0 B21R2.42731 COc1cc(ccc1Br)CSCc2cc(=O)c(co2)O 62a_100010110085_100000010605 [0,1,0,0,0,1|1,1,0]=4 1 B21R2.42731 COc1cc(ccc1Cl)CNCc2cc(=O)c(co2)O 2230a_100015204853_100000010605 [0,1,0,0,0,1|2,0,0]=4 2 B21R2.42731 COc1cc(ccc1Cl)CSCc2cc(=O)c(co2)O 62a_200010214485_100000010605 [0,1,0,0,0,1|1,0,0]=3 3 B21R2.42731 COc1cc(ccc1F)CSCc2cc(=O)c(co2)O 62a_100012349856_100000010605 [0,1,0,0,0,1|1,1,0]=4 4 B21R2.42731 Cc1cc(ccc1Cl)CSCc2ccc(c(c2)C=O)O 62a_100012184735_100000008128 [0,1,0,0,0,1|2,0,0]=4 5 B21R2.42731 Cc1ccc(cc1Cl)CSCc2ccc(c(c2)C=O)O 62a_100011823929_100000008128 [0,1,0,0,0,1|2,0,0]=4 6 B21R2.42731 N#Cc1cc(ccc1Br)CSCc2cc(=O)c(co2)O 62a_100010128727_100000010605 [0,1,0,0,0,1|1,1,0]=4 7 B21R2.42731 N#Cc1cc(ccc1F)CSCc2cc(=O)c(co2)O 62a_100000687583_100000010605 [0,1,0,0,0,1|1,1,0]=4 8 B21R2.42731 O=Cc1cc(ccc1O)COCc2ccc(c(c2)Cl)Cl 7a_100000211588_100000008128 [0,1,0,0,0,1|1,1,0]=4 9 B21R2.42731 O=Cc1cc(ccc1O)CSCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000008128 [0,1,0,0,0,1|1,0,0]=3 10 B21R2.42731 O=Cc1cc(ccc1O)CSCc2ccc(c(c2)Cl)F 62a_100000717365_100000008128 [0,1,0,0,0,1|1,1,0]=4 11 B21R2.42731 O=Cc1cc(ccc1O)CSCc2ccc(c(c2)Cl)I 62a_100012349665_100000008128 [0,1,0,0,0,1|1,1,0]=4 12 B21R2.42731 O=Cc1cc(ccc1O)CSCc2ccc(c(c2)F)Cl 62a_100000716492_100000008128 [0,1,0,0,0,1|1,1,0]=4 13 B21R2.42731 O=Cc1cc(ccc1O)CSCc2cnc(c(c2)Cl)Cl 62a_100009843750_100000008128 [0,1,0,0,0,1|2,0,0]=4 14 B21R2.42731 O=Cc1cc(ccc1O)SCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100000186750 [0,1,0,0,0,1|2,0,0]=4 15 B21R2.42731 O=Cc1cc(ncc1O)SCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100000048449 [0,1,0,0,0,1|2,0,0]=4 16 B21R2.358329 CC(NCc1cc(=O)c(co1)O)c2ccc(c(c2)Cl)Cl 2230a_100000743459_100000010605 [0,1,0,0,0,1|1,0,0]=3 17 B21R2.358329 CC(OCc1cc(=O)c(co1)O)c2ccc(c(c2)Cl)Cl 7a_100000742046_100000010605 [0,1,0,0,0,1|0,1,0]=3 18 B21R2.358329 CC(OCc1cc(=O)c(co1)O)c2ccc(c(c2)F)Cl 7a_100011944057_100000010605 [0,1,0,0,0,1|0,2,0]=4 19 B21R2.358329 C[C@@H](NCc1cc(=O)c(co1)O)c2ccc(c(c2)Cl)F 2230a_100016987892_100000010605 [0,1,0,0,0,1|1,1,0]=4 20 B21R2.358329 C[C@@H](NCc1cc(=O)c(co1)O)c2ccc(c(c2)F)Cl 2230a_100016987903_100000010605 [0,1,0,0,0,1|1,1,0]=4 21 B21R2.358329 Cc1ccc(cc1Cl)C(C)NCc2cc(=O)c(co2)O 2230a_100012005020_100000010605 [0,1,0,0,0,1|2,0,0]=4 22 B21R2.358329 O=C(CSc1ccc(c(c1)Cl)Cl)c2ccc(c(c2)O)O 62a_100011214914_100000183813 [0,1,0,0,0,1|1,0,1]=4 23 B21R2.358468 Cc1ccc(c(c1F)F)CSCc2cc(=O)c(co2)O 62a_100009813564_100000010605 [0,1,0,0,0,1|1,1,0]=4 24 B21R2.358468 O=c1cc(occ1O)CNCc2ccc(c(c2F)Cl)F 2230a_100000062223_100000010605 [0,1,0,0,0,1|1,1,0]=4 25 B21R2.358468 O=c1cc(occ1O)COCc2ccc(c(c2Cl)F)Cl 7a_200015968052_100000010605 [0,1,0,0,0,1|0,2,0]=4 26 B21R2.358468 O=c1cc(occ1O)COCc2ccc(c(c2F)Cl)Br 7a_100014105406_100000010605 [0,1,0,0,0,1|0,2,0]=4 27 B21R2.358468 O=c1cc(occ1O)COCc2ccc(c(c2F)Cl)F 7a_200009882269_100000010605 [0,1,0,0,0,1|0,2,0]=4 28 B21R2.358468 O=c1cc(occ1O)CSCc2ccc(c(c2Br)F)F 62a_100016216887_100000010605 [0,1,0,0,0,1|0,2,0]=4 29 B21R2.358468 O=c1cc(occ1O)CSCc2ccc(c(c2F)Cl)F 62a_100009814552_100000010605 [0,1,0,0,0,1|0,1,0]=3 30 B21R2.358468 O=c1cc(occ1O)CSCc2ccc(c(c2F)F)F 62a_100011218744_100000010605 [0,1,0,0,0,1|0,2,0]=4 31 B21R2.358468 O=c1cc(occ1O)CSCn2ncc(c(c2=O)Cl)Cl 62a_100000026310_100000010605 [0,1,0,0,0,1|2,0,0]=4 32 B21R2.361684 CN(Cc1ccc(c(c1)Cl)Cl)Cc2cc(=O)c(co2)O 2230a_100000184578_100000010605 [0,1,0,0,0,1|1,0,0]=3 33 B21R2.361684 CN(Cc1ccc(c(c1)Cl)Cl)Cc2cc(=O)c(co2)O 269982a_100000184578_100000010605 [0,1,0,0,0,1|1,0,0]=3 34 B21R2.361684 O=C(Cc1ccc(c(c1)Br)Cl)Cc2cc(=O)c(co2)O 1458a_100012349508_100000010605 [0,1,0,0,0,1|1,1,0]=4 35 B21R2.361684 O=C(Cc1ccc(c(c1)Cl)Br)Cc2cc(=O)c(co2)O 1458a_100000766880_100000010605 [0,1,0,0,0,1|1,1,0]=4 36 B21R2.361684 O=C(Cc1ccc(c(c1)Cl)Cl)Cc2cc(=O)c(co2)O 1458a_100000210702_100000010605 [0,1,0,0,0,1|1,0,0]=3 37 B21R2.361684 O=C(Cc1ccc(c(c1)Cl)F)Cc2cc(=O)c(co2)O 1458a_100011217296_100000010605 [0,1,0,0,0,1|1,1,0]=4 38 B21R2.361684 O=C(Cc1ccc(c(c1)Cl)O)Cc2cc(=O)c(co2)O 1458a_100000035197_100000010605 [0,1,0,0,0,1|2,0,0]=4 39 B21R2.361684 O=C(Cc1ccc(c(c1)F)Cl)Cc2cc(=O)c(co2)O 1458a_100000722404_100000010605 [0,1,0,0,0,1|1,1,0]=4 40 B21R2.770519 Cc1cc(c(cc1F)F)CSCc2cc(=O)c(co2)O 62a_100012347589_100000010605 [0,1,0,0,0,1|1,1,0]=4 41 B21R2.770519 Nc1cc(c(cc1SCCc2ccc(c(c2)O)O)Cl)Cl 62a_200011093942_200010393615 [0,1,0,0,0,1|1,0,1]=4 42 B21R2.770519 O=c1cc(occ1O)CNCc2cc(c(cc2Cl)Cl)F 2230a_114828290983_100000010605 [0,1,0,0,0,1|1,1,0]=4 43 B21R2.770519 O=c1cc(occ1O)CNCc2cc(c(cc2F)F)Cl 2230a_103624766871_100000010605 [0,1,0,0,0,1|1,1,0]=4 44 B21R2.770519 O=c1cc(occ1O)COCc2cc(c(cc2Cl)Cl)F 7a_100000043066_100000010605 [0,1,0,0,0,1|0,2,0]=4 45 B21R2.770519 O=c1cc(occ1O)COCc2cc(c(cc2F)Cl)Br 7a_200011070574_100000010605 [0,1,0,0,0,1|0,2,0]=4 46 B21R2.770519 O=c1cc(occ1O)COCc2cc(c(cc2F)F)Cl 7a_100010365311_100000010605 [0,1,0,0,0,1|0,2,0]=4 47 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2Br)F)F 62a_100010077255_100000010605 [0,1,0,0,0,1|0,2,0]=4 48 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2Cl)Cl)Cl 62a_100010220947_100000010605 [0,1,0,0,0,1|0,0,0]=2 49 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2Cl)Cl)F 62a_100009813697_100000010605 [0,1,0,0,0,1|0,1,0]=3 50 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2Cl)F)F 62a_100011830393_100000010605 [0,1,0,0,0,1|0,2,0]=4 51 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2F)Br)F 62a_100012024439_100000010605 [0,1,0,0,0,1|0,2,0]=4 52 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2F)Cl)F 62a_200012361342_100000010605 [0,1,0,0,0,1|0,1,0]=3 53 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2F)F)Cl 62a_100010994231_100000010605 [0,1,0,0,0,1|0,1,0]=3 54 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2F)F)F 62a_100011218792_100000010605 [0,1,0,0,0,1|0,2,0]=4 55 B21R2.770519 O=c1cc(occ1O)CSCc2cc(c(cc2F)F)I 62a_100019984567_100000010605 [0,1,0,0,0,1|0,2,0]=4 56 B21R2.783770 Cc1cc(cc(c1F)C)CSCc2cc(=O)c(co2)O 62a_100011352456_100000010605 [0,1,0,0,0,1|1,1,0]=4 57 B21R2.783770 Nc1c(cc(cc1Cl)COCc2cc(=O)c(co2)O)Cl 7a_100012281804_100000010605 [0,1,0,0,0,1|1,1,0]=4 58 B21R2.783770 O=c1cc(occ1O)COCc2cc(c(c(c2)Cl)Br)Cl 7a_100000717615_100000010605 [0,1,0,0,0,1|0,2,0]=4 59 B21R2.783770 O=c1cc(occ1O)COCc2cc(c(c(c2)Cl)F)F 7a_100009854262_100000010605 [0,1,0,0,0,1|0,2,0]=4 60 B21R2.783770 O=c1cc(occ1O)CSCc2cc(c(c(c2)F)Cl)F 62a_100010769323_100000010605 [0,1,0,0,0,1|0,1,0]=3 61 B21R2.783770 O=c1cc(occ1O)CSCc2cc(c(c(c2)F)F)F 62a_100011216845_100000010605 [0,1,0,0,0,1|0,2,0]=4 62 B21R2.2711787 COc1ccc(cc1Br)CSCc2cc(=O)c(co2)O 62a_200011397701_100000010605 [0,1,0,0,0,1|1,1,0]=4 63 B21R2.2711787 COc1ccc(cc1C)CSCc2cc(=O)c(co2)O 62a_200011290836_100000010605 [0,1,0,0,0,1|2,0,0]=4 64 B21R2.2711787 COc1ccc(cc1Cl)CNCc2cc(=O)c(co2)O 2230a_100000008799_100000010605 [0,1,0,0,0,1|2,0,0]=4 65 B21R2.2711787 COc1ccc(cc1Cl)COCc2cc(=O)c(co2)O 7a_100000694469_100000010605 [0,1,0,0,0,1|1,1,0]=4 66 B21R2.2711787 COc1ccc(cc1Cl)CSCc2cc(=O)c(co2)O 62a_100000693707_100000010605 [0,1,0,0,0,1|1,0,0]=3 67 B21R2.2711787 COc1ccc(cc1F)CSCc2cc(=O)c(co2)O 62a_100000189595_100000010605 [0,1,0,0,0,1|1,1,0]=4 68 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)Br)Cl 2230a_100012349490_100000081511 [0,1,0,0,0,1|1,1,0]=4 69 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)Cl)Br 2230a_100012362553_100000081511 [0,1,0,0,0,1|1,1,0]=4 70 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)Cl)C 2230a_102495364989_100000081511 [0,1,0,0,0,1|2,0,0]=4 71 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)Cl)Cl 2230a_100000174881_100000081511 [0,1,0,0,0,1|1,0,0]=3 72 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)Cl)F 2230a_100000749334_100000081511 [0,1,0,0,0,1|1,1,0]=4 73 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(c2)F)Cl 2230a_100011219866_100000081511 [0,1,0,0,0,1|1,1,0]=4 74 B21R2.2711787 COc1coc(cc1=O)CNCc2ccc(c(n2)Cl)Cl 2230a_100009887527_100000081511 [0,1,0,0,0,1|2,0,0]=4 75 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Br)Cl 7a_100012353893_100000081511 [0,1,0,0,0,1|0,2,0]=4 76 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Cl)Br 7a_100000709168_100000081511 [0,1,0,0,0,1|0,2,0]=4 77 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Cl)C 7a_100011290783_100000081511 [0,1,0,0,0,1|1,1,0]=4 78 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Cl)Cl 7a_100000211588_100000081511 [0,1,0,0,0,1|0,1,0]=3 79 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Cl)F 7a_100011217911_100000081511 [0,1,0,0,0,1|0,2,0]=4 80 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)Cl)I 7a_100000718186_100000081511 [0,1,0,0,0,1|0,2,0]=4 81 B21R2.2711787 COc1coc(cc1=O)COCc2ccc(c(c2)F)Cl 7a_100011218299_100000081511 [0,1,0,0,0,1|0,2,0]=4 82 B21R2.2711787 COc1coc(cc1=O)COCc2cnc(c(c2)Cl)Cl 7a_100000042784_100000081511 [0,1,0,0,0,1|1,1,0]=4 83 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Br)Br 62a_100012353900_100000081511 [0,1,0,0,0,1|0,2,0]=4 84 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Br)C 62a_100012232412_100000081511 [0,1,0,0,0,1|1,1,0]=4 85 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Br)Cl 62a_100012353894_100000081511 [0,1,0,0,0,1|0,1,0]=3 86 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Br)F 62a_100011206884_100000081511 [0,1,0,0,0,1|0,2,0]=4 87 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)C)Br 62a_100000727479_100000081511 [0,1,0,0,0,1|1,1,0]=4 88 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)C)C 62a_100000742320_100000081511 [0,1,0,0,0,1|2,0,0]=4 89 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)C)Cl 62a_100012184735_100000081511 [0,1,0,0,0,1|1,0,0]=3 90 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)C)F 62a_100011216667_100000081511 [0,1,0,0,0,1|1,1,0]=4 91 