N(C)Cc2ccccn2)C1 161112241 JWKGHSGDAKKIMK-STQMWFEESA-N 246.354 2.866 70 20 BFID Cc1occc1CN(C)CC[C@H]1CCCN1C 161474213 WKWIYPVTANWCKF-CQSZACIVSA-N 236.359 2.504 70 20 BFID CCn1cncc1CNc1ccc(F)c(OC)c1 159910379 VSPAKJCMXLBPKI-UHFFFAOYSA-N 249.289 2.663 70 20 BFID CC[C@H](CC(=O)N[C@@H](CO)CC(C)C)C(C)C 161203508 ZCIZXOXDSOHBAE-CHWSQXEVSA-N 243.391 2.582 70 20 BFID COc1ccc(N[C@@H]2C[C@H](C)N(C)C[C@@H]2C)cc1 217923782 DCFAYOWMNNOLDU-SLEUVZQESA-N 248.370 2.836 70 20 BFID CC[C@H]1CCC[C@@H]1NC(=O)c1occc1C 159774024 OIMXRBGFRKHCRO-QWRGUYRKSA-N 221.300 2.897 70 20 BFID C1CC([C@H]2CCCN2CCOCC2CC2)C1 160454639 CQVWXYIHBOBSSA-CQSZACIVSA-N 223.360 2.678 70 20 BFID CCCCCCC(=O)NOCc1cccnc1 160810404 WRTMEXJOPHMDIU-UHFFFAOYSA-N 236.315 2.600 70 20 BFID C[C@H](NC[C@@H]1CCc2ccccc21)[C@H]1CCOC1 160965720 UVBROUIMPMNXAZ-QEJZJMRPSA-N 245.366 2.731 70 20 BFID COC(=O)[C@H](C)CS[C@H]1C=CCCC1 161244365 GPONVVSTZMAOCT-ZJUUUORDSA-N 214.330 2.637 70 20 BFID FC(F)(F)CN1CC[C@@H]2CCCC[C@@H]21 159692733 XYROMEXCPKHENX-IUCAKERBSA-N 207.239 2.813 70 20 BFID COc1cc(N[C@H]2CCO[C@H](C)C2)ccc1F 159968171 FXONAUYTQIEIQK-KOLCDFICSA-N 239.290 2.814 70 20 BFID CN(Cc1ccncc1)C(=O)N1CCCCCC1 160362657 DIMFRUWGMLIEFL-UHFFFAOYSA-N 247.342 2.509 70 20 BFID CC(C)(C)C1=CCN(C(=O)NC2CC2)CC1 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244.791 2.966 70 20 BFID CCCCNC(=O)NC[C@@H]1CCC[C@H](C)C1 218001624 GNJFFEYPEGAKKL-NWDGAFQWSA-N 226.364 2.912 70 20 BFID C[C@H](O)CN(C)[C@@H]1CCc2c(Cl)cccc21 159553629 AVNNWQKKLVQTLZ-TVQRCGJNSA-N 239.746 2.640 70 20 BFID O=C(CC1CCC1)N1CCc2c(F)cccc2C1 160911076 GKRYNXDYKKCOGD-UHFFFAOYSA-N 247.313 2.901 70 20 BFID C[C@@H]1CCN(Cc2nc3c(s2)CCCC3)C1 216685249 RZYHGQYXKSCGDF-SNVBAGLBSA-N 236.384 2.864 70 20 BFID CC[C@H](N)C(=O)N(C)[C@@H](c1ccccc1)C(C)C 159757067 JSFKLWMYWUVDOA-UONOGXRCSA-N 248.370 2.579 70 20 BFID Cc1cccc(CCNC(=O)NC2(C)CCC2)c1 160366865 UPEPFEGSVLQHFR-UHFFFAOYSA-N 246.354 2.779 70 20 BFID Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)C1CC1 161326111 KNCPEUHCTQVTLE-QWRGUYRKSA-N 235.352 2.781 70 20 BFID CC[C@@H](C)[C@@H](C)NC(=O)Nc1ccc(C)nc1 161378282 CXINZUSGWNSKHB-MWLCHTKSSA-N 235.331 2.946 70 20 BFID C[C@H]1CC[C@H](C)N1C(=O)NC1CCCC1 161433738 VIFLOABXBJABTR-UWVGGRQHSA-N 210.321 2.511 70 20 BFID CCc1ncnc(N[C@@H]2CCC[C@H]2C)c1F 218008271 MHJAIUCDALVEBL-PSASIEDQSA-N 223.295 2.779 70 20 BFID 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221.304 2.638 70 20 BFID CC[C@H](C)C(=O)N1CCc2c(F)cccc2C1 160919863 KDUDUMXNUGKPQN-JTQLQIEISA-N 235.302 2.757 70 20 BFID CC1(C)OC[C@@H](COc2ccccc2Cl)O1 217826982 ZCRYRYPPEYWKFQ-SECBINFHSA-N 242.702 2.870 70 20 BFID Cc1cc(N[C@@H]2CCc3ccccc32)ncn1 217828863 VGCXOVAJGYVZST-CYBMUJFWSA-N 225.295 2.884 70 20 BFID Cc1cc(C)c([C@H](C)S(=O)(=O)Cl)c(C)n1 88251631 VXWWNZZUXMCZFR-VIFPVBQESA-N 247.747 2.636 70 20 BFID O=S(=O)(Cl)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 104537841 AFKIBSLYCRGOMI-OPRDCNLKSA-N 236.764 2.914 70 20 BFID CCC(=O)Nc1cc(F)ccc1OC(F)F 159499174 KSCBTIMKRAZRDW-UHFFFAOYSA-N 233.189 2.776 70 20 BFID CC[C@@]1(C)C[C@@H]1C(=O)NCCc1ccccc1F 159846195 LAGUAOCPIMIROW-DOMZBBRYSA-N 249.329 2.921 70 20 BFID CS[C@H](C)CC(=O)N(C)Cc1ccoc1C 160937118 MWHRLDVLJATIMG-SECBINFHSA-N 241.356 2.688 70 20 BFID CC[C@H](C)[C@H](C)NCCc1ccc2c(c1)OCO2 161114889 YYENBSUFPIMEJC-RYUDHWBXSA-N 249.354 2.982 70 20 BFID Cc1nc(NC(=O)CC(C)C)cc(C2CC2)n1 159962598 OUPNVZRIRCVWOB-UHFFFAOYSA-N 233.315 2.647 70 20 BFID 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CCCCCOc1cccc(-n2cncn2)c1 159702175 MFQCIEJIKMLHRX-UHFFFAOYSA-N 231.299 2.836 70 20 BFID COc1ccc(N(C)C(=O)CC2CC2)cc1F 159751669 JNNOOJVDLNAVQF-UHFFFAOYSA-N 237.274 2.597 70 20 BFID Cc1ccc(C(=O)N[C@H]2CC[C@H](C)C2)cc1 159771049 BQAYHAZYJAWOLT-AAEUAGOBSA-N 217.312 2.913 70 20 BFID CCc1ccccc1C(=O)N[C@H](C)CC 160074055 RGWQDRZPJFHRLH-SNVBAGLBSA-N 205.301 2.777 70 20 BFID CCCC[C@H](C(=O)OC)N(C)CCC(C)C 160797584 YJOBBKFGZZMFLX-GFCCVEGCSA-N 229.364 2.696 70 20 BFID CCCCCCSc1n[nH]c(COC)n1 217580507 XEUIGPWZYKXQKP-UHFFFAOYSA-N 229.349 2.624 70 20 BFID CCOC(=O)[C@H]1C[C@@H]1c1sccc1C 159363439 VLYVAOSUDBUWNY-IUCAKERBSA-N 210.298 2.723 70 20 BFID Cc1ccccc1[C@H](NC(=O)CCCN)C(C)C 159690691 SAAVKXXUESFBET-OAHLLOKOSA-N 248.370 2.547 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)c1cc[nH]c1C 159792810 DIUCOOIFXPIDIZ-CMPLNLGQSA-N 220.316 2.632 70 20 BFID C1CCN(CCCN2C[C@H]3CCC[C@@H]3C2)CC1 161409006 NFMHUQYKQVMGHM-HUUCEWRRSA-N 236.403 2.594 70 20 BFID CCOC(=O)[C@H]1C[C@H]1c1sccc1C 159363700 VLYVAOSUDBUWNY-BDAKNGLRSA-N 210.298 2.723 70 20 BFID CC1(Nc2ncnc3c2CCCC3)CCC1 159976201 BVQLAVQYPMNXKU-UHFFFAOYSA-N 217.316 2.710 70 20 BFID CN(C(=O)CCC1CC1)c1ccc2c(c1)OCO2 160261635 VRYPWJIQRTVGGJ-UHFFFAOYSA-N 247.294 2.568 70 20 BFID CC(C)C[C@H](C)NC(=O)N[C@@H]1C=CCCC1 160267223 WKGPQKAOMZZOAP-NWDGAFQWSA-N 224.348 2.829 70 20 BFID CCC(CC)n1nccc1C(=O)N(CC)CC 160864042 YKWRNYYUUDUANO-UHFFFAOYSA-N 237.347 2.726 70 20 BFID NC[C@H]1CCCCN1C/C=C\c1ccccc1 217600611 JYPAZHKMWSSXIJ-WUKHSURWSA-N 230.355 2.513 70 20 BFID CC[C@]1(C)C[C@@H]1C(=O)NCc1cccc(F)c1 161028869 UDYVJQQVSHITCI-TZMCWYRMSA-N 235.302 2.878 70 20 BFID Cc1cccc(C)c1NC(=O)N[C@@]1(C)CCOC1 159487218 XTHRLVGKFAXCDJ-AWEZNQCLSA-N 248.326 2.604 70 20 BFID CC[C@H](C)[C@@H](C)NCCN(C)[C@@H](C)CC 160065358 IYDDSGVYBTVGBE-RWMBFGLXSA-N 214.397 2.741 70 20 BFID COc1cccnc1N[C@H]1CC=CCC1 160245504 VXXHDKRJSQZCBK-JTQLQIEISA-N 204.273 2.611 70 20 BFID O=C(c1ccco1)N1CC=C(C(F)(F)F)CC1 160576381 DFZRGRXVWPPWLE-UHFFFAOYSA-N 245.200 2.614 70 20 BFID CC[C@@]1(C)C[C@@H]1C(=O)NC(C1CC1)C1CC1 160658476 CTGOIFJHQOBMJO-RISCZKNCSA-N 221.344 2.727 70 20 BFID CO[C@H](C)c1nc(CNCC(C)C)cs1 161061964 IPFSKQLFTRSEBJ-SECBINFHSA-N 228.361 2.596 70 20 BFID Cn1c(NCc2ccoc2)nc2ccccc21 161082722 JAUOQTNODZIECD-UHFFFAOYSA-N 227.267 2.778 70 20 BFID CCN(Cc1cccc(F)c1)C(=O)C1(C)CC1 159619085 IFGATXYDWIDUTR-UHFFFAOYSA-N 235.302 2.974 70 20 BFID CC[C@H]1CC[C@@H](C)N1C(=O)NC1CCCC1 161489860 JCIUOPCVLWILCP-PWSUYJOCSA-N 224.348 2.902 70 20 BFID COc1ccsc1C(=O)N1[C@@H](C)CC[C@H]1C 161494985 NYTBPICUVVHRGL-DTORHVGOSA-N 239.340 2.770 70 20 BFID Cc1ccnc(NCCC(=O)OC(C)(C)C)c1 218445049 KEKSELFKNGZDBS-UHFFFAOYSA-N 236.315 2.534 70 20 BFID O=S(=O)(Cl)Cc1ccccc1C1CC1 126682463 SMOBIUXXXYXXCN-UHFFFAOYSA-N 230.716 2.633 70 20 BFID CCCCC(=O)N(C)CCOCc1ccccc1 159382374 LXMSRPOMYFWFJA-UHFFFAOYSA-N 249.354 2.852 70 20 BFID CC[C@H](NC(=O)C(C)(CC)CC)[C@@H]1CCCO1 159508679 XVVYYSDIPLPLJA-RYUDHWBXSA-N 241.375 2.887 70 20 BFID CC1(C(=O)NCCc2cc3ccccc3[nH]2)CC1 159689660 DGNDKYXVFSZDEA-UHFFFAOYSA-N 242.322 2.627 70 20 BFID CC[C@@]1(C)C[C@@H]1C(=O)NCCc1cccs1 159786629 BVGASIVVBOGNKZ-YPMHNXCESA-N 237.368 2.843 70 20 BFID CC[C@H](C)NCc1cccc(OC)c1F 160459175 BJBACUGRYIGVSS-VIFPVBQESA-N 211.280 2.722 70 20 BFID CC(C)CSCCCNC(=O)[C@H](C)C1CC1 160814274 QJJKTDMGHCJBFX-LLVKDONJSA-N 243.416 2.928 70 20 BFID O=C(NC1CC=CC1)C1C2CC3CC(C2)CC1C3 161077683 XMMIKNPNSGVWFP-UHFFFAOYSA-N 