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Cl)Br 62a_100012353895_100000081511 [0,1,0,0,0,1|0,1,0]=3 92 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Cl)C 62a_100011823929_100000081511 [0,1,0,0,0,1|1,0,0]=3 93 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000081511 [0,1,0,0,0,1|0,0,0]=2 94 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Cl)F 62a_100000717365_100000081511 [0,1,0,0,0,1|0,1,0]=3 95 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)Cl)I 62a_100012349665_100000081511 [0,1,0,0,0,1|0,1,0]=3 96 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)F)Br 62a_100000767054_100000081511 [0,1,0,0,0,1|0,2,0]=4 97 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)F)C 62a_100011217369_100000081511 [0,1,0,0,0,1|1,1,0]=4 98 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)F)Cl 62a_100000716492_100000081511 [0,1,0,0,0,1|0,1,0]=3 99 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)F)F 62a_100000757363_100000081511 [0,1,0,0,0,1|0,2,0]=4 100 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)F)I 62a_100010149604_100000081511 [0,1,0,0,0,1|0,2,0]=4 101 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)I)Br 62a_100010146616_100000081511 [0,1,0,0,0,1|0,2,0]=4 102 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)I)C 62a_100010206137_100000081511 [0,1,0,0,0,1|1,1,0]=4 103 B21R2.2711787 COc1coc(cc1=O)CSCc2ccc(c(c2)I)F 62a_100010188208_100000081511 [0,1,0,0,0,1|0,2,0]=4 104 B21R2.2711787 COc1coc(cc1=O)CSCc2cnc(c(c2)Cl)Cl 62a_100009843750_100000081511 [0,1,0,0,0,1|1,0,0]=3 105 B21R2.2711787 COc1coc(cc1=O)CSCc2cnc(c(c2)I)Cl 62a_100011072623_100000081511 [0,1,0,0,0,1|1,1,0]=4 106 B21R2.2711787 N#Cc1ccc(cc1Br)CSCc2cc(=O)c(co2)O 62a_100012355662_100000010605 [0,1,0,0,0,1|1,1,0]=4 107 B21R2.2711787 N#Cc1ccc(cc1Cl)COCc2cc(=O)c(co2)O 7a_100009876504_100000010605 [0,1,0,0,0,1|1,1,0]=4 108 B21R2.2711787 O=Cc1ccc(cc1F)CSCc2cc(=O)c(co2)O 62a_100010142638_100000010605 [0,1,0,0,0,1|1,1,0]=4 109 B21R2.19299 Cc1c(ccc(c1Cl)C(=O)Cc2cc(=O)c(co2)O)Cl 1458a_100010074829_100000010605 [0,2,0,0,0,0|2,0,0]=4 110 B21R2.19299 Cc1c(ccc(c1F)C(=O)Cc2cc(=O)c(co2)O)Cl 1458a_100012183103_100000010605 [0,2,0,0,0,0|2,0,0]=4 111 B21R2.19299 Cc1ccc(c(c1Cl)F)C(=O)Cc2cc(=O)c(co2)O 1458a_100000722910_100000010605 [0,2,0,0,0,0|2,0,0]=4 112 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2Cl)Br)Cl 1458a_100010208263_100000010605 [0,2,0,0,0,0|1,1,0]=4 113 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2Cl)Cl)Br 1458a_200012347731_100000010605 [0,2,0,0,0,0|1,1,0]=4 114 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2Cl)Cl)F 1458a_100010209669_100000010605 [0,2,0,0,0,0|1,1,0]=4 115 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2Cl)F)Cl 1458a_200010192171_100000010605 [0,2,0,0,0,0|1,1,0]=4 116 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2F)Cl)Br 1458a_100000719840_100000010605 [0,2,0,0,0,0|1,1,0]=4 117 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2F)Cl)F 1458a_100000034381_100000010605 [0,2,0,0,0,0|1,1,0]=4 118 B21R2.19299 O=C(Cc1cc(=O)c(co1)O)c2ccc(c(c2F)F)Cl 1458a_100000085317_100000010605 [0,2,0,0,0,0|1,1,0]=4 119 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Br)Cl 1458a_100000691181_100000081511 [0,2,0,0,0,0|1,1,0]=4 120 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)C)Cl 1458a_100000686306_100000081511 [0,2,0,0,0,0|2,0,0]=4 121 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)Br 1458a_100000687082_100000081511 [0,2,0,0,0,0|1,1,0]=4 122 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)C 1458a_100000751740_100000081511 [0,2,0,0,0,0|2,0,0]=4 123 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)Cl 1458a_100000210401_100000081511 [0,2,0,0,0,0|1,0,0]=3 124 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)F 1458a_100000686462_100000081511 [0,2,0,0,0,0|1,1,0]=4 125 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)I 1458a_100000684831_100000081511 [0,2,0,0,0,0|1,1,0]=4 126 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)Cl)O 1458a_100000212196_100000081511 [0,2,0,0,0,0|2,0,0]=4 127 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)F)Cl 1458a_100000743183_100000081511 [0,2,0,0,0,0|1,1,0]=4 128 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)I)Cl 1458a_100000739381_100000081511 [0,2,0,0,0,0|1,1,0]=4 129 B21R2.35485 COc1coc(cc1=O)CC(=O)c2ccc(c(c2)O)Cl 1458a_100011933997_100000081511 [0,2,0,0,0,0|2,0,0]=4 130 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)C)Cl 2230a_114849113799_100000081511 [0,2,0,0,0,0|2,0,0]=4 131 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)C)Cl 269982a_114849113799_100000081511 [0,2,0,0,0,0|2,0,0]=4 132 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)C 2230a_100000220120_100000081511 [0,2,0,0,0,0|2,0,0]=4 133 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)C 269982a_100000220120_100000081511 [0,2,0,0,0,0|2,0,0]=4 134 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)C 38a_100000220120_100000081511 [0,2,0,0,0,0|2,0,0]=4 135 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)Cl 2230a_100000219944_100000081511 [0,2,0,0,0,0|1,0,0]=3 136 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)Cl 269982a_100000219944_100000081511 [0,2,0,0,0,0|1,0,0]=3 137 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)F 2230a_100000697440_100000081511 [0,2,0,0,0,0|1,1,0]=4 138 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)F 269982a_100000697440_100000081511 [0,2,0,0,0,0|1,1,0]=4 139 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)F 38a_100000697440_100000081511 [0,2,0,0,0,0|1,1,0]=4 140 B21R2.35485 COc1coc(cc1=O)CN(C)c2ccc(c(c2)Cl)F 7a_100000697440_100000081511 [0,2,0,0,0,0|1,1,0]=4 141 B21R2.42048 CCc1cc(ccc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100000102533_100000010605 [0,2,0,0,0,0|2,0,0]=4 142 B21R2.42048 COc1cc(ccc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100000181799_100000010605 [0,2,0,0,0,0|2,0,0]=4 143 B21R2.42048 N#Cc1cc(ccc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100000696165_100000010605 [0,2,0,0,0,0|2,0,0]=4 144 B21R2.42621 CN(Cc1ccc(c(c1)C=O)O)c2ccc(c(c2)Cl)Cl 269982a_100000219944_100000008128 [0,2,0,0,0,0|2,0,0]=4 145 B21R2.782024 Cc1cc(c(cc1C(=O)Cc2cc(=O)c(co2)O)Cl)Cl 1458a_100010439669_100000010605 [0,2,0,0,0,0|1,0,0]=3 146 B21R2.782024 Cc1cc(c(cc1C(=O)Cc2cc(=O)c(co2)O)F)Cl 1458a_200010768543_100000010605 [0,2,0,0,0,0|1,1,0]=4 147 B21R2.782024 Cc1cc(c(cc1Cl)C(=O)Cc2cc(=O)c(co2)O)Cl 1458a_100013033594_100000010605 [0,2,0,0,0,0|2,0,0]=4 148 B21R2.782024 Cc1cc(c(cc1Cl)C(=O)Cc2cc(=O)c(co2)O)F 1458a_100012180961_100000010605 [0,2,0,0,0,0|2,0,0]=4 149 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2Br)F)Cl 1458a_100012921620_100000010605 [0,2,0,0,0,0|1,1,0]=4 150 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2Cl)Br)Cl 1458a_100000246132_100000010605 [0,2,0,0,0,0|1,1,0]=4 151 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2Cl)Cl)Cl 1458a_100011934218_100000010605 [0,2,0,0,0,0|1,0,0]=3 152 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2Cl)Cl)F 1458a_100000212284_100000010605 [0,2,0,0,0,0|1,1,0]=4 153 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)Br)Cl 1458a_100012347732_100000010605 [0,2,0,0,0,0|1,1,0]=4 154 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)Cl)Br 1458a_100011217226_100000010605 [0,2,0,0,0,0|1,1,0]=4 155 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)Cl)Cl 1458a_100011217469_100000010605 [0,2,0,0,0,0|1,0,0]=3 156 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)Cl)F 1458a_100000690020_100000010605 [0,2,0,0,0,0|1,1,0]=4 157 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)Cl)I 1458a_100012920488_100000010605 [0,2,0,0,0,0|1,1,0]=4 158 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)F)Cl 1458a_100011997751_100000010605 [0,2,0,0,0,0|1,1,0]=4 159 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2F)O)Cl 1458a_200009924051_100000010605 [0,2,0,0,0,0|2,0,0]=4 160 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2O)Cl)Br 1458a_200009814723_100000010605 [0,2,0,0,0,0|1,1,0]=4 161 B21R2.782024 O=C(Cc1cc(=O)c(co1)O)c2cc(c(cc2O)F)Cl 1458a_100009910333_100000010605 [0,2,0,0,0,0|1,1,0]=4 162 B21R2.782025 Cc1c(cc(cc1Cl)C(=O)Cc2cc(=O)c(co2)O)Cl 1458a_100012356007_100000010605 [0,2,0,0,0,0|2,0,0]=4 163 B21R2.782025 Cc1cc(cc(c1Cl)C)C(=O)Cc2cc(=O)c(co2)O 1458a_100000102532_100000010605 [0,2,0,0,0,0|2,0,0]=4 164 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Br)Cl)Cl 1458a_200012920480_100000010605 [0,2,0,0,0,0|1,0,0]=3 165 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Br)Cl)F 1458a_100010291025_100000010605 [0,2,0,0,0,0|1,1,0]=4 166 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)Br)Cl 1458a_100012354307_100000010605 [0,2,0,0,0,0|1,1,0]=4 167 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)Cl)Cl 1458a_100012339221_100000010605 [0,2,0,0,0,0|1,0,0]=3 168 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)Cl)F 1458a_200010244527_100000010605 [0,2,0,0,0,0|1,0,0]=3 169 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)F)Cl 1458a_100011934374_100000010605 [0,2,0,0,0,0|1,1,0]=4 170 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)F)F 1458a_100000068011_100000010605 [0,2,0,0,0,0|1,1,0]=4 171 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)O)Cl 1458a_100000184433_100000010605 [0,2,0,0,0,0|2,0,0]=4 172 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000010605 [0,2,0,0,0,0|2,0,0]=4 173 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)F)Cl)F 1458a_100000104779_100000010605 [0,2,0,0,0,0|1,1,0]=4 174 B21R2.782025 O=C(Cc1cc(=O)c(co1)O)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000010605 [0,2,0,0,0,0|2,0,0]=4 175 B21R2.2711446 C#Cc1ccc(cc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100014797261_100000010605 [0,2,0,0,0,0|2,0,0]=4 176 B21R2.2711446 COc1ccc(cc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100000188346_100000010605 [0,2,0,0,0,0|2,0,0]=4 177 B21R2.2711446 N#Cc1ccc(cc1Cl)C(=O)Cc2cc(=O)c(co2)O 1458a_100000694585_100000010605 [0,2,0,0,0,0|2,0,0]=4 178 B21R2.42826 Cc1c(ccc(c1Cl)Cl)NCc2ccc(c(c2)C=O)O 7a_114948340058_100000008128 [0,2,0,0,0,0|2,0,0]=4 179 B21R2.42826 O=Cc1cc(ccc1O)COc2ccc(c(c2Cl)Cl)Cl 7a_200011215298_100000008128 [0,2,0,0,0,0|1,1,0]=4 180 B21R2.42826 O=Cc1cc(ccc1O)CSc2ccc(c(c2F)Cl)F 62a_200000038702_100000008128 [0,2,0,0,0,0|1,1,0]=4 181 B21R2.42827 COc1cc(ccc1Cl)SCc2ccc(c(c2)C=O)O 62a_100011356853_100000008128 [0,2,0,0,0,0|2,0,0]=4 182 B21R2.42827 O=Cc1cc(ccc1O)CSc2ccc(c(c2)C=O)Cl 62a_100010254384_100000008128 [0,2,0,0,0,0|2,0,0]=4 183 B21R2.42827 O=Cc1cc(ccc1O)CSc2ccc(c(c2)CO)Cl 62a_100010128486_100000008128 [0,2,0,0,0,0|2,0,0]=4 184 B21R2.232760 CCc1cc(cc(c1N)C)SCc2cc(=O)c(co2)O 62a_200000186424_100000010605 [0,2,0,0,0,0|2,0,0]=4 185 B21R2.232760 COc1cc(cc(c1Cl)Br)NCc2cc(=O)c(co2)O 2230a_100010131419_100000010605 [0,2,0,0,0,0|1,1,0]=4 186 B21R2.232760 COc1cc(cc(c1Cl)Br)NCc2cc(=O)c(co2)O 7a_100010131419_100000010605 [0,2,0,0,0,0|1,1,0]=4 187 B21R2.232760 COc1cc(cc(c1F)C)SCc2cc(=O)c(co2)O 62a_100010271686_100000010605 [0,2,0,0,0,0|1,1,0]=4 188 B21R2.232760 COc1cc(cc(c1F)F)SCc2cc(=O)c(co2)O 62a_100011218012_100000010605 [0,2,0,0,0,0|0,2,0]=4 189 B21R2.232760 COc1cc(cc(c1F)O)SCc2cc(=O)c(co2)O 62a_200015524394_100000010605 [0,2,0,0,0,0|1,1,0]=4 190 B21R2.232760 COc1cc(cc(c1N)C)SCc2cc(=O)c(co2)O 62a_100000741850_100000010605 [0,2,0,0,0,0|2,0,0]=4 191 B21R2.232760 Cc1cc(cc(c1F)C=O)SCc2cc(=O)c(co2)O 62a_100010235757_100000010605 [0,2,0,0,0,0|1,1,0]=4 192 B21R2.232760 Cc1cc(cc(c1F)CO)SCc2cc(=O)c(co2)O 62a_200010782270_100000010605 [0,2,0,0,0,0|1,1,0]=4 193 B21R2.232760 O=Cc1cc(cc(c1F)F)SCc2cc(=O)c(co2)O 62a_100009814787_100000010605 [0,2,0,0,0,0|0,2,0]=4 194 B21R2.232760 O=Cc1cc(cc(c1O)F)SCc2cc(=O)c(co2)O 62a_100011217654_100000010605 [0,2,0,0,0,0|1,1,0]=4 195 B21R2.262475 CCNc1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000696630_100000010605 [0,2,0,0,0,0|2,0,0]=4 196 B21R2.262475 CCOc1cc(ccc1C)SCc2cc(=O)c(co2)O 62a_100012361169_100000010605 [0,2,0,0,0,0|2,0,0]=4 197 B21R2.262475 CCOc1cc(ccc1Cl)NCc2cc(=O)c(co2)O 2230a_100011964961_100000010605 [0,2,0,0,0,0|2,0,0]=4 198 B21R2.262475 CCOc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_200012344967_100000010605 [0,2,0,0,0,0|1,1,0]=4 199 B21R2.262475 CCOc1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000688918_100000010605 [0,2,0,0,0,0|2,0,0]=4 200 B21R2.262475 CNCc1cc(ccc1C)SCc2cc(=O)c(co2)O 62a_106744473289_100000010605 [0,2,0,0,0,0|2,0,0]=4 201 B21R2.262475 CNCc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100000748472_100000010605 [0,2,0,0,0,0|1,1,0]=4 202 B21R2.262475 CNCc1cc(ccc1O)SCc2cc(=O)c(co2)O 62a_100011602694_100000010605 [0,2,0,0,0,0|2,0,0]=4 203 B21R2.262475 COCc1cc(ccc1Br)SCc2cc(=O)c(co2)O 62a_202125822959_100000010605 [0,2,0,0,0,0|1,1,0]=4 204 B21R2.262475 COCc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100010140362_100000010605 [0,2,0,0,0,0|1,1,0]=4 205 B21R2.262475 Cc1ccc(cc1CC#N)SCc2cc(=O)c(co2)O 62a_100010147029_100000010605 [0,2,0,0,0,0|2,0,0]=4 206 B21R2.262475 N#CCc1cc(ccc1Br)SCc2cc(=O)c(co2)O 62a_100010146707_100000010605 [0,2,0,0,0,0|1,1,0]=4 207 B21R2.262475 N#CCc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100000739769_100000010605 [0,2,0,0,0,0|1,1,0]=4 208 B21R2.262475 N#CCc1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100010188562_100000010605 [0,2,0,0,0,0|2,0,0]=4 209 B21R2.358488 CC(=O)c1cc(ccc1C)SCc2cc(=O)c(co2)O 62a_100012706819_100000010605 [0,2,0,0,0,0|2,0,0]=4 210 B21R2.358488 CC(=O)c1cc(ccc1Cl)OCc2cc(=O)c(co2)O 7a_100009867868_100000010605 [0,2,0,0,0,0|1,1,0]=4 211 B21R2.358488 CC(=O)c1cc(ccc1Cl)SCc2cc(=O)c(co2)O 62a_100010712560_100000010605 [0,2,0,0,0,0|1,0,0]=3 212 B21R2.358488 CC(=O)c1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100000689017_100000010605 [0,2,0,0,0,0|1,1,0]=4 213 B21R2.358488 CC(=O)c1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000695420_100000010605 [0,2,0,0,0,0|2,0,0]=4 214 B21R2.358488 CC(C)c1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_200053017515_100000010605 [0,2,0,0,0,0|1,1,0]=4 215 B21R2.358488 CC(C)c1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000694223_100000010605 [0,2,0,0,0,0|2,0,0]=4 216 B21R2.358488 CC(C)c1cc(ccc1O)SCc2cc(=O)c(co2)O 62a_100000691460_100000010605 [0,2,0,0,0,0|2,0,0]=4 217 B21R2.358488 CC(O)c1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100011943926_100000010605 [0,2,0,0,0,0|1,1,0]=4 218 B21R2.358488 CN(C)c1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100010288836_100000010605 [0,2,0,0,0,0|1,1,0]=4 219 B21R2.358488 Cc1ccc(cc1B(O)O)SCc2cc(=O)c(co2)O 62a_100010223188_100000010605 [0,2,0,0,0,0|2,0,0]=4 220 B21R2.358488 Cc1ccc(cc1C(=O)N)SCc2cc(=O)c(co2)O 62a_100012257281_100000010605 [0,2,0,0,0,0|2,0,0]=4 221 B21R2.358488 NC(=O)c1cc(ccc1Cl)NCc2cc(=O)c(co2)O 7a_100000736848_100000010605 [0,2,0,0,0,0|2,0,0]=4 222 B21R2.358488 NC(=O)c1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100000162119_100000010605 [0,2,0,0,0,0|1,1,0]=4 223 B21R2.358488 NC(=O)c1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000740421_100000010605 [0,2,0,0,0,0|2,0,0]=4 224 B21R2.358488 NC(=O)c1cc(ccc1O)SCc2cc(=O)c(co2)O 62a_100000192807_100000010605 [0,2,0,0,0,0|2,0,0]=4 225 B21R2.358488 O=[N+]([O-])c1cc(ccc1O)CNc2ccc(c(c2)Cl)Cl 2230a_100000184108_100010149780 [0,2,0,0,0,0|2,0,0]=4 226 B21R2.358488 O=[N+]([O-])c1cc(ccc1O)COc2ccc(c(c2)Cl)Cl 7a_100000211054_100010149780 [0,2,0,0,0,0|1,1,0]=4 227 B21R2.358488 O=c1cc(occ1O)COc2ccc(c(c2)[N+](=O)[O-])Cl 7a_100000718020_100000010605 [0,2,0,0,0,0|1,1,0]=4 228 B21R2.358488 O=c1cc(occ1O)CSc2ccc(c(c2)B(O)O)Br 62a_200010171685_100000010605 [0,2,0,0,0,0|1,1,0]=4 229 B21R2.358488 O=c1cc(occ1O)CSc2ccc(c(c2)B(O)O)F 62a_100011356809_100000010605 [0,2,0,0,0,0|1,1,0]=4 230 B21R2.358488 O=c1cc(occ1O)CSc2ccc(c(c2)C(F)F)F 62a_100010167061_100000010605 [0,2,0,0,0,0|0,2,0]=4 231 B21R2.1523891 CCc1cc(ccc1C=O)SCc2cc(=O)c(co2)O 62a_100010209654_100000010605 [0,2,0,0,0,0|2,0,0]=4 232 B21R2.1523891 CCc1cc(ccc1NN)SCc2cc(=O)c(co2)O 62a_100000700371_100000010605 [0,2,0,0,0,0|2,0,0]=4 233 B21R2.1523891 CCc1cc(ccc1OC)SCc2cc(=O)c(co2)O 62a_200010179862_100000010605 [0,2,0,0,0,0|2,0,0]=4 234 B21R2.1523891 CCc1ccc(cc1CO)SCc2cc(=O)c(co2)O 62a_100010766240_100000010605 [0,2,0,0,0,0|2,0,0]=4 235 B21R2.1523891 CCc1ccc(cc1OC)SCc2cc(=O)c(co2)O 62a_200010710398_100000010605 [0,2,0,0,0,0|2,0,0]=4 236 B21R2.1523891 COc1cc(ccc1C=O)SCc2cc(=O)c(co2)O 62a_100000697075_100000010605 [0,2,0,0,0,0|2,0,0]=4 237 B21R2.1523891 COc1cc(ccc1CO)SCc2cc(=O)c(co2)O 62a_100011277633_100000010605 [0,2,0,0,0,0|2,0,0]=4 238 B21R2.1523891 COc1cc(ccc1SC)SCc2cc(=O)c(co2)O 62a_200011001119_100000010605 [0,2,0,0,0,0|2,0,0]=4 239 B21R2.1523891 COc1ccc(cc1C=O)SCc2cc(=O)c(co2)O 62a_100000170026_100000010605 [0,2,0,0,0,0|2,0,0]=4 240 B21R2.1523891 COc1ccc(cc1CN)SCc2cc(=O)c(co2)O 62a_100000690498_100000010605 [0,2,0,0,0,0|2,0,0]=4 241 B21R2.1523891 COc1ccc(cc1CO)SCc2cc(=O)c(co2)O 62a_100000204679_100000010605 [0,2,0,0,0,0|2,0,0]=4 242 B21R2.1523891 COc1ccc(cc1SC)SCc2cc(=O)c(co2)O 62a_200009892704_100000010605 [0,2,0,0,0,0|2,0,0]=4 243 B21R2.1523891 O=Cc1ccc(cc1C=O)SCc2cc(=O)c(co2)O 62a_200010077131_100000010605 [0,2,0,0,0,0|2,0,0]=4 244 B21R2.1523891 O=c1cc(occ1O)CSc2ccc(c(c2)CO)CO 62a_100000719600_100000010605 [0,2,0,0,0,0|2,0,0]=4 245 B21R2.1832539 C=Cc1cc(c(cc1F)F)SCc2cc(=O)c(co2)O 62a_100016015529_100000010605 [0,2,0,0,0,0|1,1,0]=4 246 B21R2.1832539 CNc1cc(c(cc1N)F)SCc2cc(=O)c(co2)O 62a_100013631271_100000010605 [0,2,0,0,0,0|2,0,0]=4 247 B21R2.1832539 COc1cc(c(cc1Br)Br)SCc2cc(=O)c(co2)O 62a_200014006352_100000010605 [0,2,0,0,0,0|1,1,0]=4 248 B21R2.1832539 COc1cc(c(cc1C)N)SCc2cc(=O)c(co2)O 62a_200010584344_100000010605 [0,2,0,0,0,0|2,0,0]=4 249 B21R2.1832539 COc1cc(c(cc1Cl)Br)NCc2cc(=O)c(co2)O 7a_100013022580_100000010605 [0,2,0,0,0,0|2,0,0]=4 250 B21R2.1832539 COc1cc(c(cc1Cl)C)NCc2cc(=O)c(co2)O 2230a_100009858536_100000010605 [0,2,0,0,0,0|2,0,0]=4 251 B21R2.1832539 COc1cc(c(cc1Cl)C)NCc2cc(=O)c(co2)O 7a_100009858536_100000010605 [0,2,0,0,0,0|2,0,0]=4 252 B21R2.1832539 COc1cc(c(cc1Cl)F)NCc2cc(=O)c(co2)O 7a_100009872666_100000010605 [0,2,0,0,0,0|2,0,0]=4 253 B21R2.1832539 COc1cc(c(cc1Cl)F)SCc2cc(=O)c(co2)O 62a_100010739614_100000010605 [0,2,0,0,0,0|1,0,0]=3 254 B21R2.1832539 COc1cc(c(cc1F)C)SCc2cc(=O)c(co2)O 62a_100011009880_100000010605 [0,2,0,0,0,0|1,1,0]=4 255 B21R2.1832539 COc1cc(c(cc1F)F)SCc2cc(=O)c(co2)O 62a_200015541288_100000010605 [0,2,0,0,0,0|1,1,0]=4 256 B21R2.1832539 COc1cc(c(cc1F)N)SCc2cc(=O)c(co2)O 62a_100010365326_100000010605 [0,2,0,0,0,0|1,1,0]=4 257 B21R2.1832539 COc1cc(c(cc1N)C)SCc2cc(=O)c(co2)O 62a_100010141321_100000010605 [0,2,0,0,0,0|2,0,0]=4 258 B21R2.1832539 COc1cc(c(cc1N)F)SCc2cc(=O)c(co2)O 62a_100012766639_100000010605 [0,2,0,0,0,0|2,0,0]=4 259 B21R2.1832539 Cc1cc(c(cc1SCc2cc(=O)c(co2)O)C=O)F 62a_100010138641_100000010605 [0,2,0,0,0,0|1,1,0]=4 260 B21R2.1832539 N#Cc1cc(c(cc1Cl)F)NCc2cc(=O)c(co2)O 7a_100009978698_100000010605 [0,2,0,0,0,0|2,0,0]=4 261 B21R2.1832539 Nc1cc(c(cc1C=O)SCc2cc(=O)c(co2)O)F 62a_200010571964_100000010605 [0,2,0,0,0,0|2,0,0]=4 262 B21R2.1832539 O=Cc1cc(c(cc1F)F)SCc2cc(=O)c(co2)O 62a_100009814802_100000010605 [0,2,0,0,0,0|1,1,0]=4 263 B21R2.1832539 O=Cc1cc(c(cc1O)F)SCc2cc(=O)c(co2)O 62a_100010175118_100000010605 [0,2,0,0,0,0|2,0,0]=4 264 B21R2.1832539 O=c1cc(occ1O)CSc2cc(c(cc2F)F)CO 62a_100016029355_100000010605 [0,2,0,0,0,0|1,1,0]=4 265 B21R2.2568935 Cc1cc(c(cc1Cl)C)SCc2ccc(c(c2)C=O)O 62a_100012357408_100000008128 [0,2,0,0,0,0|2,0,0]=4 266 B21R2.2568935 Cc1cc(c(cc1NCc2ccc(c(c2)C=O)O)Cl)Cl 7a_100012017293_100000008128 [0,2,0,0,0,0|2,0,0]=4 267 B21R2.2568935 Nc1cc(c(cc1Cl)Cl)SCc2ccc(c(c2)C=O)O 62a_100016224655_100000008128 [0,2,0,0,0,0|2,0,0]=4 268 B21R2.2568935 Nc1cc(c(cc1OCc2ccc(c(c2)C=O)O)Cl)Cl 7a_100000696747_100000008128 [0,2,0,0,0,0|1,1,0]=4 269 B21R2.2568935 Nc1cc(c(cc1SCc2ccc(c(c2)C=O)O)Cl)Cl 62a_200011093942_100000008128 [0,2,0,0,0,0|1,0,0]=3 270 B21R2.2568935 Nc1cc(c(cc1SCc2ccc(c(c2)C=O)O)Cl)F 62a_100010892166_100000008128 [0,2,0,0,0,0|1,1,0]=4 271 B21R2.2568935 Nc1cc(c(cc1SCc2ccc(c(c2)C=O)O)F)Cl 62a_200010992381_100000008128 [0,2,0,0,0,0|1,1,0]=4 272 B21R2.2568935 O=Cc1cc(ccc1O)CNc2cc(c(cc2Cl)Cl)Cl 7a_100000211015_100000008128 [0,2,0,0,0,0|2,0,0]=4 273 B21R2.2568935 O=Cc1cc(ccc1O)CNc2cc(c(cc2F)Cl)Cl 7a_100000724578_100000008128 [0,2,0,0,0,0|2,0,0]=4 274 B21R2.2568935 O=Cc1cc(ccc1O)CNc2cc(c(cc2I)Cl)Cl 7a_200011093942_100000008128 [0,2,0,0,0,0|2,0,0]=4 275 B21R2.2568935 O=Cc1cc(ccc1O)CNc2cc(c(cc2O)Cl)Cl 7a_100000696747_100000008128 [0,2,0,0,0,0|2,0,0]=4 276 B21R2.2568935 O=Cc1cc(ccc1O)COc2cc(c(cc2Cl)Cl)Cl 7a_100000211312_100000008128 [0,2,0,0,0,0|1,1,0]=4 277 B21R2.2568935 O=Cc1cc(ccc1O)CSc2cc(c(cc2Br)Cl)O 62a_100021297947_100000008128 [0,2,0,0,0,0|2,0,0]=4 278 B21R2.2568935 O=Cc1cc(ccc1O)CSc2cc(c(cc2F)Cl)F 62a_100010142863_100000008128 [0,2,0,0,0,0|1,1,0]=4 279 B21R2.2568935 O=Cc1cc(ccc1O)CSc2cc(c(cc2F)Cl)O 62a_100010735246_100000008128 [0,2,0,0,0,0|2,0,0]=4 280 B21R2.2711828 C#Cc1cc(ccc1Cl)NCc2cc(=O)c(co2)OC 2230a_103624766972_100000081511 [0,2,0,0,0,0|2,0,0]=4 281 B21R2.2711828 C=Cc1cc(ccc1F)SCc2cc(=O)c(co2)OC 62a_100000688377_100000081511 [0,2,0,0,0,0|1,1,0]=4 282 B21R2.2711828 CCc1cc(ccc1Br)SCc2cc(=O)c(co2)OC 62a_100010244631_100000081511 [0,2,0,0,0,0|1,1,0]=4 283 B21R2.2711828 CCc1cc(ccc1Cl)OCc2cc(=O)c(co2)OC 7a_100000212063_100000081511 [0,2,0,0,0,0|1,1,0]=4 284 B21R2.2711828 CCc1cc(ccc1F)SCc2cc(=O)c(co2)OC 62a_100010244625_100000081511 [0,2,0,0,0,0|1,1,0]=4 285 B21R2.2711828 CCc1cc(ccc1N)SCc2cc(=O)c(co2)OC 62a_100000686106_100000081511 [0,2,0,0,0,0|2,0,0]=4 286 B21R2.2711828 CNc1cc(ccc1C)SCc2cc(=O)c(co2)OC 62a_100020629602_100000081511 [0,2,0,0,0,0|2,0,0]=4 287 B21R2.2711828 CNc1cc(ccc1F)SCc2cc(=O)c(co2)OC 62a_100011314990_100000081511 [0,2,0,0,0,0|1,1,0]=4 288 B21R2.2711828 CNc1cc(ccc1N)SCc2cc(=O)c(co2)OC 62a_100000694363_100000081511 [0,2,0,0,0,0|2,0,0]=4 289 B21R2.2711828 COc1cc(ccc1Br)SCc2cc(=O)c(co2)OC 62a_100012353699_100000081511 [0,2,0,0,0,0|1,1,0]=4 290 B21R2.2711828 COc1cc(ccc1C)SCc2cc(=O)c(co2)OC 62a_100011830276_100000081511 [0,2,0,0,0,0|2,0,0]=4 291 B21R2.2711828 COc1cc(ccc1Cl)NCc2cc(=O)c(co2)OC 2230a_100000742311_100000081511 [0,2,0,0,0,0|2,0,0]=4 292 B21R2.2711828 COc1cc(ccc1Cl)OCc2cc(=O)c(co2)OC 7a_100012186310_100000081511 [0,2,0,0,0,0|1,1,0]=4 293 B21R2.2711828 COc1cc(ccc1Cl)SCc2cc(=O)c(co2)OC 62a_100011356853_100000081511 [0,2,0,0,0,0|1,0,0]=3 294 B21R2.2711828 COc1cc(ccc1F)SCc2cc(=O)c(co2)OC 62a_100011934186_100000081511 [0,2,0,0,0,0|1,1,0]=4 295 B21R2.2711828 COc1cc(ccc1N)SCc2cc(=O)c(co2)OC 62a_100011279103_100000081511 [0,2,0,0,0,0|2,0,0]=4 296 B21R2.2711828 COc1ccc(cc1Cl)SCc2ccc(c(c2)C=O)O 62a_100012355395_100000008128 [0,2,0,0,0,0|2,0,0]=4 297 B21R2.2711828 COc1coc(cc1=O)CNc2ccc(c(c2)C#N)Cl 7a_100000239497_100000081511 [0,2,0,0,0,0|2,0,0]=4 298 B21R2.2711828 COc1coc(cc1=O)CNc2ccc(c(c2)CO)Cl 2230a_100011273577_100000081511 [0,2,0,0,0,0|2,0,0]=4 299 B21R2.2711828 COc1coc(cc1=O)COc2ccc(c(c2)C#N)Cl 7a_100000092820_100000081511 [0,2,0,0,0,0|1,1,0]=4 300 B21R2.2711828 COc1coc(cc1=O)COc2ccc(c(c2)CO)Cl 7a_100000091669_100000081511 [0,2,0,0,0,0|1,1,0]=4 301 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C#N)Br 62a_100012355174_100000081511 [0,2,0,0,0,0|1,1,0]=4 302 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C=O)Br 62a_100010185652_100000081511 [0,2,0,0,0,0|1,1,0]=4 303 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C=O)C 62a_100011361606_100000081511 [0,2,0,0,0,0|2,0,0]=4 304 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C=O)Cl 62a_100010254384_100000081511 [0,2,0,0,0,0|1,0,0]=3 305 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C=O)F 62a_100000050626_100000081511 [0,2,0,0,0,0|1,1,0]=4 306 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)C=O)N 62a_100011935258_100000081511 [0,2,0,0,0,0|2,0,0]=4 307 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CN)F 62a_100009815772_100000081511 [0,2,0,0,0,0|1,1,0]=4 308 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CN)N 62a_100012349119_100000081511 [0,2,0,0,0,0|2,0,0]=4 309 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CN)O 62a_100000730032_100000081511 [0,2,0,0,0,0|2,0,0]=4 310 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)Br 62a_100012359683_100000081511 [0,2,0,0,0,0|1,1,0]=4 311 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)C 62a_100000700630_100000081511 [0,2,0,0,0,0|2,0,0]=4 312 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)Cl 62a_100010128486_100000081511 [0,2,0,0,0,0|1,0,0]=3 313 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)F 62a_100000246282_100000081511 [0,2,0,0,0,0|1,1,0]=4 314 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)N 62a_100012353972_100000081511 [0,2,0,0,0,0|2,0,0]=4 315 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)CO)O 62a_100000184703_100000081511 [0,2,0,0,0,0|2,0,0]=4 316 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)NN)F 62a_100020610843_100000081511 [0,2,0,0,0,0|1,1,0]=4 317 B21R2.2711828 COc1coc(cc1=O)CSc2ccc(c(c2)SC)F 62a_100010341305_100000081511 [0,2,0,0,0,0|1,1,0]=4 318 B21R2.2711828 CSc1ccc(cc1Cl)SCc2ccc(c(c2)C=O)O 62a_206447510565_100000008128 [0,2,0,0,0,0|2,0,0]=4 319 B21R2.2711828 O=Cc1cc(ccc1O)CSc2ccc(c(c2)Cl)C=O 62a_100000727542_100000008128 [0,2,0,0,0,0|2,0,0]=4 320 B21R2.2882237 COc1c(ccc(c1F)SCc2cc(=O)c(co2)O)Cl 62a_200135222481_100000010605 [0,2,0,0,0,0|1,0,0]=3 321 B21R2.2882237 COc1c(ccc(c1F)SCc2cc(=O)c(co2)O)N 62a_100010734149_100000010605 [0,2,0,0,0,0|2,0,0]=4 322 B21R2.2882237 CSc1c(ccc(c1F)SCc2cc(=O)c(co2)O)F 62a_202125771753_100000010605 [0,2,0,0,0,0|1,1,0]=4 323 B21R2.2882237 N#Cc1c(ccc(c1Cl)NCc2cc(=O)c(co2)O)Cl 7a_100000092368_100000010605 [0,2,0,0,0,0|2,0,0]=4 324 B21R2.2882237 N#Cc1c(ccc(c1F)SCc2cc(=O)c(co2)O)F 62a_100010080413_100000010605 [0,2,0,0,0,0|1,1,0]=4 325 B21R2.2882237 O=Cc1c(ccc(c1F)SCc2cc(=O)c(co2)O)Br 62a_100010769263_100000010605 [0,2,0,0,0,0|1,1,0]=4 326 B21R2.2882237 O=Cc1c(ccc(c1F)SCc2cc(=O)c(co2)O)Cl 62a_100010782290_100000010605 [0,2,0,0,0,0|1,0,0]=3 327 B21R2.2882237 O=Cc1c(ccc(c1F)SCc2cc(=O)c(co2)O)F 62a_100000725362_100000010605 [0,2,0,0,0,0|1,1,0]=4 328 B21R2.2882237 O=c1cc(occ1O)CSc2ccc(c(c2F)CO)Br 62a_200010782277_100000010605 [0,2,0,0,0,0|1,1,0]=4 329 B21R2.2882237 O=c1cc(occ1O)CSc2ccc(c(c2F)CO)F 62a_100000725363_100000010605 [0,2,0,0,0,0|1,1,0]=4 330 B21R2.8436726 Cc1cc(cc(c1Cl)Cl)NCc2ccc(c(c2)C=O)O 7a_100009830880_100000008128 [0,2,0,0,0,0|2,0,0]=4 331 B21R2.8436726 Cc1cc(cc(c1O)Cl)SCc2ccc(c(c2)C=O)O 62a_200015900153_100000008128 [0,2,0,0,0,0|2,0,0]=4 332 B21R2.8436726 O=Cc1cc(ccc1O)CNc2cc(c(c(c2)Br)Cl)Cl 7a_100010735061_100000008128 [0,2,0,0,0,0|2,0,0]=4 333 B21R2.8436726 O=Cc1cc(ccc1O)CNc2cc(c(c(c2)Cl)Cl)Cl 7a_100000037808_100000008128 [0,2,0,0,0,0|2,0,0]=4 334 B21R2.8436726 O=Cc1cc(ccc1O)CNc2cc(c(c(c2)Cl)Cl)F 7a_100012961779_100000008128 [0,2,0,0,0,0|2,0,0]=4 335 B21R2.8436726 O=Cc1cc(ccc1O)CNc2cc(c(c(c2)Cl)Cl)O 7a_100015839415_100000008128 [0,2,0,0,0,0|2,0,0]=4 336 B21R2.8436726 O=Cc1cc(ccc1O)COc2cc(c(c(c2)Br)Cl)Cl 7a_100016179818_100000008128 [0,2,0,0,0,0|1,1,0]=4 337 B21R2.8436726 O=Cc1cc(ccc1O)COc2cc(c(c(c2)Cl)Cl)Cl 7a_100000074982_100000008128 [0,2,0,0,0,0|1,1,0]=4 338 B21R2.8436726 O=Cc1cc(ccc1O)CSc2cc(c(c(c2)Cl)F)Cl 62a_100012357505_100000008128 [0,2,0,0,0,0|1,1,0]=4 339 B21R2.8436726 O=Cc1cc(ccc1O)CSc2cc(c(c(c2)Cl)O)Cl 62a_100012339652_100000008128 [0,2,0,0,0,0|2,0,0]=4 340 B21R2.8436726 O=Cc1cc(ccc1O)CSc2cc(c(c(c2)F)Cl)F 62a_100010154629_100000008128 [0,2,0,0,0,0|1,1,0]=4 341 B21R2.19207 Cc1c(c(cc(c1F)SCc2cc(=O)c(co2)O)F)F 62a_200010072831_100000010605 [0,2,0,0,0,0|0,2,0]=4 342 B21R2.19207 Cc1c(cc(c(c1C)N)N)SCc2cc(=O)c(co2)O 62a_100009812817_100000010605 [0,2,0,0,0,0|2,0,0]=4 343 B21R2.19207 Cc1cc(c(c(c1Cl)C)Cl)OCc2cc(=O)c(co2)O 7a_100011219678_100000010605 [0,2,0,0,0,0|1,1,0]=4 344 B21R2.19207 Cc1cc(c(c(c1O)C)C)SCc2cc(=O)c(co2)O 62a_200012339818_100000010605 [0,2,0,0,0,0|2,0,0]=4 345 B21R2.19207 Nc1c(cc(c(c1F)Br)F)SCc2cc(=O)c(co2)O 62a_200102952493_100000010605 [0,2,0,0,0,0|0,2,0]=4 346 B21R2.19207 Nc1c(cc(c(c1F)F)F)SCc2cc(=O)c(co2)O 62a_100011215548_100000010605 [0,2,0,0,0,0|0,2,0]=4 347 B21R2.19207 O=c1cc(occ1O)CNc2cc(c(c(c2Br)Cl)Br)Cl 7a_200010212261_100000010605 [0,2,0,0,0,0|1,1,0]=4 348 B21R2.19207 O=c1cc(occ1O)CNc2cc(c(c(c2Cl)F)Cl)F 2230a_200009859656_100000010605 [0,2,0,0,0,0|1,1,0]=4 349 B21R2.19207 O=c1cc(occ1O)CNc2cc(c(c(c2Cl)F)Cl)F 7a_200009859656_100000010605 [0,2,0,0,0,0|1,1,0]=4 350 B21R2.19207 O=c1cc(occ1O)CNc2cc(c(c(c2F)Cl)F)Cl 2230a_100000037071_100000010605 [0,2,0,0,0,0|1,1,0]=4 351 B21R2.19207 O=c1cc(occ1O)CNc2cc(c(c(c2F)Cl)F)Cl 7a_100000037071_100000010605 [0,2,0,0,0,0|1,1,0]=4 352 B21R2.19207 O=c1cc(occ1O)CSc2cc(c(c(c2Br)F)F)F 62a_200010187590_100000010605 [0,2,0,0,0,0|0,2,0]=4 353 B21R2.19207 O=c1cc(occ1O)CSc2cc(c(c(c2F)F)F)Br 62a_200029601227_100000010605 [0,2,0,0,0,0|0,2,0]=4 354 B21R2.19207 O=c1cc(occ1O)CSc2cc(c(c(c2F)F)F)F 62a_200009813226_100000010605 [0,2,0,0,0,0|0,2,0]=4 355 B21R2.19207 O=c1cc(occ1O)CSc2cc(c(c(c2F)F)F)O 62a_100009816144_100000010605 [0,2,0,0,0,0|0,2,0]=4 356 B21R2.81082 COc1c(ccc(c1F)C)SCc2cc(=O)c(co2)O 62a_100010081143_100000010605 [0,2,0,0,0,0|1,1,0]=4 357 B21R2.81082 COc1c(ccc(c1F)F)SCc2cc(=O)c(co2)O 62a_100010223324_100000010605 [0,2,0,0,0,0|0,2,0]=4 358 B21R2.81082 CSc1c(ccc(c1F)C)SCc2cc(=O)c(co2)O 62a_200134762213_100000010605 [0,2,0,0,0,0|1,1,0]=4 359 B21R2.81082 Cc1ccc(c(c1F)C=O)SCc2cc(=O)c(co2)O 62a_100000039034_100000010605 [0,2,0,0,0,0|1,1,0]=4 360 B21R2.81082 N#Cc1c(ccc(c1Br)Cl)OCc2cc(=O)c(co2)O 