245.366 2.894 70 20 BFID CC[C@@H](CC(=O)N[C@H](CO)CC(C)C)C(C)C 161203232 ZCIZXOXDSOHBAE-STQMWFEESA-N 243.391 2.582 70 20 BFID CSc1cccc(NC(=O)C(F)F)c1 218045932 HBOOYOLVYVNQMO-UHFFFAOYSA-N 217.240 2.612 70 20 BFID Cc1cccc([C@H]2CCCN2CCOC(C)C)n1 160036214 LWSLLRKANSEDER-OAHLLOKOSA-N 248.370 2.952 70 20 BFID CCC(CC)n1nccc1C(=O)NC1CCCC1 160602979 QOMVZFFPBLJSIV-UHFFFAOYSA-N 249.358 2.917 70 20 BFID CCOCCC1(CN[C@@H](C)CCOC)CCC1 159980656 RGUGDJGIJAZGGN-ZDUSSCGKSA-N 243.391 2.598 70 20 BFID CCCCCNC(=O)c1ccnc(Cl)c1F 160645633 IETDZJCBAYJFCB-UHFFFAOYSA-N 244.697 2.794 70 20 BFID CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc2cn[nH]c12 160818422 MRQQSFDOWSNPDL-YGRLFVJLSA-N 243.310 2.938 70 20 BFID C1CN[C@@H](CCNC2C3CC4CC(C3)CC2C4)C1 216854348 ZYAPJOAPQHLSKU-BAPHQMLMSA-N 248.414 2.543 70 20 BFID CC1=CCN(C(=O)c2cccc(C)c2F)CC1 160176498 ZRVPDJQPJLRGMR-UHFFFAOYSA-N 233.286 2.926 70 20 BFID CC[C@H](COC)NC[C@H]1CCc2ccccc21 161001318 SBUZNEWLSZDZEE-ZIAGYGMSSA-N 233.355 2.731 70 20 BFID Cc1nc(C2(NCc3ccco3)CCCC2)no1 161365314 QUFZATQFLJONSH-UHFFFAOYSA-N 247.298 2.530 70 20 BFID CCCc1ccc(NC(=O)C(F)F)cc1 217640443 UTLVNUAZCFCXLY-UHFFFAOYSA-N 213.227 2.843 70 20 BFID CC[C@@H]1CCC[C@@H]1NC(=O)c1cc[nH]c1C 159792374 DIUCOOIFXPIDIZ-PWSUYJOCSA-N 220.316 2.632 70 20 BFID Cc1cc(NC[C@H](C)CN2CCCCC2)ccn1 160918269 HNHBSIASNJUFHY-ZDUSSCGKSA-N 247.386 2.924 70 20 BFID CSC[C@H](C)N[C@@H](C)c1ccc(F)cn1 161452719 WDGGLCNOVQIENW-IUCAKERBSA-N 228.336 2.623 70 20 BFID C[C@@H](Cc1ccccc1F)NCC1CC1 161006460 WKHGGNXHTJBKQS-JTQLQIEISA-N 207.292 2.756 70 20 BFID O=C(NC1CC1)N[C@H]1CCCc2sccc21 161168885 UMCCVVKSGTZOET-JTQLQIEISA-N 236.340 2.587 70 20 BFID C[C@@H](NC[C@H](C)C1CC1)c1cscn1 161175745 OAJWBGQCGADXLH-DTWKUNHWSA-N 210.346 2.840 70 20 BFID Cc1ccc(C(=O)N2[C@@H](C)CC[C@H]2C)o1 161411949 KANJTQUWRNTILQ-DTORHVGOSA-N 207.273 2.601 70 20 BFID C[C@H](NC(=O)C(F)F)c1ccccc1Cl 217622556 SYARXKPPQKCQFG-LURJTMIESA-N 233.645 2.782 70 20 BFID CC[C@@H]1CCN(C(=O)c2ccc3c(c2)NCC3)C1 159626838 DQPWSIPJYWTVIJ-LLVKDONJSA-N 244.338 2.527 70 20 BFID COCCCN1CCC[C@@H]1c1cccc(C)n1 160281262 AMNQGGMJCOCXRT-CQSZACIVSA-N 234.343 2.563 70 20 BFID Fc1cccc(N[C@H]2CCO[C@@H](C3CC3)C2)n1 160327582 SEJYRISAXJMYRM-WDEREUQCSA-N 236.290 2.590 70 20 BFID CCc1ccccc1C(=O)N1CCO[C@H](CC)C1 161227847 MZBHTSVXEBCPRM-CYBMUJFWSA-N 247.338 2.500 70 20 BFID O=C(NCC1(C2CC2)CC1)[C@@H]1C[C@H]1c1ccco1 160114146 AYXJZQGCMBHRJU-VXGBXAGGSA-N 245.322 2.690 70 20 BFID CCC(CC)CC(=O)N(C)Cc1cccn1C 160422843 NRDZIYMCQXOEFK-UHFFFAOYSA-N 236.359 2.810 70 20 BFID CC(C)n1ccnc1CN(C)[C@H](C)C1CC1 160854729 LPTDVYATGUNBGB-LLVKDONJSA-N 221.348 2.694 70 20 BFID O=C(CCl)NCCc1ccc2ccccc2c1 168211411 PYNUXDVDZPURBT-UHFFFAOYSA-N 247.725 2.737 70 20 BFID O=S(=O)(Cl)[C@@H]1CC[C@H]2CCCC[C@H]2C1 104537845 AFKIBSLYCRGOMI-KXUCPTDWSA-N 236.764 2.914 70 20 BFID CCOCCCN(C)c1cccc(C)c1 160326009 CKNMTDTUXKGAGN-UHFFFAOYSA-N 207.317 2.858 70 20 BFID CC[C@@H](C)NC(=O)[C@H](C)c1c(F)cccc1F 160465440 CIFVEUSNWHWITF-RKDXNWHRSA-N 241.281 2.983 70 20 BFID CSC[C@@H](C)N[C@@H](C)c1ccc(F)cn1 161452841 WDGGLCNOVQIENW-BDAKNGLRSA-N 228.336 2.623 70 20 BFID Cc1ccc(F)c(NC(=O)[C@@H]2CCCCO2)c1 159623229 YMSOASPSAIKNOU-LBPRGKRZSA-N 237.274 2.642 70 20 BFID CC[C@H]1CCC[C@@H]1NC(=O)CCC1CC1 159751366 KVOSGIWTJGHINM-RYUDHWBXSA-N 209.333 2.872 70 20 BFID CC(C)c1nnc(N2CCCCC2)s1 159810955 OROOOGBRVPIDFA-UHFFFAOYSA-N 211.334 2.652 70 20 BFID C[C@]1(Nc2nc3ccccc3s2)CCOC1 160076315 DBSCEMMKXWVXRC-LBPRGKRZSA-N 234.324 2.887 70 20 BFID CC(C)CNC(=S)N[C@H](C)CC(C)C 159571416 HPGVXTVLHVQYIK-SNVBAGLBSA-N 216.394 2.541 70 20 BFID CC[C@@H](C)CNC(=O)c1ccc(F)cc1C 159860886 YMMJLTIMWAOZFT-SECBINFHSA-N 223.291 2.910 70 20 BFID O=C(CCC1CCC1)NCC1(C2CC2)CC1 159865574 GQUKJAQPHLMUKH-UHFFFAOYSA-N 221.344 2.873 70 20 BFID CC[C@@H]1CCC[C@H]1NC(=O)NC[C@@H](C)SC 160237670 ZIZFBWMXMNOSMQ-GMTAPVOTSA-N 244.404 2.616 70 20 BFID CC[C@H](C)CN(CC)[C@H](C(N)=O)c1ccccc1 160538225 RGJCMXWTXNVGTP-JSGCOSHPSA-N 248.370 2.581 70 20 BFID CC[C@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159916784 LNFHNYJEXGYPFQ-RYUDHWBXSA-N 239.359 2.641 70 20 BFID CCc1cccc(N(C)C[C@@H]2CCCNC2)c1 216731789 JQGQADBNVBZALW-CQSZACIVSA-N 232.371 2.685 70 20 BFID CCCCNC(=S)N[C@@H](C)CC(C)C 159573908 GUFMCOMRDYTWPW-JTQLQIEISA-N 216.394 2.685 70 20 BFID CC1(C)C(C(=O)NCC2(C3CC3)CC2)C1(C)C 159724883 RRJNQGOXGTYRJI-UHFFFAOYSA-N 235.371 2.975 70 20 BFID O=C(N[C@H]1CCCc2sccc21)c1cc[nH]c1 159812124 PFTIWOPGCMCYQW-NSHDSACASA-N 246.335 2.884 70 20 BFID CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(C)cn1 159883213 MQGNSXGSQBUINW-GWCFXTLKSA-N 218.300 2.765 70 20 BFID CN[C@@H]1CC2(CCC2)Oc2ccccc21 160683302 CKNBDDHLSYGERN-LLVKDONJSA-N 203.285 2.652 70 20 BFID CC[C@H](C)C(=O)N[C@@H](CC)c1c(C)noc1C 160285981 BOXJMGMCERSZIK-KWQFWETISA-N 238.331 2.905 70 20 BFID CC[C@H]1CCCC[C@@H]1CS(=O)(=O)Cl 307128613 XAIIWNAHVAYVEU-DTWKUNHWSA-N 224.753 2.771 70 20 BFID FCCCN1CCO[C@@]2(CCc3ccccc32)C1 159619838 YASXHYKUEGTTRB-HNNXBMFYSA-N 249.329 2.520 70 20 BFID CC(C)CCNC(=O)c1cccn1C(C)C 161383270 YPSTWWRQYYQLDU-UHFFFAOYSA-N 222.332 2.845 70 20 BFID Cc1cccc(C(=O)N(C)CC(F)(F)F)c1F 161453551 VZBBUSQQOGYTCZ-UHFFFAOYSA-N 249.207 2.768 70 20 BFID C[C@H](CN(C)C[C@@H]1CCC[C@@H]1O)c1ccccc1 159767683 OSACTHZYSYTOSI-KBMXLJTQSA-N 247.382 2.883 70 20 BFID CC(C)c1cc(=O)n(CC2CCCCC2)cn1 160649723 UPULPDQIDFDCIJ-UHFFFAOYSA-N 234.343 2.947 70 20 BFID C[C@@H](NC(=O)C1CC1)C1CCCCCC1 160673963 SVCHWPBLEWROPX-SNVBAGLBSA-N 209.333 2.872 70 20 BFID C[C@H](N[C@H]1CCC[C@H](N(C)C)C1)c1ccco1 161092929 QTKUCEQYSIPTIF-AVGNSLFASA-N 236.359 2.803 70 20 BFID CCO[C@H](C)c1nccn1C[C@@H]1CCCCO1 161472989 IMJXILHAAOJEGZ-NEPJUHHUSA-N 238.331 2.550 70 20 BFID CCC1CCN(C(=O)C[C@H](C)SC)CC1 160550109 AMFIUYXUFAMHED-JTQLQIEISA-N 229.389 2.777 70 20 BFID CN(c1cc(Cl)nc(C2CC2)n1)C1CCC1 161055406 MCEAVQCRQHLGIA-UHFFFAOYSA-N 237.734 2.996 70 20 BFID CC[C@@H](SCc1c(C)cccc1C)C(N)=O 161379016 WZMWFMDLJSGTFR-GFCCVEGCSA-N 237.368 2.801 70 20 BFID CN(Cc1cccc(Cl)c1)C(=O)C(F)F 217612377 DFMVOVNWJFENEU-UHFFFAOYSA-N 233.645 2.564 70 20 BFID CCc1ccc(/C=C/S(=O)(=O)Cl)cc1 59312455 QDOWIEDTQWDTLR-BQYQJAHWSA-N 230.716 2.788 70 20 BFID CN(c1nc(C(C)(C)C)ns1)C1CCC1 159679850 HOJDDYIFPBHWTN-UHFFFAOYSA-N 225.361 2.824 70 20 BFID CN(Cc1cccc(F)c1)Cc1ccn(C)c1 160462107 VCHRXLCHEHYUBB-UHFFFAOYSA-N 232.302 2.796 70 20 BFID CC[C@H]1CCC[C@H](S(=O)(=O)Cl)C1 112429305 ZGNDGZJGXJYILS-YUMQZZPRSA-N 210.726 2.524 70 20 BFID C[C@@H]1CC(C)(C)CC[C@@H]1S(=O)(=O)Cl 123744519 CFYYMURGXCINQL-SFYZADRCSA-N 224.753 2.770 70 20 BFID CCC[C@@H](C(=O)Nc1nc(C)ns1)C(C)C 159557053 BSSJLKATBJIALJ-SECBINFHSA-N 241.360 2.857 70 20 BFID CC(=O)N1C[C@@H](C)CSc2ccccc21 159625586 DNLIUUGFDZIQDN-SECBINFHSA-N 221.325 2.781 70 20 BFID CCOCCCN1CCC[C@H]1CC(C)C 159938480 DYQSOGWVQRZSEI-ZDUSSCGKSA-N 213.365 2.924 70 20 BFID CCOC(=O)c1ccc(N[C@H](C)C2CCC2)nc1 159995331 PTQCBWRGQUTFBH-SNVBAGLBSA-N 248.326 2.859 