7a_100015534069_100000010605 [0,2,0,0,0,0|0,2,0]=4 361 B21R2.81082 N#Cc1c(ccc(c1Cl)Cl)NCc2cc(=O)c(co2)O 2230a_100000043469_100000010605 [0,2,0,0,0,0|1,0,0]=3 362 B21R2.81082 N#Cc1c(ccc(c1Cl)Cl)NCc2cc(=O)c(co2)O 7a_100000043469_100000010605 [0,2,0,0,0,0|1,0,0]=3 363 B21R2.81082 N#Cc1c(ccc(c1F)Br)SCc2cc(=O)c(co2)O 62a_100010208228_100000010605 [0,2,0,0,0,0|0,2,0]=4 364 B21R2.81082 N#Cc1c(ccc(c1F)F)SCc2cc(=O)c(co2)O 62a_100010752648_100000010605 [0,2,0,0,0,0|0,2,0]=4 365 B21R2.81082 O=Cc1c(ccc(c1F)F)SCc2cc(=O)c(co2)O 62a_100009814791_100000010605 [0,2,0,0,0,0|0,2,0]=4 366 B21R2.81082 O=c1cc(occ1O)CSc2ccc(c(c2CO)F)F 62a_100010177773_100000010605 [0,2,0,0,0,0|0,2,0]=4 367 B21R2.781630 Cc1c(c(cc(c1NCc2cc(=O)c(co2)O)Br)Br)Cl 7a_200010186311_100000010605 [0,2,0,0,0,0|1,1,0]=4 368 B21R2.781630 Cc1c(cc(c(c1Cl)NCc2cc(=O)c(co2)O)Cl)Cl 7a_100012970278_100000010605 [0,2,0,0,0,0|2,0,0]=4 369 B21R2.781630 Cc1c(cc(c(c1Cl)OCc2cc(=O)c(co2)O)N)Cl 7a_100000011795_100000010605 [0,2,0,0,0,0|1,1,0]=4 370 B21R2.781630 Cc1cc(c(c(c1F)C)SCc2cc(=O)c(co2)O)C 62a_100010738083_100000010605 [0,2,0,0,0,0|1,1,0]=4 371 B21R2.781630 Cc1cc(c(c(c1N)C)SCc2cc(=O)c(co2)O)C 62a_100011215665_100000010605 [0,2,0,0,0,0|2,0,0]=4 372 B21R2.781630 Cc1cc(c(c(c1SCc2cc(=O)c(co2)O)C)C)O 62a_100000730119_100000010605 [0,2,0,0,0,0|2,0,0]=4 373 B21R2.781630 Nc1cc(c(c(c1SCc2cc(=O)c(co2)O)F)F)F 62a_100012339889_100000010605 [0,2,0,0,0,0|0,2,0]=4 374 B21R2.781630 O=c1cc(occ1O)CSc2c(cc(c(c2Br)F)Br)F 62a_200010212197_100000010605 [0,2,0,0,0,0|0,2,0]=4 375 B21R2.1897678 COc1ccc(c(c1C)C)SCc2cc(=O)c(co2)O 62a_100000049725_100000010605 [0,2,0,0,0,0|2,0,0]=4 376 B21R2.1897678 COc1ccc(c(c1F)F)SCc2cc(=O)c(co2)O 62a_100009816879_100000010605 [0,2,0,0,0,0|1,1,0]=4 377 B21R2.1897678 CSc1ccc(c(c1F)C)SCc2cc(=O)c(co2)O 62a_202125771832_100000010605 [0,2,0,0,0,0|1,1,0]=4 378 B21R2.1897678 Cc1c(ccc(c1Cl)C#N)NCc2cc(=O)c(co2)O 7a_100000087022_100000010605 [0,2,0,0,0,0|2,0,0]=4 379 B21R2.1897678 Cc1c(ccc(c1F)C=O)SCc2cc(=O)c(co2)O 62a_100015546853_100000010605 [0,2,0,0,0,0|1,1,0]=4 380 B21R2.1897678 NCc1ccc(c(c1F)F)SCc2cc(=O)c(co2)O 62a_100020621914_100000010605 [0,2,0,0,0,0|1,1,0]=4 381 B21R2.1897678 O=Cc1ccc(c(c1F)F)SCc2cc(=O)c(co2)O 62a_100010209662_100000010605 [0,2,0,0,0,0|1,1,0]=4 382 B21R2.1897678 O=Cc1ccc(c(c1O)F)SCc2cc(=O)c(co2)O 62a_100010762540_100000010605 [0,2,0,0,0,0|2,0,0]=4 383 B21R2.1897678 O=c1cc(occ1O)CSc2ccc(c(c2F)F)CO 62a_100010712623_100000010605 [0,2,0,0,0,0|1,1,0]=4 384 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Br)Cl 2230a_100016073598_100000081511 [0,2,0,0,0,0|1,1,0]=4 385 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Br)Cl 7a_100016073598_100000081511 [0,2,0,0,0,0|1,1,0]=4 386 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)Br 2230a_100009816872_100000081511 [0,2,0,0,0,0|1,1,0]=4 387 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)Br 7a_100009816872_100000081511 [0,2,0,0,0,0|1,1,0]=4 388 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)C 2230a_100009954856_100000081511 [0,2,0,0,0,0|2,0,0]=4 389 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)C 7a_100009954856_100000081511 [0,2,0,0,0,0|2,0,0]=4 390 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)Cl 2230a_114948340058_100000081511 [0,2,0,0,0,0|1,0,0]=3 391 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2C)Cl)Cl 7a_114948340058_100000081511 [0,2,0,0,0,0|1,0,0]=3 392 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)C)Cl 7a_100011935240_100000081511 [0,2,0,0,0,0|2,0,0]=4 393 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)Cl)F 2230a_100000068956_100000081511 [0,2,0,0,0,0|1,1,0]=4 394 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)Cl)F 7a_100000068956_100000081511 [0,2,0,0,0,0|1,1,0]=4 395 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)Cl)O 7a_100012017499_100000081511 [0,2,0,0,0,0|2,0,0]=4 396 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)F)Cl 2230a_100000069711_100000081511 [0,2,0,0,0,0|1,1,0]=4 397 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2Cl)F)Cl 7a_100000069711_100000081511 [0,2,0,0,0,0|1,1,0]=4 398 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)Cl)Br 2230a_100009813730_100000081511 [0,2,0,0,0,0|1,1,0]=4 399 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)Cl)Cl 2230a_100000036759_100000081511 [0,2,0,0,0,0|1,0,0]=3 400 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)Cl)F 2230a_100000038966_100000081511 [0,2,0,0,0,0|1,1,0]=4 401 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)Cl)F 7a_100000038966_100000081511 [0,2,0,0,0,0|1,1,0]=4 402 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)Cl)O 7a_200000098347_100000081511 [0,2,0,0,0,0|2,0,0]=4 403 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)F)Cl 2230a_100000088996_100000081511 [0,2,0,0,0,0|1,1,0]=4 404 B21R2.2711826 COc1coc(cc1=O)CNc2ccc(c(c2F)F)Cl 7a_100000088996_100000081511 [0,2,0,0,0,0|1,1,0]=4 405 B21R2.2711826 COc1coc(cc1=O)COc2ccc(c(c2Cl)Cl)Br 7a_100011988769_100000081511 [0,2,0,0,0,0|0,2,0]=4 406 B21R2.2711826 COc1coc(cc1=O)COc2ccc(c(c2Cl)Cl)Cl 7a_200011215298_100000081511 [0,2,0,0,0,0|0,1,0]=3 407 B21R2.2711826 COc1coc(cc1=O)COc2ccc(c(c2Cl)Cl)N 7a_100012017499_100000081511 [0,2,0,0,0,0|1,1,0]=4 408 B21R2.2711826 COc1coc(cc1=O)COc2ccc(c(c2Cl)N)Cl 7a_100016988457_100000081511 [0,2,0,0,0,0|1,1,0]=4 409 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)C)Br 62a_200010185626_100000081511 [0,2,0,0,0,0|1,1,0]=4 410 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)C)F 62a_100009816033_100000081511 [0,2,0,0,0,0|1,1,0]=4 411 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)C)N 62a_100009816967_100000081511 [0,2,0,0,0,0|2,0,0]=4 412 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)C)O 62a_100012353674_100000081511 [0,2,0,0,0,0|2,0,0]=4 413 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)Cl)Br 62a_200010212245_100000081511 [0,2,0,0,0,0|0,1,0]=3 414 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)F)Br 62a_100010208201_100000081511 [0,2,0,0,0,0|0,2,0]=4 415 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)F)F 62a_100009815991_100000081511 [0,2,0,0,0,0|0,2,0]=4 416 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)F)N 62a_100000722916_100000081511 [0,2,0,0,0,0|1,1,0]=4 417 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)N)C 62a_200010074581_100000081511 [0,2,0,0,0,0|2,0,0]=4 418 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)N)F 62a_100010588651_100000081511 [0,2,0,0,0,0|1,1,0]=4 419 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)N)N 62a_100010009725_100000081511 [0,2,0,0,0,0|2,0,0]=4 420 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2C)N)O 62a_100013039247_100000081511 [0,2,0,0,0,0|2,0,0]=4 421 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2Cl)C)Br 62a_100055076181_100000081511 [0,2,0,0,0,0|1,1,0]=4 422 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2Cl)C)Cl 62a_100010730154_100000081511 [0,2,0,0,0,0|1,0,0]=3 423 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)Br)F 62a_100010167943_100000081511 [0,2,0,0,0,0|0,2,0]=4 424 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)Br)N 62a_100015781493_100000081511 [0,2,0,0,0,0|1,1,0]=4 425 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)C)C 62a_200015555822_100000081511 [0,2,0,0,0,0|2,0,0]=4 426 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)C)F 62a_100009815987_100000081511 [0,2,0,0,0,0|1,1,0]=4 427 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)C)N 62a_100010208198_100000081511 [0,2,0,0,0,0|2,0,0]=4 428 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)C)O 62a_100010390934_100000081511 [0,2,0,0,0,0|2,0,0]=4 429 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)Cl)Br 62a_100010212236_100000081511 [0,2,0,0,0,0|0,1,0]=3 430 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)Cl)F 62a_200000038702_100000081511 [0,2,0,0,0,0|0,1,0]=3 431 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)F)Br 62a_100010212264_100000081511 [0,2,0,0,0,0|0,2,0]=4 432 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)F)C 62a_100012766498_100000081511 [0,2,0,0,0,0|1,1,0]=4 433 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)F)F 62a_100000750562_100000081511 [0,2,0,0,0,0|0,2,0]=4 434 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)F)N 62a_100010200256_100000081511 [0,2,0,0,0,0|1,1,0]=4 435 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)F)O 62a_100011830415_100000081511 [0,2,0,0,0,0|1,1,0]=4 436 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)N)F 62a_100025793129_100000081511 [0,2,0,0,0,0|1,1,0]=4 437 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)N)N 62a_100009814308_100000081511 [0,2,0,0,0,0|2,0,0]=4 438 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)O)Br 62a_200010782288_100000081511 [0,2,0,0,0,0|1,1,0]=4 439 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2F)O)F 62a_100010167067_100000081511 [0,2,0,0,0,0|1,1,0]=4 440 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2N)C)F 62a_100011009917_100000081511 [0,2,0,0,0,0|1,1,0]=4 441 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2N)F)F 62a_100010008850_100000081511 [0,2,0,0,0,0|0,2,0]=4 442 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2N)N)F 62a_100011102919_100000081511 [0,2,0,0,0,0|1,1,0]=4 443 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2N)O)Br 62a_100020748643_100000081511 [0,2,0,0,0,0|1,1,0]=4 444 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2O)C)F 62a_200010391124_100000081511 [0,2,0,0,0,0|1,1,0]=4 445 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2O)F)C 62a_100000722096_100000081511 [0,2,0,0,0,0|1,1,0]=4 446 B21R2.2711826 COc1coc(cc1=O)CSc2ccc(c(c2O)F)F 62a_100010243909_100000081511 [0,2,0,0,0,0|0,2,0]=4 447 B21R2.2711826 COc1coc(cc1=O)CSc2cnc(c(c2N)F)Cl 62a_100135388890_100000081511 [0,2,0,0,0,0|1,1,0]=4 448 B21R2.431566 CCc1cc(c(cc1SCc2cc(=O)c(co2)O)F)O 62a_100011156610_100000010605 [0,2,0,0,0,0|1,1,0]=4 449 B21R2.431566 COc1cc(c(cc1NCc2cc(=O)c(co2)O)Br)Cl 2230a_100010380671_100000010605 [0,2,0,0,0,0|1,1,0]=4 450 B21R2.431566 COc1cc(c(cc1NCc2cc(=O)c(co2)O)C)Cl 2230a_100000211396_100000010605 [0,2,0,0,0,0|2,0,0]=4 451 B21R2.431566 COc1cc(c(cc1NCc2cc(=O)c(co2)O)Cl)Br 2230a_100010212225_100000010605 [0,2,0,0,0,0|1,1,0]=4 452 B21R2.431566 COc1cc(c(cc1NCc2cc(=O)c(co2)O)Cl)C 2230a_100009868623_100000010605 [0,2,0,0,0,0|2,0,0]=4 453 B21R2.431566 COc1cc(c(cc1NCc2cc(=O)c(co2)O)Cl)F 2230a_100012186795_100000010605 [0,2,0,0,0,0|1,1,0]=4 454 B21R2.431566 COc1cc(c(cc1SCc2cc(=O)c(co2)O)C)F 62a_100010201977_100000010605 [0,2,0,0,0,0|1,1,0]=4 455 B21R2.431566 COc1cc(c(cc1SCc2cc(=O)c(co2)O)C)N 62a_100010232211_100000010605 [0,2,0,0,0,0|2,0,0]=4 456 B21R2.431566 COc1cc(c(cc1SCc2cc(=O)c(co2)O)F)F 62a_100009813744_100000010605 [0,2,0,0,0,0|0,2,0]=4 457 B21R2.431566 COc1cc(c(cc1SCc2cc(=O)c(co2)O)N)C 62a_106657271712_100000010605 [0,2,0,0,0,0|2,0,0]=4 458 B21R2.431566 COc1cc(c(cc1SCc2cc(=O)c(co2)O)N)N 62a_100012769537_100000010605 [0,2,0,0,0,0|2,0,0]=4 459 B21R2.431566 Cc1cc(c(cc1C)SCc2cc(=O)c(co2)O)C=O 62a_100010184403_100000010605 [0,2,0,0,0,0|2,0,0]=4 460 B21R2.431566 Cc1cc(c(cc1C)SCc2cc(=O)c(co2)O)CO 62a_100010184405_100000010605 [0,2,0,0,0,0|2,0,0]=4 461 B21R2.431566 Cc1cc(c(cc1F)C=O)SCc2cc(=O)c(co2)O 62a_100010186290_100000010605 [0,2,0,0,0,0|1,1,0]=4 462 B21R2.431566 Cc1cc(c(cc1F)SCc2cc(=O)c(co2)O)C=O 62a_100009814814_100000010605 [0,2,0,0,0,0|1,1,0]=4 463 B21R2.431566 Cc1cc(c(cc1O)C=O)SCc2cc(=O)c(co2)O 62a_100010186689_100000010605 [0,2,0,0,0,0|2,0,0]=4 464 B21R2.431566 N#Cc1cc(c(cc1NCc2cc(=O)c(co2)O)Cl)Cl 7a_100009958103_100000010605 [0,2,0,0,0,0|1,0,0]=3 465 B21R2.431566 N#Cc1cc(c(cc1NCc2cc(=O)c(co2)O)F)Cl 2230a_200010892116_100000010605 [0,2,0,0,0,0|1,1,0]=4 466 B21R2.431566 N#Cc1cc(c(cc1NCc2cc(=O)c(co2)O)F)Cl 7a_200010892116_100000010605 [0,2,0,0,0,0|1,1,0]=4 467 B21R2.431566 N#Cc1cc(c(cc1OCc2cc(=O)c(co2)O)F)Cl 7a_200014338297_100000010605 [0,2,0,0,0,0|0,2,0]=4 468 B21R2.431566 O=Cc1cc(c(cc1SCc2cc(=O)c(co2)O)F)F 62a_100012344232_100000010605 [0,2,0,0,0,0|0,2,0]=4 469 B21R2.431566 O=c1cc(occ1O)CSc2cc(c(cc2CO)F)F 62a_100012344399_100000010605 [0,2,0,0,0,0|0,2,0]=4 470 B21R2.465949 COc1cc(c(cc1C)SCc2cc(=O)c(co2)O)C 62a_100000698960_100000010605 [0,2,0,0,0,0|2,0,0]=4 471 B21R2.465949 COc1cc(c(cc1C)SCc2cc(=O)c(co2)O)N 62a_100010244135_100000010605 [0,2,0,0,0,0|2,0,0]=4 472 B21R2.465949 COc1cc(c(cc1Cl)NCc2cc(=O)c(co2)O)C 7a_100012039520_100000010605 [0,2,0,0,0,0|2,0,0]=4 473 B21R2.465949 COc1cc(c(cc1F)SCc2cc(=O)c(co2)O)C 62a_100010074640_100000010605 [0,2,0,0,0,0|1,1,0]=4 474 B21R2.465949 COc1cc(c(cc1F)SCc2cc(=O)c(co2)O)F 62a_100009813720_100000010605 [0,2,0,0,0,0|1,1,0]=4 475 B21R2.465949 COc1cc(c(cc1F)SCc2cc(=O)c(co2)O)N 62a_100010208193_100000010605 [0,2,0,0,0,0|1,1,0]=4 476 B21R2.465949 COc1cc(c(cc1N)SCc2cc(=O)c(co2)O)Cl 62a_100011011177_100000010605 [0,2,0,0,0,0|2,0,0]=4 477 B21R2.465949 COc1cc(c(cc1N)SCc2cc(=O)c(co2)O)F 62a_100012361397_100000010605 [0,2,0,0,0,0|2,0,0]=4 478 B21R2.465949 Cc1cc(c(cc1C=O)C)SCc2cc(=O)c(co2)O 62a_100012024176_100000010605 [0,2,0,0,0,0|2,0,0]=4 479 B21R2.465949 Cc1cc(c(cc1C=O)F)SCc2cc(=O)c(co2)O 62a_100010186292_100000010605 [0,2,0,0,0,0|2,0,0]=4 480 B21R2.465949 Cc1cc(c(cc1SCc2cc(=O)c(co2)O)F)C=O 62a_100010186291_100000010605 [0,2,0,0,0,0|1,1,0]=4 481 B21R2.465949 Cc1cc(c(cc1SCc2cc(=O)c(co2)O)O)C=O 62a_200010762526_100000010605 [0,2,0,0,0,0|2,0,0]=4 482 B21R2.465949 N#Cc1cc(c(cc1Cl)NCc2cc(=O)c(co2)O)F 7a_100000102500_100000010605 [0,2,0,0,0,0|2,0,0]=4 483 B21R2.465949 N#Cc1cc(c(cc1Cl)OCc2cc(=O)c(co2)O)Cl 7a_100013052837_100000010605 [0,2,0,0,0,0|1,1,0]=4 484 B21R2.465949 O=Cc1cc(c(cc1F)SCc2cc(=O)c(co2)O)F 62a_100011998483_100000010605 [0,2,0,0,0,0|1,1,0]=4 485 B21R2.465949 O=Cc1cc(c(cc1O)SCc2cc(=O)c(co2)O)F 62a_200010762562_100000010605 [0,2,0,0,0,0|2,0,0]=4 486 B21R2.465949 O=c1cc(occ1O)CSc2cc(c(cc2F)CO)F 62a_100012024398_100000010605 [0,2,0,0,0,0|1,1,0]=4 487 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Br)C)Cl 7a_100000702286_100000081511 [0,2,0,0,0,0|2,0,0]=4 488 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Br)Cl)F 7a_100010254744_100000081511 [0,2,0,0,0,0|1,1,0]=4 489 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Br)F)Cl 7a_100009817155_100000081511 [0,2,0,0,0,0|1,1,0]=4 490 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Br)Cl 2230a_100012353740_100000081511 [0,2,0,0,0,0|1,1,0]=4 491 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Br)Cl 7a_100012353740_100000081511 [0,2,0,0,0,0|1,1,0]=4 492 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)Br 2230a_100010244688_100000081511 [0,2,0,0,0,0|1,1,0]=4 493 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)Br 7a_100010244688_100000081511 [0,2,0,0,0,0|1,1,0]=4 494 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)C 2230a_100011830454_100000081511 [0,2,0,0,0,0|2,0,0]=4 495 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)C 7a_100011830454_100000081511 [0,2,0,0,0,0|2,0,0]=4 496 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)Cl 7a_100012017293_100000081511 [0,2,0,0,0,0|1,0,0]=3 497 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)Cl)O 7a_100009961766_100000081511 [0,2,0,0,0,0|2,0,0]=4 498 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)F)Cl 2230a_100012017673_100000081511 [0,2,0,0,0,0|1,1,0]=4 499 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2C)F)Cl 7a_100012017673_100000081511 [0,2,0,0,0,0|1,1,0]=4 500 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Br)Cl 7a_100000246133_100000081511 [0,2,0,0,0,0|1,1,0]=4 501 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)Br 7a_200012360370_100000081511 [0,2,0,0,0,0|1,1,0]=4 502 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)C 7a_100012000392_100000081511 [0,2,0,0,0,0|2,0,0]=4 503 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)Cl 7a_100000211015_100000081511 [0,2,0,0,0,0|1,0,0]=3 504 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)F 7a_100012017157_100000081511 [0,2,0,0,0,0|1,1,0]=4 505 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)I 7a_100016224655_100000081511 [0,2,0,0,0,0|1,1,0]=4 506 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)Cl)O 7a_100000037174_100000081511 [0,2,0,0,0,0|2,0,0]=4 507 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)F)Cl 7a_100000085081_100000081511 [0,2,0,0,0,0|1,1,0]=4 508 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2Cl)O)Cl 7a_100012000071_100000081511 [0,2,0,0,0,0|2,0,0]=4 509 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Br)Cl 7a_100012356688_100000081511 [0,2,0,0,0,0|1,1,0]=4 510 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Cl)Br 7a_100013023876_100000081511 [0,2,0,0,0,0|1,1,0]=4 511 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Cl)C 7a_100000091823_100000081511 [0,2,0,0,0,0|2,0,0]=4 512 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Cl)Cl 7a_100000724578_100000081511 [0,2,0,0,0,0|1,0,0]=3 513 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Cl)F 7a_100011998097_100000081511 [0,2,0,0,0,0|1,1,0]=4 514 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)Cl)O 7a_100000042052_100000081511 [0,2,0,0,0,0|2,0,0]=4 515 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)F)Cl 2230a_100011998096_100000081511 [0,2,0,0,0,0|1,1,0]=4 516 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2F)F)Cl 7a_100011998096_100000081511 [0,2,0,0,0,0|1,1,0]=4 517 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2I)Cl)Cl 7a_200011093942_100000081511 [0,2,0,0,0,0|1,0,0]=3 518 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2I)Cl)F 7a_100010892166_100000081511 [0,2,0,0,0,0|1,1,0]=4 519 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2I)F)Cl 7a_200010992381_100000081511 [0,2,0,0,0,0|1,1,0]=4 520 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2O)Cl)Br 7a_100013488937_100000081511 [0,2,0,0,0,0|1,1,0]=4 521 B21R2.2478188 COc1coc(cc1=O)CNc2cc(c(cc2O)Cl)Cl 7a_100000696747_100000081511 [0,2,0,0,0,0|1,0,0]=3 522 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Br)Cl)C 7a_100022700756_100000081511 [0,2,0,0,0,0|1,1,0]=4 523 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2C)Cl)N 7a_100000092876_100000081511 [0,2,0,0,0,0|1,1,0]=4 524 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)Br)Cl 7a_100000719705_100000081511 [0,2,0,0,0,0|0,2,0]=4 525 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)Cl)Br 7a_100010203734_100000081511 [0,2,0,0,0,0|0,2,0]=4 526 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)Cl)C 7a_100012002691_100000081511 [0,2,0,0,0,0|1,1,0]=4 527 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)Cl)Cl 7a_100000211312_100000081511 [0,2,0,0,0,0|0,1,0]=3 528 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)Cl)N 7a_100000037174_100000081511 [0,2,0,0,0,0|1,1,0]=4 529 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2Cl)N)Cl 7a_100012000071_100000081511 [0,2,0,0,0,0|1,1,0]=4 530 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2F)N)Cl 7a_100009886023_100000081511 [0,2,0,0,0,0|1,1,0]=4 531 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2N)Br)Cl 7a_100013488937_100000081511 [0,2,0,0,0,0|0,2,0]=4 532 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2N)Cl)C 7a_100000091707_100000081511 [0,2,0,0,0,0|1,1,0]=4 533 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2N)Cl)Cl 7a_100000696747_100000081511 [0,2,0,0,0,0|0,1,0]=3 534 B21R2.2478188 COc1coc(cc1=O)COc2cc(c(cc2N)I)Cl 7a_100011011175_100000081511 [0,2,0,0,0,0|0,2,0]=4 535 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)Br)F 62a_200010212206_100000081511 [0,2,0,0,0,0|0,2,0]=4 536 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)C)Br 62a_100012929169_100000081511 [0,2,0,0,0,0|1,1,0]=4 537 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)C)F 