70 20 BFID Cc1cnccc1CN[C@H](C)CC(C)C 160591326 SVLBRAYQRINZIC-GFCCVEGCSA-N 206.333 2.914 70 20 BFID C[C@H](CCc1ccc(F)cc1)NCC(C)(C)O 160656893 ORWNGBDHDUTAAX-LLVKDONJSA-N 239.334 2.507 70 20 BFID CCCCSCCC(=O)NC1CC=CC1 161007623 ITCSNWKTJYMLOY-UHFFFAOYSA-N 227.373 2.745 70 20 BFID C[C@@H](NC(C1CC1)C1CC1)c1cscn1 161173631 HIHIHLWNSZJUSC-MRVPVSSYSA-N 222.357 2.982 70 20 BFID CC[C@@H](C)[C@@H](C)Nc1ncccc1OC 159468188 WVKNXFBZQGHILS-NXEZZACHSA-N 208.305 2.937 70 20 BFID CCCC1(CNC(=O)N[C@@H](C)CC)CC1 160234011 OVUMZVMNUUBZAU-JTQLQIEISA-N 212.337 2.664 70 20 BFID CCN(Cc1c(C)nc2ccccn12)CC1CC1 160390777 LBMJGBWHRKGMBU-UHFFFAOYSA-N 243.354 2.875 70 20 BFID COC(CN1CCC[C@H]1C1CCCCC1)OC 160624107 QBHDJRYDKBRRFM-ZDUSSCGKSA-N 241.375 2.650 70 20 BFID COCC(C)(C)C(=O)Nc1ccc(C)cc1F 160625092 FIRHJESMZYEGOK-UHFFFAOYSA-N 239.290 2.745 70 20 BFID CCCC[C@@H](C(=O)OC)N(C)CCC(C)C 160797445 YJOBBKFGZZMFLX-LBPRGKRZSA-N 229.364 2.696 70 20 BFID COC[C@@H](NC[C@H]1CCc2ccccc21)C(C)C 160992933 YWMMHKAICHAUSK-GDBMZVCRSA-N 247.382 2.977 70 20 BFID CCCC[C@H](CC)CNC(=O)c1cc(C)ncn1 161461394 SXOWNLFIPRFVQH-LBPRGKRZSA-N 249.358 2.731 70 20 BFID C/C=C/C(=O)N[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C 217806807 QNKRFJLGNQTZGB-RWMIUETPSA-N 221.344 2.894 70 20 BFID CC[C@H](C)[C@@H](C)Nc1ncccc1OC 159468321 WVKNXFBZQGHILS-VHSXEESVSA-N 208.305 2.937 70 20 BFID Cc1ccc(CN(C)Cc2ccc(CO)o2)cc1 160637753 HCGRAALDQNQLBA-UHFFFAOYSA-N 245.322 2.712 70 20 BFID CSCC[C@H](C)N[C@@H](C)c1cscn1 161205028 LGLUAOOUUDMUJL-IUCAKERBSA-N 230.402 2.935 70 20 BFID CC[C@@H](C)CNCCSC(F)(F)F 161494513 ODTPDGHAVOOTLP-SSDOTTSWSA-N 215.284 2.875 70 20 BFID CC[C@H](SCC(=O)NC)c1ccc(F)cc1 161353777 ZXNPLNHESKPYBU-NSHDSACASA-N 241.331 2.756 70 20 BFID CC(C)(C)C[C@H](CO)Nc1ccnc(Cl)c1 161418083 LMRHOOHZAXOSKZ-SNVBAGLBSA-N 242.750 2.944 70 20 BFID Cc1cccc(C(=O)Nc2c(C)n[nH]c2C)c1F 161470176 OJUGNUPXNGXEFU-UHFFFAOYSA-N 247.273 2.726 70 20 BFID CCC(C)(C)C(=O)OC[C@@H]1CCC[C@@H](O)C1 217796583 CXERZLKKEUPKNT-GHMZBOCLSA-N 228.332 2.517 70 20 BFID OCCCSC/C=C\c1ccccc1 218051276 BKTQIEHRSLDSMF-YWEYNIOJSA-N 208.326 2.815 70 20 BFID O=S(=O)(Cl)[C@H]1CCCC12CCCC2 306499733 WSQXRYKKQRGFQJ-QMMMGPOBSA-N 222.737 2.668 70 20 BFID O=C(c1ccccc1)c1ccc([B-](F)(F)F)cc1 584644229 ZBYTXXJIRKAKSQ-UHFFFAOYSA-N 249.020 2.972 70 20 BFID CCOC(=O)[C@@H]1C[C@@H]1c1sccc1C 159363319 VLYVAOSUDBUWNY-DTWKUNHWSA-N 210.298 2.723 70 20 BFID Cc1ccccc1OCCN(C)C(=O)C1(C)CC1 160082594 GYLVINASVPKTLX-UHFFFAOYSA-N 247.338 2.632 70 20 BFID COCC(C)(C)C(=O)Nc1cc(C)ccc1F 160630681 BWWKALMUXHXOHV-UHFFFAOYSA-N 239.290 2.745 70 20 BFID CCCCCn1cc(-n2cccc2)cn1 159714531 LTKISFRPYIDFBJ-UHFFFAOYSA-N 203.289 2.864 70 20 BFID COc1ccc(CN(C)Cc2cncs2)cc1 159851995 POAUOVLVDUWBLF-UHFFFAOYSA-N 248.351 2.784 70 20 BFID Cc1cccc(N[C@H]2CCOC(C)(C)C2)n1 159996280 RPBGMWKFKFKVOW-NSHDSACASA-N 220.316 2.760 70 20 BFID CCOCCCSCCc1c(C)noc1C 160146437 ZRKWUIMZEDCOAU-UHFFFAOYSA-N 243.372 2.994 70 20 BFID Cc1ccc(C(=O)N2[C@H](C)CC[C@H]2C)o1 161412196 KANJTQUWRNTILQ-RKDXNWHRSA-N 207.273 2.601 70 20 BFID Cc1cccc(C(=O)N2[C@@H](C)CC[C@H]2C)c1O 161397635 AVOBGAWTBQOCHL-PHIMTYICSA-N 233.311 2.714 70 20 BFID CCC(CC)n1nccc1C(=O)N[C@@H](C)CC 160551989 OQPAARCXOFSVTL-JTQLQIEISA-N 237.347 2.773 70 20 BFID C[C@@H]1CCCCN1C(=O)NCC1CCCC1 217569301 UAZJAZSQLQXWBA-LLVKDONJSA-N 224.348 2.761 70 20 BFID Cc1ccc(CNc2cc(C(N)=O)ccc2C)o1 160016048 XTXDTCZHWGKEHB-UHFFFAOYSA-N 244.294 2.607 70 20 BFID CCC(CC)CNC(=O)N(C)[C@H](C)C1CC1 160581545 UVOGVTKDABMXBX-SNVBAGLBSA-N 226.364 2.863 70 20 BFID CC[C@@H](C)C(=O)NCc1ccc(F)cc1F 217382257 ZWJJQTBIELHTRE-MRVPVSSYSA-N 227.254 2.627 70 20 BFID CCC1(O)CCN(Cc2ccc(F)cc2)CC1 218393413 RQOKHQHRSQAOPI-UHFFFAOYSA-N 237.318 2.563 70 20 BFID CC1(NC(=O)NC[C@@H]2Cc3ccccc32)CCC1 159889204 YKCZELVSIFRVMR-LBPRGKRZSA-N 244.338 2.568 70 20 BFID 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247.298 2.501 70 20 BFID Fc1ccccc1CN(C[C@@H]1CCCO1)C1CC1 160775499 XIPDKPUACRBBAN-AWEZNQCLSA-N 249.329 2.969 70 20 BFID CCc1ncnc(N[C@@H](C)C2CCC2)c1F 218083617 NLJYVINMXYDMBA-QMMMGPOBSA-N 223.295 2.779 70 20 BFID COC(=O)[C@@H](C)CS[C@H]1C=CCCC1 161244242 GPONVVSTZMAOCT-UWVGGRQHSA-N 214.330 2.637 70 20 BFID CCC[C@H](C)CC(=O)Nc1cccc(F)n1 160911297 OQKPOZSKZDEGAM-VIFPVBQESA-N 224.279 2.986 70 20 BFID NC(=O)Nc1ccc(Cl)cc1-n1cccc1 159422143 YNQNBFKDNVUVFI-UHFFFAOYSA-N 235.674 2.621 70 20 BFID CCOCCCN1CC[C@@H](Nc2ccccc2)C1 160280654 SMFQOYMVFMMRLM-OAHLLOKOSA-N 248.370 2.599 70 20 BFID CCc1nc(CN[C@@H](C)c2ccc(C)cc2)n[nH]1 160289279 XAKRABCAEUNLBD-NSHDSACASA-N 244.342 2.526 70 20 BFID COC(=O)N1CCC[C@H]1C1CCCCC1 216789508 XRHJWTMIBZRBDM-NSHDSACASA-N 211.305 2.798 70 20 BFID CCOC(=O)[C@H]1C[C@H]1c1ccc(F)cc1F 217679174 ODBHUFHGOFVDOE-UWVGGRQHSA-N 226.222 2.631 70 20 BFID CCOCCC1(CNC(=O)[C@@H](C)CC)CCC1 160764542 HCBIRGDPBHHRNE-LBPRGKRZSA-N 241.375 2.746 70 20 BFID C[C@@H](O)C[C@@H]1CCCN1CCC(C)(C)C 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2.582 70 20 BFID Cc1cccc(O[C@@H](C)C(=O)NC2CC=CC2)c1 160993232 HJQKRSRZMJMZBL-LBPRGKRZSA-N 245.322 2.597 70 20 BFID COC(=O)C[C@@H](C)S[C@H]1C=CCCC1 161243843 ULLKVNUGRXERFM-ZJUUUORDSA-N 214.330 2.780 70 20 BFID CC[C@H]1CCCC[C@H]1NCCCc1cnn(C)c1 161422447 OZVWYSPFXBMRSF-LSDHHAIUSA-N 249.402 2.911 70 20 BFID CC1=CCN(C(=O)c2ccc3cc[nH]c3c2)CC1 160164769 HHMPUTSNIQPRMP-UHFFFAOYSA-N 240.306 2.960 70 20 BFID CC(C)OCCN1CC[C@@H]2CCCC[C@@H]21 159607643 UYJZJICSNFVCRO-STQMWFEESA-N 211.349 2.676 70 20 BFID CC[C@H](NCCC(C)(C)C)[C@@H]1CCCO1 159756550 GUSXOPCWWBMXQE-RYUDHWBXSA-N 213.365 2.970 70 20 BFID CCCOC(=O)c1ccc(C(F)(F)F)cn1 161175774 JMAPRQDIMPLENR-UHFFFAOYSA-N 233.189 2.667 70 20 BFID CCC1(CNC(=O)C[C@H](C)c2ccncc2)CC1 161293518 KATHXBZFKKMZTI-LBPRGKRZSA-N 246.354 2.882 70 20 BFID CC[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCCCO1 161431613 NUSDFTMUFPLNRQ-AGIUHOORSA-N 239.359 2.641 70 20 BFID Cc1cc(NC(=O)CC2=CCCCC2)c[nH]c1=O 159367828 HFBPXOQPJKOWMO-UHFFFAOYSA-N 246.310 2.512 70 20 BFID 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CCCc1noc(CN2CC[C@@H]3CCCC[C@@H]32)n1 160547062 JWSVVMIHSDQLLY-RYUDHWBXSA-N 249.358 2.787 70 20 BFID CCC(C)(CC)C(=O)NC[C@H](C)SC 159361392 OVWGJNKJFUMFJN-VIFPVBQESA-N 217.378 2.680 70 20 BFID CCC(C)(CC)C(=O)Nc1cc(N(C)C)ccn1 159472241 WYBCLBODZZXFBZ-UHFFFAOYSA-N 249.358 2.912 70 20 BFID CC[C@]1(C)C[C@@H]1C(=O)Nc1ccnn1CC(C)C 159993184 IXBDGVJMEWTQHH-BXUZGUMPSA-N 249.358 2.914 70 20 BFID CCC[C@@H](C)CC(=O)NCCc1cccc(O)c1 160241828 ZUHITXORMJGOLD-GFCCVEGCSA-N 249.354 2.877 70 20 BFID CCCC(=O)Nc1ccc(F)c(OC)c1 160556683 WFBNLGNDWXYCHL-UHFFFAOYSA-N 211.236 2.573 70 20 BFID CC[C@H](Cc1ccc(C)cc1)NCC(C)(C)O 160608478 ZAOVPNSCTZSDEN-CQSZACIVSA-N 235.371 2.677 70 20 BFID N#CN(Cc1nccs1)c1ccccc1 161407604 SGOPSWJMOHJQAY-UHFFFAOYSA-N 215.281 2.631 70 20 BFID O=S(=O)(Cl)[C@H]1CCCCCC[C@H]1F 238853585 KHJXYHJPLCMBND-SFYZADRCSA-N 228.716 2.616 70 20 BFID in-vitro CCc1ccc(CN(C)C[C@H]2CCC[C@@H]2O)cc1 159476568 AADYFTOOFCXIIQ-CVEARBPZSA-N 247.382 2.842 70 20 BFID O=C(Cc1ccsc1)NCC1(C2CC2)CC1 160084924 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70 20 BFID CC[C@H](C)OCC(=O)N1CC[C@H](CC(C)C)C1 159433511 ARDPTLWFAPNUPY-QWHCGFSZSA-N 241.375 2.696 70 20 BFID CCC(CC)CNC(=O)N(C)[C@H](C)CC 160570572 ZNGDVZLHZYRFTB-SNVBAGLBSA-N 214.353 2.863 70 20 BFID Fc1ccccc1CN(C[C@H]1CCCO1)C1CC1 160775639 XIPDKPUACRBBAN-CQSZACIVSA-N 249.329 2.969 70 20 BFID CCCCn1ncc(Nc2ccnc(C)n2)c1C 161115472 BVTSBMWHNNNGSP-UHFFFAOYSA-N 245.330 2.834 70 20 BFID COc1cc(F)cc(NC(=O)C(C)(C)C)c1 161362432 AYICCNPWCLRSHX-UHFFFAOYSA-N 225.263 2.819 70 20 BFID CC[C@@H]1CCCC[C@@H]1CS(=O)(=O)Cl 307128616 XAIIWNAHVAYVEU-RKDXNWHRSA-N 224.753 2.771 70 20 BFID Cc1noc(C)c1CN(C)OCc1ccccc1 159628967 UNNDCAKTTUHHPF-UHFFFAOYSA-N 246.310 2.855 70 20 BFID C[C@H](NCCc1ccc2c(c1)OCO2)C1(C)CC1 161143356 DVWKSNKVXSTUNX-NSHDSACASA-N 247.338 2.736 70 20 BFID Cc1ccc([C@@H](C)N(C)CCn2ccnc2)cc1 159750509 SHHYSRFYNUABBS-CQSZACIVSA-N 243.354 2.885 70 20 BFID CCC[C@H]1CCCN(c2ccnc(C)n2)C1 160590411 ZJDDTVMVIXJZHO-LBPRGKRZSA-N 219.332 2.802 70 20 BFID CC[C@@H](NC(=O)NC1(C)CCC1)c1ccncc1 161485649 DHRPHISIYCFZPO-GFCCVEGCSA-N 247.342 2.775 70 20 BFID CC1(C)CCC[C@@H](S(=O)(=O)Cl)C1 112492661 TYDBGIYIDBZHNG-SSDOTTSWSA-N 210.726 2.524 70 20 BFID COc1ccc(N(C)C(=O)C(C)C)cc1Cl 159981318 XQSVLOKZWMQRLO-UHFFFAOYSA-N 241.718 2.967 70 20 BFID Cc1ccc(C)c(NC(=O)c2cc(C)ncn2)c1 161130614 QPXFSFDQQVHIAW-UHFFFAOYSA-N 241.294 2.654 70 20 BFID C[C@H]1C[C@H](C)N(Cc2cccc(O)c2)C1 161297772 IWPHKJRLIGFHKY-QWRGUYRKSA-N 205.301 2.623 70 20 BFID Cc1cccc(C)c1CS[C@H]1CCN(C)C1=O 161387162 CNHBEFHEEYFJIA-ZDUSSCGKSA-N 249.379 2.767 70 20 BFID Cc1cccc([C@@H]2CCCN2Cc2ccon2)n1 160239583 HOQFKOPKDXTENI-AWEZNQCLSA-N 243.310 2.715 70 20 BFID CC[C@H](C)CN(C)CCCN1CCCCC1 161048177 VZBTUYRXZSVGQI-AWEZNQCLSA-N 226.408 2.840 70 20 BFID CCCCNC(=O)NCC1(CCC)CC1 160234273 FDLOZCCWZLEAAP-UHFFFAOYSA-N 212.337 2.666 70 20 BFID CC(C)C[C@@H](C)NC(=O)N[C@H]1C=CCCC1 160266848 WKGPQKAOMZZOAP-NEPJUHHUSA-N 224.348 2.829 70 20 BFID Cc1nccc(NC(=O)N(C)C2CC2)c1Cl 159729271 FAFYCCYXWOHFMW-UHFFFAOYSA-N 239.706 2.670 70 20 BFID CCC[C@@H]1C[C@H]1NC(=O)C[C@@H](C)c1ccncc1 160856524 NLVGYWWGNHDZTO-MRVWCRGKSA-N 246.354 2.880 70 20 BFID CCC(C)(CC)C(=O)Nc1ccc2[nH]nnc2c1 159463901 WSGHLMKOZYUUIS-UHFFFAOYSA-N 246.314 2.723 70 20 BFID CCCCOC(=O)[C@H](C)Sc1ccncc1 159973510 GUNLMYXEDXEKDC-JTQLQIEISA-N 239.340 2.906 70 20 BFID Cc1nc(NC(=O)CCC2CC2)cc(C2CC2)n1 160266801 WAFXPTJSXZLDAE-UHFFFAOYSA-N 245.326 2.791 70 20 BFID COc1cccc(N[C@@H]2C[C@@H](C)N(C)C[C@@H]2C)c1 217922948 DFIFMZKHUOGYBI-YWPYICTPSA-N 248.370 2.836 70 20 BFID C1=CC[C@H](CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CC1 159523144 QQAVVJDNYBSUOY-XQLPTFJDSA-N 247.382 2.890 70 20 BFID COc1cccnc1NC[C@H]1CCCCS1 160253177 WIVSLCFGHDZMFN-SNVBAGLBSA-N 238.356 2.788 70 20 BFID CCO[C@H](C)c1nccn1CCCSC 161493849 YGBYWGIFDWCHHU-SNVBAGLBSA-N 228.361 2.734 70 20 BFID CS[C@@H](C)CNC(=O)c1cccc(C)c1F 159470430 XUAJLCLQZOQAFS-VIFPVBQESA-N 241.331 2.615 70 20 BFID Cc1cc(NC(=O)NOCC(C)C)ccc1F 160045551 NSXLZPZJDSQCSM-UHFFFAOYSA-N 240.278 2.843 70 20 BFID Cc1ncsc1CN[C@H](C)c1cscn1 161190927 LSQCMKWJANUXCV-SSDOTTSWSA-N 239.369 2.759 70 20 BFID CCC(=O)c1cccc(NC(=O)c2cc[nH]c2)c1 160714686 XNCZARWQFVNMIE-UHFFFAOYSA-N 242.278 2.860 70 20 BFID C/C=C/COC(=O)COc1ccc(CC)cc1 217395477 BJKIELMIIFHPQB-HWKANZROSA-N 234.295 2.747 70 20 BFID CCc1ccc(CN(C)C[C@@H]2CCC[C@@H]2O)cc1 159476431 AADYFTOOFCXIIQ-HOTGVXAUSA-N 247.382 2.842 70 20 BFID CC(C)c1ccc(C(=O)N(C)C(C)C)cn1 160669737 HXHXKBNXVMDNCA-UHFFFAOYSA-N 220.316 2.685 70 20 BFID CC(C)Cc1noc(CSCCCF)n1 161444505 TZHUGIQWOATVNJ-UHFFFAOYSA-N 232.324 2.861 70 20 BFID CC(C)=CCN1CCN(C)C[C@@H]1c1ccccc1 216737272 YPZDYTYERZTKNN-MRXNPFEDSA-N 244.382 2.941 70 20 BFID CN(C[C@@H]1CCCOC1)C(=O)CCC(C)(C)C 159441914 KLXRVVWLXQNXJV-LBPRGKRZSA-N 241.375 2.698 70 20 BFID CC[C@H](C)CNCc1cc(O)cc(F)c1 159600485 DQOJBKHCVGOOEB-VIFPVBQESA-N 211.280 2.667 70 20 BFID COc1cccnc1NC[C@@H]1CCCCS1 160253029 WIVSLCFGHDZMFN-JTQLQIEISA-N 238.356 2.788 70 20 BFID C[C@@H](NC[C@H]1CCCS1)c1cscn1 161223283 QSDQHCTUCQJVQP-RKDXNWHRSA-N 228.386 2.689 70 20 BFID CCc1nc(C2(NC3CCCC3)CCCC2)no1 161380040 PKEGRZQCSGXYFI-UHFFFAOYSA-N 249.358 2.934 70 20 BFID CC[C@@H](C)CN(C)C(=O)c1cccc2[nH]cnc12 159487912 UAWDCXCHPPYIDZ-SNVBAGLBSA-N 245.326 2.681 70 20 BFID COc1ccc(N(C)C(=O)C=C(C)C)cc1F 159602665 ZAEGZZLWGPHSRO-UHFFFAOYSA-N 237.274 2.763 70 20 BFID CC[C@H]1CCC[C@@H]1NC(=O)CC[C@@H]1CCCO1 159641129 OSIUBVNCBQKEGC-AVGNSLFASA-N 239.359 2.641 70 20 BFID C[C@@H](NC[C@H]1CCCC[C@@H]1O)C(C)(C)C 160602969 WJVFPHVPEZFPNL-UTUOFQBUSA-N 213.365 2.562 70 20 BFID CCCCCn1cnc(C(C)C)cc1=O 160844722 KYINMDXZKNMOGJ-UHFFFAOYSA-N 208.305 2.557 70 20 BFID O=C(c1ccccc1F)N1[C@H]2C=CC[C@H]1CC2 218689731 HOSHEUABUOIBMY-QWRGUYRKSA-N 231.270 2.759 70 20 BFID CC(C)CNC(=S)NCC(C)(C)C(C)C 218745825 HMHOVUIXORGONA-UHFFFAOYSA-N 230.421 2.789 70 20 BFID CC[C@H](C)C(=O)N[C@H](CC)c1c(C)noc1C 160286272 BOXJMGMCERSZIK-GZMMTYOYSA-N 238.331 2.905 70 20 BFID CCC(CC)CN1CCC[C@H]1C[C@@H](C)O 161046076 FRAFJSFHUAOWGX-YPMHNXCESA-N 213.365 2.658 70 20 BFID Cn1ccc2c(C(=O)NC3CC=CC3)cccc21 160943944 VVTJXGVNPFJJSJ-UHFFFAOYSA-N 240.306 2.627 70 20 BFID Cc1cc(C)cc(NC(=O)N[C@]2(C)CCOC2)c1 159399404 MVUUSGCNOZQUTF-CQSZACIVSA-N 248.326 2.604 70 20 BFID Cc1cc(CN[C@@]2(C)CCOC2)c(C)s1 160188099 OTXFAZXCSRVHMS-LBPRGKRZSA-N 225.357 2.634 70 20 BFID CSC[C@H](C)Nc1nc2ccccc2n1C 160551844 LPNUJAAAXKSQOL-VIFPVBQESA-N 235.356 2.737 70 20 BFID CC[C@@H](c1ccc(F)cc1)N1CCC[C@@H](O)C1 217237908 LGVBWOMLRSHCLR-KGLIPLIRSA-N 237.318 2.734 70 20 BFID CCN(C(=O)C[C@@H](C)SC)C1CCCC1 159915086 SMYFKHRATMJIKT-SNVBAGLBSA-N 229.389 2.919 70 20 BFID CC(C)C[C@H](C)NC(=O)NC[C@@H]1CCCS1 160172722 HKMUHBVRDWENJE-QWRGUYRKSA-N 244.404 2.616 70 20 BFID CS[C@@H](C)CC(=O)Nc1ccc(Cl)cn1 160641280 IIRWCQQMASNGPF-ZETCQYMHSA-N 244.747 2.815 70 20 BFID COc1ccsc1C(=O)N1[C@H](C)CC[C@H]1C 161495212 NYTBPICUVVHRGL-RKDXNWHRSA-N 239.340 2.770 70 20 BFID CCCC1(CNC(=O)[C@H](C)CSC)CC1 160772805 PFEPNAFNULQEMZ-SNVBAGLBSA-N 229.389 2.682 70 20 BFID C[C@H]1CCN(C(=O)Nc2cccnc2)C[C@H](C)C1 160818672 OKMNBLQCWIRYMU-NWDGAFQWSA-N 247.342 2.982 70 20 BFID Cc1cccc(OC[C@@H]2CCCO2)c1C 217800463 VKUDXEVBFAGCTA-LBPRGKRZSA-N 206.285 2.861 70 20 BFID O=S(=O)(Cl)[C@H]1CCCCCC[C@@H]1F 238853586 KHJXYHJPLCMBND-YUMQZZPRSA-N 228.716 2.616 70 20 BFID in-vitro Cc1ccc(NC(=O)N(C)CCC2CC2)cn1 160577787 YKDLLMZPKAKUAC-UHFFFAOYSA-N 233.315 2.654 70 20 BFID CC(C)c1nccc(N[C@H]2CCOC(C)(C)C2)n1 160659205 PNRRCUOLTCYVEG-NSHDSACASA-N 249.358 2.970 70 20 BFID CC(C)OCCN[C@@H]1CCC[C@H](C)[C@@H]1C 217617659 IEDNMTVWHAYOBA-RWMBFGLXSA-N 213.365 2.826 70 20 BFID O=C([C@@H]1CC=CCC1)N1[C@H]2C=CC[C@H]1CC2 218705866 AZBXEBUQPCNFGR-AGIUHOORSA-N 217.312 2.662 70 20 BFID C/C=C/C=C/C(=O)N(C)c1ccc2c(c1)OCO2 160510269 IVMLHCDUXUDBEP-VNKDHWASSA-N 