62a_200009814774_100000081511 [0,2,0,0,0,0|1,1,0]=4 538 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)Cl)F 62a_100010254745_100000081511 [0,2,0,0,0,0|0,1,0]=3 539 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)Cl)O 62a_100021297947_100000081511 [0,2,0,0,0,0|1,0,0]=3 540 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)F)C 62a_200009814773_100000081511 [0,2,0,0,0,0|1,1,0]=4 541 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Br)F)F 62a_100010259568_100000081511 [0,2,0,0,0,0|0,2,0]=4 542 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)Br)C 62a_100011356911_100000081511 [0,2,0,0,0,0|1,1,0]=4 543 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)Br)Cl 62a_200009814780_100000081511 [0,2,0,0,0,0|0,1,0]=3 544 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)Br)F 62a_100011356895_100000081511 [0,2,0,0,0,0|0,2,0]=4 545 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)C)C 62a_100000759388_100000081511 [0,2,0,0,0,0|2,0,0]=4 546 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)C)N 62a_100000703630_100000081511 [0,2,0,0,0,0|2,0,0]=4 547 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)Cl)C 62a_100012357408_100000081511 [0,2,0,0,0,0|1,0,0]=3 548 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)F)Br 62a_100011216669_100000081511 [0,2,0,0,0,0|0,2,0]=4 549 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)F)C 62a_100010212296_100000081511 [0,2,0,0,0,0|1,1,0]=4 550 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)F)F 62a_100009815990_100000081511 [0,2,0,0,0,0|0,2,0]=4 551 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)F)N 62a_100011014115_100000081511 [0,2,0,0,0,0|1,1,0]=4 552 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)F)O 62a_100010068922_100000081511 [0,2,0,0,0,0|1,1,0]=4 553 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)N)C 62a_100011934712_100000081511 [0,2,0,0,0,0|2,0,0]=4 554 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)N)F 62a_100000691575_100000081511 [0,2,0,0,0,0|1,1,0]=4 555 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)N)N 62a_100010080480_100000081511 [0,2,0,0,0,0|2,0,0]=4 556 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)N)O 62a_200010107346_100000081511 [0,2,0,0,0,0|2,0,0]=4 557 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)O)C 62a_100000698207_100000081511 [0,2,0,0,0,0|2,0,0]=4 558 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)O)F 62a_100012355673_100000081511 [0,2,0,0,0,0|1,1,0]=4 559 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2C)O)N 62a_200010235796_100000081511 [0,2,0,0,0,0|2,0,0]=4 560 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)Br)C 62a_100010259621_100000081511 [0,2,0,0,0,0|1,1,0]=4 561 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)Br)F 62a_100010212230_100000081511 [0,2,0,0,0,0|0,2,0]=4 562 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)Cl)Cl 62a_200011216203_100000081511 [0,2,0,0,0,0|0,0,0]=2 563 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)Cl)N 62a_100016224655_100000081511 [0,2,0,0,0,0|1,0,0]=3 564 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)F)F 62a_100012349977_100000081511 [0,2,0,0,0,0|0,2,0]=4 565 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2Cl)O)N 62a_100011011175_100000081511 [0,2,0,0,0,0|2,0,0]=4 566 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)Br)Br 62a_200010212210_100000081511 [0,2,0,0,0,0|0,2,0]=4 567 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)Br)C 62a_200009814772_100000081511 [0,2,0,0,0,0|1,1,0]=4 568 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)Br)F 62a_100011356857_100000081511 [0,2,0,0,0,0|0,2,0]=4 569 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)C)Br 62a_100011068846_100000081511 [0,2,0,0,0,0|1,1,0]=4 570 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)C)C 62a_100010197417_100000081511 [0,2,0,0,0,0|2,0,0]=4 571 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)C)F 62a_100011219510_100000081511 [0,2,0,0,0,0|1,1,0]=4 572 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)C)N 62a_100000717900_100000081511 [0,2,0,0,0,0|2,0,0]=4 573 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)C)O 62a_100014242602_100000081511 [0,2,0,0,0,0|2,0,0]=4 574 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)Cl)F 62a_100010142863_100000081511 [0,2,0,0,0,0|0,1,0]=3 575 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)Cl)O 62a_100010735246_100000081511 [0,2,0,0,0,0|1,0,0]=3 576 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)F)Br 62a_100011356914_100000081511 [0,2,0,0,0,0|0,2,0]=4 577 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)F)C 62a_100000692463_100000081511 [0,2,0,0,0,0|1,1,0]=4 578 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)F)F 62a_100011756838_100000081511 [0,2,0,0,0,0|0,2,0]=4 579 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)F)N 62a_100000700208_100000081511 [0,2,0,0,0,0|1,1,0]=4 580 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)F)O 62a_100012457948_100000081511 [0,2,0,0,0,0|1,1,0]=4 581 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)N)C 62a_100000695870_100000081511 [0,2,0,0,0,0|2,0,0]=4 582 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)N)F 62a_100000690247_100000081511 [0,2,0,0,0,0|1,1,0]=4 583 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)N)N 62a_100000766667_100000081511 [0,2,0,0,0,0|2,0,0]=4 584 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)N)O 62a_100013038943_100000081511 [0,2,0,0,0,0|2,0,0]=4 585 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)O)F 62a_100011830439_100000081511 [0,2,0,0,0,0|1,1,0]=4 586 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2F)O)N 62a_100012359894_100000081511 [0,2,0,0,0,0|2,0,0]=4 587 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)Br)C 62a_200015600912_100000081511 [0,2,0,0,0,0|1,1,0]=4 588 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)Br)F 62a_200021016574_100000081511 [0,2,0,0,0,0|0,2,0]=4 589 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)C)C 62a_100012337760_100000081511 [0,2,0,0,0,0|2,0,0]=4 590 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)C)F 62a_100010233353_100000081511 [0,2,0,0,0,0|1,1,0]=4 591 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)Cl)Cl 62a_200011093942_100000081511 [0,2,0,0,0,0|0,0,0]=2 592 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)Cl)F 62a_200010992381_100000081511 [0,2,0,0,0,0|0,1,0]=3 593 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)F)Br 62a_100010888672_100000081511 [0,2,0,0,0,0|0,2,0]=4 594 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)F)C 62a_100011218008_100000081511 [0,2,0,0,0,0|1,1,0]=4 595 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)F)Cl 62a_100010892166_100000081511 [0,2,0,0,0,0|0,1,0]=3 596 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)F)F 62a_100000765032_100000081511 [0,2,0,0,0,0|0,2,0]=4 597 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)N)C 62a_200013038441_100000081511 [0,2,0,0,0,0|2,0,0]=4 598 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2N)N)F 62a_200010115645_100000081511 [0,2,0,0,0,0|1,1,0]=4 599 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2O)C)C 62a_100009814663_100000081511 [0,2,0,0,0,0|2,0,0]=4 600 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(cc2O)F)F 62a_100009813768_100000081511 [0,2,0,0,0,0|0,2,0]=4 601 B21R2.2478188 COc1coc(cc1=O)CSc2cc(c(nc2N)Cl)Br 62a_100010270345_100000081511 [0,2,0,0,0,0|1,1,0]=4 602 B21R2.3098500 COc1c(cc(cc1Br)SCc2cc(=O)c(co2)O)C 62a_100010997178_100000010605 [0,2,0,0,0,0|1,1,0]=4 603 B21R2.3098500 COc1c(cc(cc1C)SCc2cc(=O)c(co2)O)C 62a_100000211903_100000010605 [0,2,0,0,0,0|2,0,0]=4 604 B21R2.3098500 COc1c(cc(cc1Cl)NCc2cc(=O)c(co2)O)Cl 7a_100000749172_100000010605 [0,2,0,0,0,0|2,0,0]=4 605 B21R2.3098500 COc1c(cc(cc1Cl)NCc2cc(=O)c(co2)O)F 7a_200000094053_100000010605 [0,2,0,0,0,0|2,0,0]=4 606 B21R2.3098500 COc1c(cc(cc1Cl)OCc2cc(=O)c(co2)O)F 7a_100000061510_100000010605 [0,2,0,0,0,0|1,1,0]=4 607 B21R2.3098500 COc1c(cc(cc1Cl)SCc2cc(=O)c(co2)O)Cl 62a_200010110313_100000010605 [0,2,0,0,0,0|1,0,0]=3 608 B21R2.3098500 COc1c(cc(cc1F)SCc2cc(=O)c(co2)O)F 62a_100009813559_100000010605 [0,2,0,0,0,0|1,1,0]=4 609 B21R2.3098500 COc1c(cc(cc1F)SCc2cc(=O)c(co2)O)N 62a_200010245146_100000010605 [0,2,0,0,0,0|1,1,0]=4 610 B21R2.3098500 CSc1c(cc(cc1F)SCc2cc(=O)c(co2)O)F 62a_200010732561_100000010605 [0,2,0,0,0,0|1,1,0]=4 611 B21R2.3098500 Cc1cc(cc(c1C=O)C)SCc2cc(=O)c(co2)O 62a_100010238521_100000010605 [0,2,0,0,0,0|2,0,0]=4 612 B21R2.3098500 Cc1cc(cc(c1CO)C)SCc2cc(=O)c(co2)O 62a_100010128451_100000010605 [0,2,0,0,0,0|2,0,0]=4 613 B21R2.3098500 Cc1cc(cc(c1NN)C)SCc2cc(=O)c(co2)O 62a_100020646918_100000010605 [0,2,0,0,0,0|2,0,0]=4 614 B21R2.3098500 NCc1c(cc(cc1F)SCc2cc(=O)c(co2)O)F 62a_100000709252_100000010605 [0,2,0,0,0,0|1,1,0]=4 615 B21R2.3098500 O=Cc1c(cc(cc1Cl)SCc2cc(=O)c(co2)O)Cl 62a_200011001975_100000010605 [0,2,0,0,0,0|1,0,0]=3 616 B21R2.3098500 O=Cc1c(cc(cc1F)SCc2cc(=O)c(co2)O)F 62a_100000036707_100000010605 [0,2,0,0,0,0|1,1,0]=4 617 B21R2.3098500 O=Cc1c(cc(cc1F)SCc2cc(=O)c(co2)O)O 62a_100010762571_100000010605 [0,2,0,0,0,0|1,1,0]=4 618 B21R2.3098500 O=c1cc(occ1O)COc2cc(c(c(c2)Cl)CO)Cl 7a_100000084600_100000010605 [0,2,0,0,0,0|1,1,0]=4 619 B21R2.3098500 O=c1cc(occ1O)CSc2cc(c(c(c2)Cl)CO)Cl 62a_200011001976_100000010605 [0,2,0,0,0,0|1,0,0]=3 620 B21R2.3098500 O=c1cc(occ1O)CSc2cc(c(c(c2)F)CO)F 62a_100011219983_100000010605 [0,2,0,0,0,0|1,1,0]=4 621 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Br)Cl)Cl 2230a_100010735061_100000081511 [0,2,0,0,0,0|1,0,0]=3 622 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Br)Cl)Cl 7a_100010735061_100000081511 [0,2,0,0,0,0|1,0,0]=3 623 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Br)Cl 2230a_100010212259_100000081511 [0,2,0,0,0,0|1,1,0]=4 624 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Br)Cl 