245.278 2.510 70 20 BFID CC[C@H](C)C(=O)NCCCSCC(C)C 160666170 ZDEQZPRRPAJCAS-NSHDSACASA-N 231.405 2.928 70 20 BFID CC[C@@H](C)[C@H](C)NCCc1ccc2c(c1)OCO2 161114795 YYENBSUFPIMEJC-NEPJUHHUSA-N 249.354 2.982 70 20 BFID CC(C)CNC(=O)NCCCCc1ccccc1 217269578 AOYWKKMBGSDIHO-UHFFFAOYSA-N 248.370 2.965 70 20 BFID C[C@H]1CCN(CCOCc2ccccc2)C1 217779553 INGMJGQYSFKUNV-ZDUSSCGKSA-N 219.328 2.545 70 20 BFID CC(C)[C@@H]1CCCC[C@@H]1S(=O)(=O)Cl 125875428 SJRUDTHFHAOZSM-IUCAKERBSA-N 224.753 2.770 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)c1ccnc(F)c1 159756689 HAKHNUYUPMPVJH-GXSJLCMTSA-N 236.290 2.529 70 20 BFID CCNC(=O)CN(c1cc(C)ccc1C)C(C)C 160743234 CLKSINQOXLRAIK-UHFFFAOYSA-N 248.370 2.654 70 20 BFID CCCC1(CNC(=O)c2cc[nH]c2C)CC1 160751920 FMDAKYPJIJMLDL-UHFFFAOYSA-N 220.316 2.633 70 20 BFID CC[C@H](COC)NC[C@@H]1CCc2ccccc21 161001076 SBUZNEWLSZDZEE-UONOGXRCSA-N 233.355 2.731 70 20 BFID Cc1ccc([C@H](C)S(=O)(=O)Cl)c(C)c1 88251469 WWGMOOSNPUEZLD-VIFPVBQESA-N 232.732 2.933 70 20 BFID O=C(NCC1(C2CC2)CC1)c1ccc(F)cc1 160165282 RLESSHARAURWAV-UHFFFAOYSA-N 233.286 2.746 70 20 BFID O=C(C(F)F)N1CCC[C@@H]1c1cccs1 217644088 UZTZYYRFIOCVOG-SSDOTTSWSA-N 231.267 2.677 70 20 BFID CC[C@@H](NC(=O)C(C)(CC)CC)[C@@H]1CCCO1 159508827 XVVYYSDIPLPLJA-NEPJUHHUSA-N 241.375 2.887 70 20 BFID CC(=O)OCCCCSc1ccncc1 159970553 AMCOPHCYYBODJU-UHFFFAOYSA-N 225.313 2.517 70 20 BFID CC[C@H](C)NC(=O)c1cc(C)c(F)c(C)c1 160464396 KMEANRIOTGBSGM-JTQLQIEISA-N 223.291 2.971 70 20 BFID Cc1cc(NCc2ccc3c(c2)OCO3)ccn1 160911088 WBFYNCPCQQVSCV-UHFFFAOYSA-N 242.278 2.731 70 20 BFID CC[C@@H](C)CN(C)CCCN1CCCCC1 161048072 VZBTUYRXZSVGQI-CQSZACIVSA-N 226.408 2.840 70 20 BFID CC(C)C[C@@H](CO)NC(=O)C(C)(C)CC(C)C 161265904 FEIGLPYQNKWTBR-LBPRGKRZSA-N 243.391 2.582 70 20 BFID Cc1cccc(C(=O)N2[C@@H](C)CC[C@@H]2C)c1O 161397762 AVOBGAWTBQOCHL-QWRGUYRKSA-N 233.311 2.714 70 20 BFID CC1(C)CCC[C@H](S(=O)(=O)Cl)CC1 114438776 SQMDHQKOUSQALT-QMMMGPOBSA-N 224.753 2.914 70 20 BFID Cc1cccc([C@H]2CCCN2CC2CC2)n1 159926204 YTJLZOVBPPMPMR-CQSZACIVSA-N 216.328 2.937 70 20 BFID CC[C@H](C)C(=O)N[C@H]1CCc2c(OC)cccc21 160152284 LOKFMQKOXIVBQE-GWCFXTLKSA-N 247.338 2.845 70 20 BFID CC1(NC(=S)Nc2ccccc2)CCC1 159966184 XWAXPWMHMNAPGA-UHFFFAOYSA-N 220.341 2.916 70 20 BFID COc1cc(C)cc(Br)c1C(C)=O 217366731 GLWCCFUUWAJGIZ-UHFFFAOYSA-N 243.100 2.969 70 20 BFID CCC1(CNC(=O)NCC2(C3CC3)CC2)CC1 159457334 SXMMMNWARJYIAK-UHFFFAOYSA-N 236.359 2.666 70 20 BFID CC(C)(C)CCC(=O)NCc1cccc(O)c1 160225289 FWWWXMUTDQCZMT-UHFFFAOYSA-N 235.327 2.835 70 20 BFID Cc1cc(N)nc(S[C@H]2C=CCCC2)n1 161027250 UGGDSMSVBDBHBZ-VIFPVBQESA-N 221.329 2.568 70 20 BFID CC(C)n1cccc1C(=O)N1CCCCC1 160442663 LQZUOMVOJUCHBZ-UHFFFAOYSA-N 220.316 2.695 70 20 BFID CCCCCSCCCCS(C)(=O)=O 160953717 JHNVCGMLHOZJID-UHFFFAOYSA-N 238.418 2.735 70 20 BFID CCO[C@@H](C)c1nccn1C[C@@H]1CCCCO1 161472880 IMJXILHAAOJEGZ-RYUDHWBXSA-N 238.331 2.550 70 20 BFID O=S(=O)(Cl)[C@H]1CCC[C@H](C2CC2)C1 113180260 YXRYPEINJRQRPS-IUCAKERBSA-N 222.737 2.524 70 20 BFID C[C@@H](O)[C@@H](C)Sc1nc(C(C)(C)C)ns1 159757199 AJBRKFFGSGQHSQ-RNFRBKRXSA-N 246.401 2.697 70 20 BFID CCOCCCN(C)C(C1CC1)C1CC1 159868173 CFQXDUCNKMJABO-UHFFFAOYSA-N 211.349 2.533 70 20 BFID CCCCN(CCCC)C(=O)[C@H]1CCCCO1 160943475 URZCRUBFFQVOPA-CYBMUJFWSA-N 241.375 2.984 70 20 BFID CNC(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1 160003069 ZIANHUZPQIZVDN-CHWSQXEVSA-N 241.375 2.888 70 20 BFID CSC[C@@H](CCO)N[C@@H](C)c1cccs1 160208193 ABECPGCRJUGVBO-VHSXEESVSA-N 245.413 2.513 70 20 BFID Cc1cccc(C)c1CN[C@@H]1C[C@H]2CC[C@@H]1O2 160387412 CWYQQCHERYECFR-YUELXQCFSA-N 231.339 2.713 70 20 BFID CCOC(=O)c1ccc(N[C@@H](C)C2CCC2)nc1 159995242 PTQCBWRGQUTFBH-JTQLQIEISA-N 248.326 2.859 70 20 BFID Cc1noc(C)c1CCSCCOC(C)C 160139417 YEXZOLDATLGAES-UHFFFAOYSA-N 243.372 2.992 70 20 BFID Cc1cc(C(=O)N(C)C2CCCCCC2)ncn1 161432649 QOEQMAZMLFBBHZ-UHFFFAOYSA-N 247.342 2.580 70 20 BFID CC[C@@H]1CC[C@@H](C)N1C(=O)NC(C)(C)C 161481446 FONWFLAVDHVTMV-NXEZZACHSA-N 212.337 2.757 70 20 BFID Cc1ccc(F)cc1NC(=O)[C@@H]1CCCCO1 159515858 NPMKYRJJQOJJGO-LBPRGKRZSA-N 237.274 2.642 70 20 BFID CCOC(C)(C)CNc1nc2ccccc2n1C 159540051 AHELMWKOJPIBKX-UHFFFAOYSA-N 247.342 2.800 70 20 BFID Cc1ccc2c(c1)OCCC[C@H]2NCC(C)(C)O 160603482 XKZYTHJMIFYGDF-CYBMUJFWSA-N 249.354 2.569 70 20 BFID Cc1nc(COC(=O)CCC2CC2)c(C)s1 161428669 FHZCUFGBDPYQIB-UHFFFAOYSA-N 239.340 2.993 70 20 BFID COC(=O)c1ccc(NC[C@@H]2CC2(C)C)nc1C 218016558 QBCOYVBQZWLVQI-JTQLQIEISA-N 248.326 2.635 70 20 BFID CCCC[C@H](CC)CC(=O)NC[C@H](O)C(C)C 159747073 ORZARKQJJZWWLH-STQMWFEESA-N 243.391 2.726 70 20 BFID O=C(NC1CC=CC1)c1coc2ccccc12 160845985 TWLQSHWJCGLWGU-UHFFFAOYSA-N 227.263 2.881 70 20 BFID C[C@@H](CCS(=O)(=O)Cl)c1ccccc1 88251416 JWSJNUCERBNFBP-VIFPVBQESA-N 232.732 2.749 70 20 BFID CCCC(=O)N[C@@H](C)c1cccc(C)c1 160324893 VMGMANVVRRFFFR-NSHDSACASA-N 205.301 2.972 70 20 BFID CC[C@H](C)NC(=O)[C@H](C)c1c(F)cccc1F 160465552 CIFVEUSNWHWITF-DTWKUNHWSA-N 241.281 2.983 70 20 BFID Cc1nc2ccccn2c1CN(C)C1CCC1 160800348 ZYKXNCSJYAIKIM-UHFFFAOYSA-N 229.327 2.627 70 20 BFID CC[C@@H](c1ccncc1)N(CC)C(=O)NC(C)C 160827285 BWXHFWFLUUEFLM-ZDUSSCGKSA-N 249.358 2.973 70 20 BFID CC(C)OCC(=O)N1CC=C(C(C)(C)C)CC1 160957712 KHEMEWJIIGLWDU-UHFFFAOYSA-N 239.359 2.616 70 20 BFID CC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 159835407 JJWOCMQYCZFTMF-OAHLLOKOSA-N 240.306 2.616 70 20 BFID CC(C)C[C@H](C)CC(=O)N[C@@H](CO)CC(C)C 160912217 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CCn1nccc1CNCc1ccc(C)cc1C 160041219 BDCBAQWFRZUCCE-UHFFFAOYSA-N 243.354 2.810 70 20 BFID CC1=CCN(C(=O)c2ccc(F)cc2)CC1 160174630 GTDXTLMLUFFOCY-UHFFFAOYSA-N 219.259 2.618 70 20 BFID CCCC1(CNC(=O)CC[C@H]2CCCO2)CC1 160747071 NYXNRZQJINOAMG-GFCCVEGCSA-N 239.359 2.642 70 20 BFID COc1cc(NC[C@@H]2CCC=CO2)ccc1F 159950829 OGTLTRSTOMEKHV-NSHDSACASA-N 237.274 2.939 70 20 BFID CCOc1ccccc1C(=O)NC1CC=CC1 160922399 JBWLKPGPVPLKTM-UHFFFAOYSA-N 231.295 2.534 70 20 BFID Cn1nccc1CSc1nc2ccccc2[nH]1 161194432 OCIMSUPZZBAASV-UHFFFAOYSA-N 244.323 2.589 70 20 BFID CN(CC[C@@H]1CCCN1C)Cc1ccsc1 161309630 UEAKVGKFUCURHN-ZDUSSCGKSA-N 238.400 2.664 70 20 BFID CC(C)CCNC(=O)N1CC[C@@H](C)[C@H](C)C1 159657241 JAFIBJKEASBCTD-VXGBXAGGSA-N 226.364 2.720 70 20 BFID C[C@@]1(Nc2nc3ccccc3s2)CCOC1 160076428 DBSCEMMKXWVXRC-GFCCVEGCSA-N 234.324 2.887 70 20 BFID C[C@H](CO)SCc1ncc(C(C)(C)C)o1 160774992 HNJZUYDWNLNJQV-MRVPVSSYSA-N 229.345 2.586 70 20 BFID CC(=O)c1ccc(N2C[C@@H](C)C[C@@H]2C)nc1 161418677 AFZVTGIWDPKMNL-UWVGGRQHSA-N 218.300 2.519 70 20 BFID O=C(NCC1(C2CC2)CC1)C1CCCCC1 160083803 NYOAHJAAKPKOIQ-UHFFFAOYSA-N 221.344 2.873 70 20 BFID CC1=CCN(C(=O)c2ccc3[nH]ccc3c2)CC1 160162522 ZYXWPLTZXGTKJY-UHFFFAOYSA-N 240.306 2.960 70 20 BFID O=C(NC1CC=CC1)C1(c2ccccc2)CCC1 161078069 JJDNGJLUJMGCLJ-UHFFFAOYSA-N 241.334 2.943 70 20 BFID C[C@H](O)CN(C)[C@@H]1CCCc2ccc(F)cc21 159385505 XONFPJFWBWIZIN-IINYFYTJSA-N 237.318 2.516 70 20 BFID CS[C@H](C)CNC(=O)c1ccc(C)cc1F 159465067 JGUCHTUPFPDXAE-SECBINFHSA-N 241.331 2.615 70 20 BFID CC[C@@H](C)C(=O)N[C@H]1CCOC2(CCCC2)C1 159916652 LNFHNYJEXGYPFQ-NEPJUHHUSA-N 239.359 2.641 70 20 BFID CCN1CCCC[C@H]1CNC(C1CC1)C1CC1 161170359 GJWJLSXEAPNJAM-AWEZNQCLSA-N 236.403 2.639 70 20 BFID CCCN(CCCN1CCCCC1)C1CC1 160910733 VHRIIKLQNUDYRN-UHFFFAOYSA-N 224.392 2.737 70 20 BFID COC(=O)C[C@@H](C)S[C@@H]1C=CCCC1 161244073 ULLKVNUGRXERFM-NXEZZACHSA-N 214.330 2.780 70 20 BFID CC(C)CC(=O)N[C@H]1CCOC2(CCCC2)C1 160169120 JIDDGHWRHXTGEE-LBPRGKRZSA-N 239.359 2.641 70 20 BFID COCCCN1CCC[C@H]1c1cccc(C)n1 160281126 AMNQGGMJCOCXRT-AWEZNQCLSA-N 234.343 2.563 70 20 BFID C[C@@H]1CCN(C(=O)Nc2cccnc2)C[C@H](C)C1 160818534 OKMNBLQCWIRYMU-VXGBXAGGSA-N 247.342 2.982 70 20 BFID CCOCCSCc1c(CC)noc1C 160009624 UIWVNZGWSMQETR-UHFFFAOYSA-N 229.345 2.815 70 20 BFID CC(C)N(C(=O)[C@H]1CCCCO1)C1CCCC1 160859860 KIACNMUPWJNPBE-CYBMUJFWSA-N 239.359 2.735 70 20 BFID CC[C@@H]1CCN(CCCN2CCCCC2)C1 161510103 AMRJISGEAIJIRW-CQSZACIVSA-N 224.392 2.594 70 20 BFID COc1cccc(C(=O)N2[C@H]3C=CC[C@H]2CC3)c1 218692133 OJOVKNJALVBDQL-STQMWFEESA-N 243.306 2.628 70 20 BFID CC[C@H]1CCC[C@H]1NC(=O)CC(F)(F)F 159524274 DGOHHXCEAOYATC-JGVFFNPUSA-N 223.238 2.634 70 20 BFID Cc1cc(C)cc(CN(C)C[C@H]2CCC[C@@H]2O)c1 159685397 CPJQEWKVKYNALW-CVEARBPZSA-N 247.382 2.896 70 20 BFID CC[C@@H](C)C(=O)NCCCSCC(C)C 160666045 ZDEQZPRRPAJCAS-LLVKDONJSA-N 231.405 2.928 70 20 BFID Cc1cc(NC[C@@H](C)CN2CCCCC2)ccn1 160918137 HNHBSIASNJUFHY-CYBMUJFWSA-N 247.386 2.924 70 20 BFID C[C@H]1CCC[C@@H](CNc2cnccn2)C1 217920599 OFJOZDFYSZYEJW-WDEREUQCSA-N 205.305 2.715 70 20 BFID C[C@H](OC(=O)[C@H]1CCCCO1)c1ccccc1 160003878 BYCXLEDGTSYALR-WCQYABFASA-N 234.295 2.860 70 20 BFID CC[C@H](NC(=O)C1CC=CC1)c1c(C)noc1C 160661764 QVOQQIAZWGCIEY-LBPRGKRZSA-N 248.326 2.825 70 20 BFID CCc1nc(CN[C@H](C)c2ccccc2C)n[nH]1 160269210 LIWSHNNLNOBASB-LLVKDONJSA-N 244.342 2.526 70 20 BFID CCCC[C@@H](C(=O)OC)N1CCCCCC1 160796292 AECDIKDNKUXOEQ-LBPRGKRZSA-N 227.348 2.594 70 20 BFID O=S(=O)(Cl)/C=C(\F)c1ccccc1 252523288 CGPXKURCIDYBMB-VURMDHGXSA-N 220.652 2.523 70 20 BFID in-vitro COCCCCCSc1ccncc1 159872605 RSMNKZQGQIHLDK-UHFFFAOYSA-N 211.330 2.990 70 20 BFID CC1(NCc2cc(F)ccc2F)CCC1 159995533 AMNHDOAFRVNVMI-UHFFFAOYSA-N 211.255 2.997 70 20 BFID CC1=CCN(C(=O)c2cccc(Cl)n2)CC1 160173402 VEUVCUCEDCDOIS-UHFFFAOYSA-N 236.702 2.527 70 20 BFID CCC(CC)n1nccc1C(=O)N[C@H](C)CC 160551855 OQPAARCXOFSVTL-SNVBAGLBSA-N 237.347 2.773 70 20 BFID C1CCC(NC[C@H]2COC3(CCCC3)O2)CC1 218363333 KSOSWINQIXRKKF-ZDUSSCGKSA-N 239.359 2.594 70 20 BFID Cc1ccc(C(=O)N(C)Cc2cccn2C)s1 160921385 GYRHEVZIDHMHDH-UHFFFAOYSA-N 248.351 2.667 70 20 BFID COc1ccnc(NC[C@H]2CCC[C@@H](C)C2)n1 217925694 SGIQNNWPAXOZCZ-MNOVXSKESA-N 235.331 2.723 70 20 BFID CC(C)c1nccc(N[C@H]2CC[C@@H](CO)CC2)n1 161329801 AYPMZDRBETZWMH-HAQNSBGRSA-N 249.358 2.563 70 20 BFID O=S(=O)(Cl)CC(C1CCC1)C1CCC1 238856554 WFDLDIWMIZXRHR-UHFFFAOYSA-N 236.764 2.771 70 20 BFID CC(C)Oc1cccnc1NCC1CC1 159444964 URSDJRSDLYHZGY-UHFFFAOYSA-N 206.289 2.691 70 20 BFID Cc1cccc(C(=O)NCC2(C3CC3)CC2)c1 159777308 VCOWSJKIWLWBMS-UHFFFAOYSA-N 229.323 2.915 70 20 BFID COc1ccc(CN(C)Cc2ccn(C)c2)cc1 159857578 DOWCMIVJXNFPNN-UHFFFAOYSA-N 244.338 2.666 70 20 BFID CCOCCC1(C(=O)NCCC(C)C)CCC1 160554899 GSKPBGKTKLRGOG-UHFFFAOYSA-N 241.375 2.746 70 20 BFID CCCNc1cc(N2C[C@H]3CCC[C@H]3C2)ncn1 160585764 ONAGTEWYSSEUIX-TXEJJXNPSA-N 246.358 2.535 70 20 BFID CC1CCC(CNC(=O)[C@@H]2CC2(C)C)CC1 160786506 JBBBDRUNQNYQKX-MCIGGMRASA-N 223.360 2.975 70 20 BFID O=C(C(F)F)N1CCC[C@H]1c1cccs1 217644173 UZTZYYRFIOCVOG-ZETCQYMHSA-N 231.267 2.677 70 20 BFID 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20 BFID C[C@@H](c1ccco1)N(C)CCOCC1CC1 159757927 BPPUGLZNHCLWPM-NSHDSACASA-N 223.316 2.699 70 20 BFID Cc1ccc(C(=O)N(C)Cc2cccn2C)cc1 160668777 PPTMJNYHEFDXMX-UHFFFAOYSA-N 242.322 2.606 70 20 BFID Cc1cccc(C(=O)Nc2ccncc2)c1F 161419510 SHCUTMAZHXRWJW-UHFFFAOYSA-N 230.242 2.781 70 20 BFID C[C@@H](O)CN(C)[C@@H]1CCc2c(Cl)cccc21 159553764 AVNNWQKKLVQTLZ-NOZJJQNGSA-N 239.746 2.640 70 20 BFID CC(C)n1cccc1C(=O)N(C)Cc1ccco1 160827924 PUXWEPWGFGBDKI-UHFFFAOYSA-N 246.310 2.934 70 20 BFID Cc1nc(CCNc2cccc(F)n2)cs1 218119024 TWXTZYNILFQMSP-UHFFFAOYSA-N 237.303 2.640 70 20 BFID CC[C@@H](C)CNCc1cc(O)cc(F)c1 159600363 DQOJBKHCVGOOEB-SECBINFHSA-N 211.280 2.667 70 20 BFID CCCCC(=O)NCC1(CCOCC)CCC1 160684217 ZPKZMNSAPNEWDQ-UHFFFAOYSA-N 241.375 2.890 70 20 BFID CC[C@H](O)CN[C@H]1CCCC[C@@H]1C(C)C 160348578 ZBWBPCFSEDREGN-XQQFMLRXSA-N 213.365 2.562 70 20 BFID CN(Cc1cccnc1)C(=O)N1CCCCCC1 160362144 QNIZDTWYWCFWEY-UHFFFAOYSA-N 247.342 2.509 70 20 BFID COCC(C)(C)C(=O)Oc1ccc(C)cc1 160487361 XAMRCSLBOXRQDV-UHFFFAOYSA-N 222.284 2.573 70 20 BFID C1CCC(NC[C@@H]2COC3(CCCC3)O2)CC1 218363285 KSOSWINQIXRKKF-CYBMUJFWSA-N 239.359 2.594 70 20 BFID CCCCO[C@@H](C)C(=O)NCC1(CCC)CC1 160844205 RHZFCZZJQHKGEN-LBPRGKRZSA-N 241.375 2.888 70 20 BFID COc1ccccc1C(=O)N1[C@H]2C=CC[C@H]1CC2 218691773 LKDTXUCEYSUYSA-RYUDHWBXSA-N 243.306 2.628 70 20 BFID CC1(C)C[C@@H]1C(=O)N[C@@H]1CCc2cc(F)ccc21 160844818 VUSRYPSSSYXVKX-CHWSQXEVSA-N 247.313 2.975 70 20 BFID O=C(CCC1CCC1)Nc1cccc(F)n1 160676533 DSZSTJXQBSTYHY-UHFFFAOYSA-N 222.263 2.740 70 20 BFID C[C@H](NC[C@@H]1CCc2ccccc21)[C@@H]1CCOC1 160965529 UVBROUIMPMNXAZ-AEGPPILISA-N 245.366 2.731 70 20 BFID CC[C@@H](C)[C@@H](C)NC[C@@H](O)c1ccc(F)cc1 218783562 VBJDDPFYCINYCR-JTNHKYCSSA-N 239.334 2.883 70 20 BFID CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)C1CC1 159540621 FFVVPJNIEQMGPO-HOSYDEDBSA-N 209.333 2.727 70 20 BFID CC1=C(C(=O)N(CC(F)F)C(C)C)CCCO1 160094791 BRJSYNJBIMUBJH-UHFFFAOYSA-N 247.285 2.573 70 20 BFID COCC(C)(C)C(=O)Oc1ccc(Cl)cc1 160484954 SDOFWIKDKCHURL-UHFFFAOYSA-N 242.702 2.918 70 20 BFID C1CCN(CCCN2C[C@@H]3CCC[C@H]3C2)CC1 161409148 NFMHUQYKQVMGHM-GJZGRUSLSA-N 236.403 2.594 70 20 BFID CS[C@H](C)CC(=O)NCc1ccc(C)s1 159932074 NKBGDDFLBHOMDK-SECBINFHSA-N 243.397 2.814 70 20 BFID O=C(O[C@H](c1ccccn1)C(F)(F)F)C1CC1 160211722 UWIKCSLRCGGZIE-SECBINFHSA-N 245.200 2.638 70 20 BFID CCOC(CN1CC[C@@H](C(C)(C)C)C1)OCC 160750613 YMYMNUIWLMYBOD-GFCCVEGCSA-N 243.391 2.754 70 20 BFID O=S(=O)(Cl)[C@@H]1CCCCCC[C@@H]1F 238853584 KHJXYHJPLCMBND-JGVFFNPUSA-N 228.716 2.616 70 20 BFID in-vitro Cc1ccc(C(=O)NCC2(C3CC3)CC2)cc1 159705579 UKOIYNAOHOBVCT-UHFFFAOYSA-N 229.323 2.915 70 20 BFID COc1cc(N[C@@H](C)[C@@H]2CCOC2)ccc1F 160106760 NSYZMPQHUHNNOZ-VHSXEESVSA-N 239.290 2.671 70 20 BFID CCC[C@@H](C(=O)OCC)c1ccccn1 161257634 SBSHYJDIQDMECK-SNVBAGLBSA-N 207.273 2.528 70 20 BFID CCN(C)C(=O)NCC(CC)(CC)SC 218004170 BZYUGQNQAUQPOL-UHFFFAOYSA-N 232.393 2.570 70 20 BFID CCCCCOCC(=O)N[C@H]1CCC[C@H]1CC 159552547 PTTGDAFVHDHVSS-OLZOCXBDSA-N 241.375 2.888 70 20 BFID CCC[C@H](C)CC(=O)N(C)Cc1cccn1C 160390710 ZKKNMPARWZOWHG-LBPRGKRZSA-N 236.359 2.810 70 20 BFID CCN1CCCC[C@H]1CN[C@H](C(C)C)C1CC1 161208277 GVDGTCOUPJISKT-LSDHHAIUSA-N 238.419 2.885 70 20 BFID Cc1cccc(C(=O)Nc2ccccn2)c1F 161431940 MTMMJUYOBGRCMD-UHFFFAOYSA-N 230.242 2.781 70 20 BFID CCC[C@@H]1CCCN(C(=O)c2ccc(N)cc2)C1 161444843 CKIJUFVMWFRXJE-GFCCVEGCSA-N 246.354 2.921 70 20 BFID Cc1ccccc1C(=O)NCC1(C2CC2)CC1 160153744 LKSYBRCLHINOLT-UHFFFAOYSA-N 229.323 2.915 70 20 BFID CCC[C@H](C)C(=O)N(C)c1ccc2c(c1)OCO2 160295470 CJPLBEPMYBQRSN-JTQLQIEISA-N 249.310 2.814 70 20 BFID COc1cc(Nc2cc(F)ncn2)ccc1F 160485828 REPUDVYTGLRVBY-UHFFFAOYSA-N 237.209 2.507 70 20 BFID CC[C@H](C)N(C)Cc1cc(O)cc(F)c1 159816143 KUGAWQJOFDATMD-VIFPVBQESA-N 211.280 2.762 70 20 BFID CNC(=O)c1ccccc1OC1CCCCC1 159825702 QTEMMZZNCXUZTK-UHFFFAOYSA-N 233.311 2.758 70 20 BFID O=C(CCC1CC1)N1CCc2c(F)cccc2C1 161013139 PZGDYXLAMANMDF-UHFFFAOYSA-N 247.313 2.901 70 20 BFID C[C@H](O)[C@@H](C)Sc1nc(C(C)(C)C)ns1 159757071 AJBRKFFGSGQHSQ-NKWVEPMBSA-N 246.401 2.697 70 20 BFID CCc1cc(O)nc(CN2CCCC[C@@H]2CC)n1 160465686 VJXFQYYXSANIMM-LBPRGKRZSA-N 249.358 2.509 70 20 BFID C/C=C/C=C/C(=O)N[C@H]1CCOC2(CCCC2)C1 161316111 CZZQJPCMUNXVQX-ADOIESLVSA-N 249.354 2.727 70 20 BFID O=S(=O)(Cl)[C@@H]1CCCCCC[C@H]1F 238853583 KHJXYHJPLCMBND-HTQZYQBOSA-N 228.716 2.616 70 20 BFID in-vitro CCC[C@@H](C)CC(=O)NCC1(N)CCCCC1 159589403 CQJMRGYBJVKESI-GFCCVEGCSA-N 240.391 2.591 70 20 BFID Fc1ccc(F)c(SCCn2ccnc2)c1 159740455 AXDOVSJMIQDOTR-UHFFFAOYSA-N 240.278 2.954 70 20 BFID CCc1nc(C(=O)Nc2cccc(C)c2O)co1 159430717 YZMKGKWULSQXTD-UHFFFAOYSA-N 246.266 2.503 70 20 BFID c1cc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cs1 159622764 IEJKGLSONBWZNJ-AVGNSLFASA-N 249.379 2.795 70 20 BFID Cc1cnccc1CNCc1cccs1 160597472 XMKKIDXFBSBEEF-UHFFFAOYSA-N 218.325 2.741 70 20 BFID O=C(NCC1(C2CC2)CCC1)Nc1cccnc1 160810927 QQLHURWQHYNSHP-UHFFFAOYSA-N 245.326 2.783 70 20 BFID C[C@H](CCc1ccccc1F)NCC(C)(C)O 160618424 YNVNJWOZANOLFI-LLVKDONJSA-N 239.334 2.507 70 20 BFID CC(C)C[C@@H](N)C(=O)N[C@@H](C)CCC(C)(C)C 159768009 SRQZPEMSWRQNDV-NWDGAFQWSA-N 242.407 2.691 70 20 BFID COc1cc(NC[C@H]2CCC=CO2)ccc1F 159950975 OGTLTRSTOMEKHV-LLVKDONJSA-N 237.274 2.939 70 20 BFID Cc1cccc([C@H]2CCCN2C[C@@H]2CCCO2)n1 160295032 YREBPXWKIFAYKY-DZGCQCFKSA-N 246.354 2.706 70 20 BFID CC1(C)CCCN(Cc2cnc3ccccn23)C1 160384094 XDLVNKJASJZUPF-UHFFFAOYSA-N 243.354 2.956 70 20 BFID C[C@@H]1CC[C@@H](C)N1C(=O)Cc1ccsc1 161403374 LTMMWAJWPHFMMP-NXEZZACHSA-N 223.341 2.690 70 20 BFID CC1(C)C[C@H]1C(=O)Nc1ccc(Cl)cn1 160073215 UNCHOWYFBYKTOI-QMMMGPOBSA-N 224.691 2.720 70 20 BFID CC(C)(O)CN[C@@H]1CCC[C@@H]1c1ccccc1 160612474 UAGXLSNMPQFLAH-ZIAGYGMSSA-N 233.355 2.683 70 20 BFID CC[C@@H](C)OCC(=O)Nc1c(F)cccc1F 160075371 RHMWLGODWXCGNG-MRVPVSSYSA-N 243.253 2.718 70 20 BFID CC[C@@H]1CCC[C@H]1NC(=O)CCC1CC1 159751475 KVOSGIWTJGHINM-VXGBXAGGSA-N 209.333 2.872 70 20 BFID CC(C)(NC(=O)c1ccncc1Cl)C1CC1 217713707 VPFDRLNJHSLJNN-UHFFFAOYSA-N 238.718 2.653 70 20 BFID COc1ccc(N(C)C(=O)c2ccco2)cc1F 159511581 AWJOCCDBMMOSTD-UHFFFAOYSA-N 249.241 2.704 70 20 BFID Cc1ccccc1CSCc1nnc(C)n1C 160932638 PUTTZYXCLHHUKW-UHFFFAOYSA-N 247.367 2.865 70 20 BFID C[C@@H](CO)Sc1ccc(C(F)(F)F)cn1 160954360 ONQBCYBPBTXNAW-LURJTMIESA-N 237.246 2.573 70 20 BFID CCCCn1ncc(Nc2cc(C)ncn2)c1C 161122664 KRXITZYQBJEMMZ-UHFFFAOYSA-N 245.330 2.834 70 20 BFID CC[C@@H](NCC1CC1)c1ccc(F)cn1 161305569 AWXPRYKYULZFON-LLVKDONJSA-N 208.280 2.671 70 20 BFID Cc1ccc(C(=O)N2[C@@H](C)CC[C@@H]2C)o1 161412067 KANJTQUWRNTILQ-IUCAKERBSA-N 207.273 2.601 70 20 BFID CC(C)C[C@H]1CCCN1CCOCC1CC1 159937208 NPBXMEYNTDNGPL-CQSZACIVSA-N 225.376 2.924 70 20 BFID CC(C)n1cccc1C(=O)NCc1ccccc1 160596291 UGBNJDDVOZHAHT-UHFFFAOYSA-N 242.322 2.999 70 20 BFID Cc1cnccc1CNCCC(C)(C)C 160601828 YKHRDUBJSNVPDH-UHFFFAOYSA-N 206.333 2.916 70 20 BFID CCc1nn(C)cc1CNc1ccc(C)nc1C 161119108 KTDMMCCXRARGMI-UHFFFAOYSA-N 244.342 2.606 70 20 BFID OCCOCCSCc1ccc(Cl)cc1 161281573 NXLIXDXGGJYTNC-UHFFFAOYSA-N 246.759 2.582 70 20 BFID CC[C@]1(C)C[C@@H]1C(=O)NCCOc1ccccc1 159533413 MQCSTXILCHSEEH-UKRRQHHQSA-N 247.338 2.618 70 20 BFID CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(C)cn1 159882963 MQGNSXGSQBUINW-MFKMUULPSA-N 218.300 2.765 70 20 BFID CCCC1(CNC(=O)[C@@H](C)C2CC2)CC1 160730609 MRLZNWQLHCJAEK-JTQLQIEISA-N 209.333 2.729 70 20 BFID CC[C@@]1(C)C[C@H]1C(=O)NCc1cccc(F)c1 161029241 UDYVJQQVSHITCI-JSGCOSHPSA-N 235.302 2.878 70 20 BFID COCCCCNC(=O)C(C)(C)C1CCCC1 159409702 SGIWVBLGHMGYGL-UHFFFAOYSA-N 241.375 2.746 70 20 BFID CN(Cc1ccco1)C(=O)N1CCCCCC1 160357107 DJSOTXMJCPCJMB-UHFFFAOYSA-N 236.315 2.707 70 20 BFID CC(C)(C)CCCN1CCN(C2CCC2)CC1 218469667 PCQQCRDBZVMRDN-UHFFFAOYSA-N 238.419 2.983 70 20 BFID Cc1ccc(CC[C@@H](C)NCC(C)(C)O)cc1 160585842 AJZGREXHYHQQHV-CYBMUJFWSA-N 235.371 2.677 70 20 BFID CC(=O)NC1CCC(Nc2cccc(C)c2)CC1 161079684 NCGVCTRZDVZXOQ-UHFFFAOYSA-N 246.354 2.854 70 20 BFID CCC[C@H](O)CNc1ncc(Cl)cc1Cl 218001182 TVBFKYCLERYWDM-QMMMGPOBSA-N 249.141 2.961 70 20 BFID COC[C@H](C)Sc1nncc2ccccc12 160237100 JFGFNXOCCDBAIJ-VIFPVBQESA-N 234.324 2.757 70 20 BFID CCC[C@@H](C)CC(=O)N(C)Cc1cccn1C 160390582 ZKKNMPARWZOWHG-GFCCVEGCSA-N 236.359 2.810 70 20 BFID CNc1ccccc1C(=O)N1C[C@H]2CCC[C@@H]2C1 160060799 IIGGEJRNCCILMK-VXGBXAGGSA-N 244.338 2.600 70 20 BFID COc1ccc(Cl)cc1NC(=O)C(F)F 217600827 MEXHJTATXZLWSE-UHFFFAOYSA-N 235.617 2.552 70 20 BFID Cc1cccc(C)c1NC(=O)N[C@]1(C)CCOC1 159487096 XTHRLVGKFAXCDJ-CQSZACIVSA-N 248.326 2.604 70 20 BFID CC[S@](=O)c1ncc(C(C)(C)C)s1 160562746 ROESIQWOSWALNL-CYBMUJFWSA-N 217.359 2.568 70 20 BFID CN(Cc1csc(C2CC2)n1)C1CC1 161470321 MGMGPFJSXMBNPU-UHFFFAOYSA-N 208.330 2.615 70 20 BFID CC[C@@H](CSC)NCc1nc(C)c(C)s1 217330611 IZPBJRQEDOSVFM-JTQLQIEISA-N 244.429 2.991 70 20 BFID O=C(OCCCc1ccccc1)[C@@H]1CCCCO1 159397433 POUDNXBPGSIQLF-AWEZNQCLSA-N 248.322 2.732 70 20 BFID CCn1ccnc1CN(CCC(C)C)C1CC1 160759522 SUHVMYYDNGGSTA-UHFFFAOYSA-N 235.375 2.914 70 20 BFID CCCC(=O)N1CCc2c(F)cccc2C1 160783637 PNRPJRRNOQQLTN-UHFFFAOYSA-N 221.275 2.511 70 20 BFID CCCCCC[C@@H](C)S(=O)(=O)Cl 106470230 XXUMKDIHMSLPKL-MRVPVSSYSA-N 212.742 2.914 70 20 BFID CC(C)[C@H]1CCCC[C@H]1S(=O)(=O)Cl 125876069 SJRUDTHFHAOZSM-RKDXNWHRSA-N 224.753 2.770 70 20 BFID CCC(C)(CC)C(=O)N[C@@H]1CCOC(C)(C)C1 159375952 VQFOIICLTMJVQB-LLVKDONJSA-N 241.375 2.887 70 20 BFID O=C(Cc1cccc(F)c1)NCC1(C2CC2)CC1 159767406 ZASYQCIDZDALCJ-UHFFFAOYSA-N 247.313 2.675 70 20 BFID CCC[C@@H](C)C(=O)N(C)c1ccc2c(c1)OCO2 160295347 CJPLBEPMYBQRSN-SNVBAGLBSA-N 249.310 2.814 70 20 BFID C[C@@H]1CCN(Cc2cnc3ccccn23)[C@H](C)C1 160564050 USDNTHUZNQTIQN-CHWSQXEVSA-N 243.354 2.955 70 20 BFID CC[C@@H]1C[C@H]1Nc1ncnc2c1CCCC2 217805222 VGHPOMYYOZVNMI-BXKDBHETSA-N 217.316 2.566 70 20 BFID Cc1cccc([C@@H]2CCCN2CCCCCO)n1 159720980 KPGJLSHWQGPXOH-HNNXBMFYSA-N 248.370 2.690 70 20 BFID CCCC1(CNC(=O)Cc2ccc(C)nc2)CC1 160481411 UMMAPMCGBRNNCV-UHFFFAOYSA-N 246.354 2.629 70 20 BFID Cc1cc(C)cc(CS[C@H](C)CO)c1 160758827 ZUAKRNNFTKRGOT-LLVKDONJSA-N 210.342 2.917 70 20 BFID CC[C@H](C)[C@@H](C)C(=O)Nc1cccc(F)n1 160823900 NVXJMCUMBYCXAM-DTWKUNHWSA-N 224.279 2.841 70 20 BFID CCCCCNCC(CC)(CC)C(=O)OC 159678132 AHEXNFJKENNPBM-UHFFFAOYSA-N 229.364 2.746 70 20 BFID Cc1cccnc1CNCCCC(C)C 161120289 BFHVCJQPDGTBEC-UHFFFAOYSA-N 206.333 2.916 70 20 BFID CCN(Cc1cccs1)Cc1nccn1CC 160705496 PDXNNCPSVXKBFV-UHFFFAOYSA-N 249.383 2.987 70 20 BFID CCN(CC[C@@H]1CCCN1C)C1CCCC1 161412595 GOJFYBIOQGTPCR-ZDUSSCGKSA-N 224.392 2.735 70 20 BFID Cc1occc1C(=O)N[C@H]1CC[C@H](C)C1 159769411 KZZCDBFKPGNPCB-WPRPVWTQSA-N 207.273 2.506 70 20 BFID CN(CCc1ccccc1)CC[C@@H]1CCCN1C 161420374 LCLNXBVITVTOHF-INIZCTEOSA-N 246.398 2.645 70 20 BFID C[C@@H]1CC[C@@H](N[C@@H]2CCOC(C)(C)C2)C1 160528069 LQJXNXFXSHLMSV-IJLUTSLNSA-N 211.349 2.722 70 20 BFID C[C@H](NCCO)c1cc(Cl)sc1Cl 159693137 XMXAVCMESHKXJS-YFKPBYRVSA-N 240.155 2.698 70 20 BFID CCCOCC(=O)N(C)[C@@H]1CCCC[C@H]1CC 161192818 FCFCERYQVDAQNU-CHWSQXEVSA-N 241.375 2.840 70 20 BFID CC[C@H](C)[C@@H](C)NC(=O)Nc1ccc(C)nc1 161378356 CXINZUSGWNSKHB-GXSJLCMTSA-N 235.331 2.946 70 20 BFID CC[C@H]1CCCC[C@@H]1NCCCc1cnn(C)c1 161422191 OZVWYSPFXBMRSF-GJZGRUSLSA-N 249.402 2.911 70 20 BFID COc1ccccc1CNC1(C)CCC1 160009266 MNWRUOSFMZPFFI-UHFFFAOYSA-N 205.301 2.727 70 20 BFID C1CS[C@H](CN[C@H]2C[C@H]3CC[C@H]2C3)CS1 161466402 CEDXLJWPAJRTLU-YFKTTZPYSA-N 243.441 2.613 70 20 BFID Cc1nccc(NC(=O)NCCCF)c1Cl 159934119 HWGQGJJYEKLZPC-UHFFFAOYSA-N 245.685 2.525 70 20 BFID COCC1CCN(C(=O)CCC(C)(C)C)CC1 159953740 ZTBJRJOJNPEOJZ-UHFFFAOYSA-N 241.375 2.698 70 20 BFID CCC(CC)CNC(=O)N(C)[C@@H](C)CC 160570710 ZNGDVZLHZYRFTB-JTQLQIEISA-N 214.353 2.863 70 20 BFID CCCN(CCO)CC1CCCCCC1 161230521 POJOHGSUBGDPBO-UHFFFAOYSA-N 213.365 2.661 70 20 BFID CCc1ncnc(N[C@H](C)Cc2ccco2)c1F 217969201 VGXOQXHEFQNQDN-SECBINFHSA-N 249.289 2.814 70 20 BFID C[C@H](c1cc(F)ccc1F)S(=O)(=O)Cl 88251346 SFOMIMQXDLFBIA-RXMQYKEDSA-N 240.658 2.594 70 20 BFID CCCCCN1C(=O)C[C@@](C)(CC(C)C)C1=O 159709704 ZDYIYDCQHGOZJL-CQSZACIVSA-N 239.359 2.988 70 20 BFID Cc1cccc(C(=O)N2[C@H](C)CC[C@H]2C)c1O 161397896 AVOBGAWTBQOCHL-GHMZBOCLSA-N 233.311 2.714 70 20 BFID CN(CC[C@@H]1CCCN1C)CC1CCCC1 161503420 HYWLOVNEYDUYGI-AWEZNQCLSA-N 224.392 2.593 70 20 BFID Cc1ccc(CC(=O)NCC2(C3CC3)CC2)cc1 160136272 IPLBANYTXRRFPC-UHFFFAOYSA-N 243.350 2.844 70 20 BFID CC(C)[C@H]1CCN(Cc2ccc(O)cc2)C1 159473234 BYEVCWXHGVZAGF-ZDUSSCGKSA-N 219.328 2.870 70 20 BFID CC[C@@H](NCCC(C)(C)C)[C@H]1CCCO1 159756916 GUSXOPCWWBMXQE-VXGBXAGGSA-N 213.365 2.970 70 20 BFID C[C@@H](CN(C)C[C@@H]1CCC[C@@H]1O)c1ccccc1 159767569 OSACTHZYSYTOSI-BPUTZDHNSA-N 247.382 2.883 70 20 BFID COc1cccnc1NCCCC(F)(F)F 160256224 ROAUMEMBBBWXSV-UHFFFAOYSA-N 234.221 2.845 70 20 BFID COc1ccc(NC(=O)C(F)F)cc1Cl 217653023 BZQJAHHNIMRYMJ-UHFFFAOYSA-N 235.617 2.552 70 20 BFID CC[C@H](C)OCC(=O)Nc1c(F)cccc1F 160075518 RHMWLGODWXCGNG-QMMMGPOBSA-N 243.253 2.718 70 20 BFID CC[C@H](NCC(C)(C)O)c1cc(F)ccc1F 160605746 DUDSIJDOVPLYNH-LBPRGKRZSA-N 243.297 2.776 70 20 BFID Cc1cc(NC(=O)NC2CC=CC2)ccc1F 160021337 IEJVILYRLOQCQX-UHFFFAOYSA-N 234.274 2.974 70 20 BFID COC(CN1CCC[C@@H]1C1CCCCC1)OC 160623970 QBHDJRYDKBRRFM-CYBMUJFWSA-N 241.375 2.650 70 20 BFID CC(C)OC(=O)c1ccc(C(F)(F)F)cn1 161098287 ZTIOCDMYVAIQSX-UHFFFAOYSA-N 233.189 2.666 70 20 BFID CN(Cc1ccccc1Cl)C(=O)C(F)F 217608502 PQGMZJWGZAAEEC-UHFFFAOYSA-N 233.645 2.564 70 20 BFID CSc1c(Br)ccc2c1OCO2 217850930 VGMXUPKCPGSQKI-UHFFFAOYSA-N 247.113 2.900 70 20 BFID CC[C@H](N)C(=O)N(C)[C@H](c1ccccc1)C(C)C 159757198 JSFKLWMYWUVDOA-KBPBESRZSA-N 248.370 2.579 70 20 BFID Cc1ccc(C[C@@H](NCC(C)(C)O)C(C)C)cc1 160652121 GKVQGYLXMIOFSA-OAHLLOKOSA-N 249.398 2.923 70 20 BFID CC[C@H](O)CCNCCC1CCCCC1 218765019 ZGGHZTFHWJXPIJ-ZDUSSCGKSA-N 213.365 2.707 70 20 BFID c1ccc([C@H]2CCN(CCOCC3CC3)C2)cc1 159808160 VIAGVOVUDXFAHE-INIZCTEOSA-N 245.366 2.903 70 20 BFID CC(C)C[C@@H](C)NC(=O)NC[C@H]1CCCS1 160172836 HKMUHBVRDWENJE-GHMZBOCLSA-N 244.404 2.616 70 20 BFID CCc1cc(O)nc(CN(C)C2CCCCC2)n1 160468583 YQHHTQZVFIMHHJ-UHFFFAOYSA-N 249.358 2.509 70 20 BFID CC(C)c1ccc(C(=O)Nc2cccnc2)cn1 160596982 GKPDYSSPDIWFJB-UHFFFAOYSA-N 241.294 2.852 70 20 BFID C[C@@H]1C[C@@H](S(=O)(=O)Cl)CC(C)(C)C1 88251305 WOJBPOIBUOZVIS-HTQZYQBOSA-N 224.753 2.770 70 20 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Cc1cc(C)cc(NC(=O)N[C@@]2(C)CCOC2)c1 159399544 MVUUSGCNOZQUTF-AWEZNQCLSA-N 248.326 2.604 70 20 BFID CCc1ccc(NC(=O)N[C@@]2(C)CCOC2)cc1 159410810 RUXKIQDYBSYYKV-AWEZNQCLSA-N 248.326 2.550 70 20 BFID CC[C@@H](NC(=O)c1ccc[nH]1)c1c(C)noc1C 160627125 MPUHEKDXLZIXOM-SNVBAGLBSA-N 247.298 2.501 70 20 BFID COc1ccc(OCc2nccs2)cc1 161114813 QXVCYTNQFQTBOO-UHFFFAOYSA-N 221.281 2.731 70 20 BFID C[C@H]1CC[C@H](C)N1C(=O)Cc1ccsc1 161403259 LTMMWAJWPHFMMP-UWVGGRQHSA-N 223.341 2.690 70 20 BFID CCCCO[C@@H](C)C(=O)N[C@H]1CCC[C@@H]1CC 159589818 IPHRWSWJBWEBTP-AVGNSLFASA-N 241.375 2.887 70 20 BFID O=C(NC1CC=CC1)c1c(F)cc(F)cc1F 161051189 GQGHSLSFFYFWIB-UHFFFAOYSA-N 241.212 2.552 70 20 BFID CCCCCNc1ncnc(CC)c1F 217951321 FSFXQOJXYKNHPY-UHFFFAOYSA-N 211.284 2.780 70 20 BFID CCN(Cc1cc(O)cc(F)c1)C(C)C 159817724 JKKMECZDKQYQAT-UHFFFAOYSA-N 211.280 2.762 70 20 BFID O=S(=O)(Cl)Cc1cccc(C(F)F)c1 124908576 HFIWLAASSZMDIF-UHFFFAOYSA-N 240.658 2.693 70 20 BFID CC[C@H](NC(=O)C1CCC1)c1c(C)noc1C 159943612 JMBNAOWYELIVND-NSHDSACASA-N 236.315 2.659 70 20 BFID COc1cc(N[C@H]2CCCOCC2)ccc1F 160037409 QOMNTIWCTMXODG-JTQLQIEISA-N 239.290 2.815 70 20 BFID CC[C@@H](NC(=O)C(F)F)c1ccc(C)cc1 217641316 YMGQZAGSCQBGSW-SNVBAGLBSA-N 227.254 2.827 70 20 BFID Cc1cccc(-c2cncc(C(=O)N(C)C)c2)c1 160176267 XOTIEBIJKIIVNV-UHFFFAOYSA-N 240.306 2.759 70 20 BFID CC[C@H](N)C(=O)N(C)[C@@H](C)c1cc(C)ccc1C 161309032 YOYXOWCPPBVCEY-JSGCOSHPSA-N 248.370 2.560 70 20 BFID O=C(c1ccon1)N1CCc2c(Cl)cccc21 161459178 CJJYWHCMKSHNDV-UHFFFAOYSA-N 248.669 2.531 70 20 BFID CCC1CCN(CCOCC2CC2)CC1 159427568 SCVLCDSOOBPQBE-UHFFFAOYSA-N 211.349 2.535 70 20 BFID CC[C@@H]1CN(C(=O)CCC(C)(C)C)C[C@H](C)O1 159775152 DOXHTUFJDZJMMZ-NWDGAFQWSA-N 241.375 2.839 70 20 BFID CCc1ncnc(NC[C@@H]2CC2(C)C)c1F 218016956 ZSOLGKYMVLSHBU-QMMMGPOBSA-N 223.295 2.636 70 20 BFID CC[C@@H](NCCC(C)(C)C)[C@@H]1CCCO1 159756687 GUSXOPCWWBMXQE-NEPJUHHUSA-N 213.365 2.970 70 20 BFID C[C@H](N(C)CCCN1CCCCC1)C1(C)CC1 161407356 OVMCQIXWTSWQKN-AWEZNQCLSA-N 238.419 2.983 70 20 BFID CC1(C)COCCN1CCC1CCCC1 159520557 GXHHAJMGWCWTJW-UHFFFAOYSA-N 211.349 2.678 70 20 BFID Cc1ccccc1CN(C)Cc1c[nH]nc1C 160529391 LZWVKERTUPFFRA-UHFFFAOYSA-N 229.327 2.659 70 20 BFID CC[C@]1(C)C[C@H]1C(=O)NC(C1CC1)C1CC1 160658595 CTGOIFJHQOBMJO-SMDDNHRTSA-N 221.344 2.727 70 20 BFID CC(C)(C(=O)NC1CC=CC1)c1cccc(F)c1 160807667 YQGPPCZYBYFTKC-UHFFFAOYSA-N 247.313 2.938 70 20 BFID CCCn1nc(C)c(C(=O)NC2CCCC2)c1C 161230471 STUHYRLTNUHEJH-UHFFFAOYSA-N 249.358 2.582 70 20 BFID CCOCCN1CCC[C@@H]1c1cccc(C)n1 160158309 JXLWSHGIISWTMI-CQSZACIVSA-N 234.343 2.563 70 20 BFID CCC[C@@H](CC)NC(=O)c1ccncc1F 161401610 XZNAQVALOBYYBZ-SECBINFHSA-N 224.279 2.529 70 20 BFID CC(C)(C)NC(=O)Nc1ccc(Cl)cn1 217313534 DOQGDRUADYFMML-UHFFFAOYSA-N 227.695 2.655 70 20 BFID CC(=O)O[C@H]1CC(C)(C)Oc2ccccc21 218560441 VUZPIHDXSZMWEL-LBPRGKRZSA-N 220.268 2.852 70 20 BFID