7a_100010212259_100000081511 [0,2,0,0,0,0|1,1,0]=4 625 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Br)F 2230a_100000728458_100000081511 [0,2,0,0,0,0|1,1,0]=4 626 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Br)F 7a_100000728458_100000081511 [0,2,0,0,0,0|1,1,0]=4 627 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)C)Cl 2230a_100000745310_100000081511 [0,2,0,0,0,0|2,0,0]=4 628 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)C)Cl 7a_100000745310_100000081511 [0,2,0,0,0,0|2,0,0]=4 629 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)C 2230a_100009830880_100000081511 [0,2,0,0,0,0|1,0,0]=3 630 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)C 7a_100009830880_100000081511 [0,2,0,0,0,0|1,0,0]=3 631 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)Cl 7a_100000037808_100000081511 [0,2,0,0,0,0|1,0,0]=3 632 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)F 2230a_100012961779_100000081511 [0,2,0,0,0,0|1,0,0]=3 633 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)F 7a_100012961779_100000081511 [0,2,0,0,0,0|1,0,0]=3 634 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)Cl)O 7a_100015839415_100000081511 [0,2,0,0,0,0|1,0,0]=3 635 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)F)Cl 2230a_100000700460_100000081511 [0,2,0,0,0,0|1,1,0]=4 636 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)F)Cl 7a_100000700460_100000081511 [0,2,0,0,0,0|1,1,0]=4 637 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)F)F 2230a_200009857453_100000081511 [0,2,0,0,0,0|1,1,0]=4 638 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)F)F 7a_200009857453_100000081511 [0,2,0,0,0,0|1,1,0]=4 639 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)I)F 7a_100014833993_100000081511 [0,2,0,0,0,0|1,1,0]=4 640 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)Cl)O)Cl 7a_100000695418_100000081511 [0,2,0,0,0,0|2,0,0]=4 641 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)F)Cl)F 2230a_100000094121_100000081511 [0,2,0,0,0,0|1,1,0]=4 642 B21R2.7727630 COc1coc(cc1=O)CNc2cc(c(c(c2)F)Cl)F 7a_100000094121_100000081511 [0,2,0,0,0,0|1,1,0]=4 643 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)Br)Cl)Cl 7a_100016179818_100000081511 [0,2,0,0,0,0|0,1,0]=3 644 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)Br)F)Cl 7a_200011105948_100000081511 [0,2,0,0,0,0|0,2,0]=4 645 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)C)Cl)C 7a_100000739557_100000081511 [0,2,0,0,0,0|1,1,0]=4 646 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)Cl)Br)Cl 7a_100009888979_100000081511 [0,2,0,0,0,0|0,2,0]=4 647 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)Cl)Cl)Cl 7a_100000074982_100000081511 [0,2,0,0,0,0|0,1,0]=3 648 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)Cl)F)Cl 7a_100012242831_100000081511 [0,2,0,0,0,0|0,2,0]=4 649 B21R2.7727630 COc1coc(cc1=O)COc2cc(c(c(c2)F)Cl)F 7a_100000117300_100000081511 [0,2,0,0,0,0|0,2,0]=4 650 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)Br)C)Br 62a_100011099977_100000081511 [0,2,0,0,0,0|1,1,0]=4 651 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)Br)O)C 62a_100010982682_100000081511 [0,2,0,0,0,0|1,1,0]=4 652 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)C)Br)C 62a_100012353698_100000081511 [0,2,0,0,0,0|1,1,0]=4 653 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)C)C)C 62a_200011015895_100000081511 [0,2,0,0,0,0|2,0,0]=4 654 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)C)F)C 62a_100009814169_100000081511 [0,2,0,0,0,0|1,1,0]=4 655 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)C)N)C 62a_100000737279_100000081511 [0,2,0,0,0,0|2,0,0]=4 656 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)C)O)C 62a_100011216129_100000081511 [0,2,0,0,0,0|2,0,0]=4 657 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)Cl)F)Cl 62a_100012357505_100000081511 [0,2,0,0,0,0|0,1,0]=3 658 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)Cl)O)C 62a_200015900153_100000081511 [0,2,0,0,0,0|1,0,0]=3 659 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)Cl)O)Cl 62a_100012339652_100000081511 [0,2,0,0,0,0|1,0,0]=3 660 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)Br)F 62a_100010176052_100000081511 [0,2,0,0,0,0|0,2,0]=4 661 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)C)F 62a_100009814309_100000081511 [0,2,0,0,0,0|1,1,0]=4 662 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)C)N 62a_100009813729_100000081511 [0,2,0,0,0,0|1,1,0]=4 663 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)Cl)F 62a_100010154629_100000081511 [0,2,0,0,0,0|0,1,0]=3 664 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)F)C 62a_200011068660_100000081511 [0,2,0,0,0,0|0,2,0]=4 665 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)F)F 62a_100011215606_100000081511 [0,2,0,0,0,0|0,2,0]=4 666 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)F)O 62a_100000709865_100000081511 [0,2,0,0,0,0|0,2,0]=4 667 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)N)C 62a_100000709789_100000081511 [0,2,0,0,0,0|1,1,0]=4 668 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)N)F 62a_100000758902_100000081511 [0,2,0,0,0,0|1,1,0]=4 669 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)N)N 62a_100011218333_100000081511 [0,2,0,0,0,0|1,1,0]=4 670 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)N)O 62a_100015475841_100000081511 [0,2,0,0,0,0|1,1,0]=4 671 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)O)F 62a_100011216917_100000081511 [0,2,0,0,0,0|1,1,0]=4 672 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)F)O)N 62a_100011217383_100000081511 [0,2,0,0,0,0|1,1,0]=4 673 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)N)F)C 62a_100010381932_100000081511 [0,2,0,0,0,0|1,1,0]=4 674 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)N)N)C 62a_100000688557_100000081511 [0,2,0,0,0,0|2,0,0]=4 675 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)N)O)C 62a_100011825904_100000081511 [0,2,0,0,0,0|2,0,0]=4 676 B21R2.7727630 COc1coc(cc1=O)CSc2cc(c(c(c2)O)N)C 62a_100010371313_100000081511 [0,2,0,0,0,0|2,0,0]=4 677 B21R2.358487 CC(=O)c1ccc(cc1C)SCc2cc(=O)c(co2)O 62a_100012360112_100000010605 [0,2,0,0,0,0|2,0,0]=4 678 B21R2.358487 CC(=O)c1ccc(cc1Cl)OCc2cc(=O)c(co2)O 7a_100011933989_100000010605 [0,2,0,0,0,0|1,1,0]=4 679 B21R2.358487 CC(=O)c1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100000690205_100000010605 [0,2,0,0,0,0|1,1,0]=4 680 B21R2.358487 CC(=O)c1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100011590516_100000010605 [0,2,0,0,0,0|2,0,0]=4 681 B21R2.358487 CC(N)c1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100000730447_100000010605 [0,2,0,0,0,0|1,1,0]=4 682 B21R2.358487 CN(C)c1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100000737018_100000010605 [0,2,0,0,0,0|2,0,0]=4 683 B21R2.358487 Cc1cc(ccc1B(O)O)SCc2cc(=O)c(co2)O 62a_100010074995_100000010605 [0,2,0,0,0,0|2,0,0]=4 684 B21R2.358487 Cc1cc(ccc1C(=O)N)SCc2cc(=O)c(co2)O 62a_100011327924_100000010605 [0,2,0,0,0,0|2,0,0]=4 685 B21R2.358487 NC(=O)c1ccc(cc1Br)SCc2cc(=O)c(co2)O 62a_200010146565_100000010605 [0,2,0,0,0,0|1,1,0]=4 686 B21R2.358487 NC(=O)c1ccc(cc1Cl)NCc2cc(=O)c(co2)O 7a_100000737725_100000010605 [0,2,0,0,0,0|2,0,0]=4 687 B21R2.358487 NC(=O)c1ccc(cc1Cl)OCc2cc(=O)c(co2)O 7a_100011997949_100000010605 [0,2,0,0,0,0|1,1,0]=4 688 B21R2.358487 NC(=O)c1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100000216903_100000010605 [0,2,0,0,0,0|1,1,0]=4 689 B21R2.358487 NC(=O)c1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100012349972_100000010605 [0,2,0,0,0,0|2,0,0]=4 690 B21R2.358487 NC(=O)c1ccc(cc1O)SCc2cc(=O)c(co2)O 62a_100011550861_100000010605 [0,2,0,0,0,0|2,0,0]=4 691 B21R2.358487 O=c1cc(occ1O)COc2ccc(c(c2)Cl)[N+](=O)[O-] 7a_100000746235_100000010605 [0,2,0,0,0,0|1,1,0]=4 692 B21R2.358487 O=c1cc(occ1O)CSc2ccc(c(c2)F)B(O)O 62a_100009813958_100000010605 [0,2,0,0,0,0|1,1,0]=4 693 B21R2.358487 O=c1cc(occ1O)CSc2ccc(c(c2)F)C(F)F 62a_100010169825_100000010605 [0,2,0,0,0,0|0,2,0]=4 694 B21R2.2711827 C#Cc1ccc(cc1Cl)NCc2cc(=O)c(co2)OC 2230a_100012001888_100000081511 [0,2,0,0,0,0|2,0,0]=4 695 B21R2.2711827 C=Cc1ccc(cc1F)SCc2cc(=O)c(co2)OC 62a_100011935271_100000081511 [0,2,0,0,0,0|1,1,0]=4 696 B21R2.2711827 CCc1ccc(cc1Cl)NCc2cc(=O)c(co2)OC 2230a_100000766362_100000081511 [0,2,0,0,0,0|2,0,0]=4 697 B21R2.2711827 CCc1ccc(cc1Cl)NCc2cc(=O)c(co2)OC 7a_100000766362_100000081511 [0,2,0,0,0,0|2,0,0]=4 698 B21R2.2711827 CCc1ccc(cc1Cl)OCc2cc(=O)c(co2)OC 7a_100009886192_100000081511 [0,2,0,0,0,0|1,1,0]=4 699 B21R2.2711827 CCc1ccc(cc1F)SCc2cc(=O)c(co2)OC 62a_200010071577_100000081511 [0,2,0,0,0,0|1,1,0]=4 700 B21R2.2711827 CCc1ccc(cc1N)SCc2cc(=O)c(co2)OC 62a_100012354963_100000081511 [0,2,0,0,0,0|2,0,0]=4 701 B21R2.2711827 CNc1ccc(cc1C)SCc2cc(=O)c(co2)OC 62a_100000221803_100000081511 [0,2,0,0,0,0|2,0,0]=4 702 B21R2.2711827 CNc1ccc(cc1F)SCc2cc(=O)c(co2)OC 62a_100000743884_100000081511 [0,2,0,0,0,0|1,1,0]=4 703 B21R2.2711827 CNc1ccc(cc1N)SCc2cc(=O)c(co2)OC 62a_100000741790_100000081511 [0,2,0,0,0,0|2,0,0]=4 704 B21R2.2711827 COc1ccc(cc1Br)SCc2cc(=O)c(co2)OC 62a_100011249507_100000081511 [0,2,0,0,0,0|1,1,0]=4 705 B21R2.2711827 COc1ccc(cc1C)SCc2cc(=O)c(co2)OC 62a_100011219705_100000081511 [0,2,0,0,0,0|2,0,0]=4 706 B21R2.2711827 COc1ccc(cc1Cl)NCc2cc(=O)c(co2)OC 2230a_100000211044_100000081511 [0,2,0,0,0,0|2,0,0]=4 707 B21R2.2711827 COc1ccc(cc1Cl)OCc2cc(=O)c(co2)OC 7a_200009861682_100000081511 [0,2,0,0,0,0|1,1,0]=4 708 B21R2.2711827 COc1ccc(cc1Cl)SCc2cc(=O)c(co2)OC 62a_100012355395_100000081511 [0,2,0,0,0,0|1,0,0]=3 709 B21R2.2711827 COc1ccc(cc1F)SCc2cc(=O)c(co2)OC 62a_100000171752_100000081511 [0,2,0,0,0,0|1,1,0]=4 710 B21R2.2711827 COc1ccc(cc1N)SCc2cc(=O)c(co2)OC 62a_100011249504_100000081511 [0,2,0,0,0,0|2,0,0]=4 711 B21R2.2711827 COc1coc(cc1=O)CNc2ccc(c(c2)Cl)C#N 7a_100000211542_100000081511 [0,2,0,0,0,0|2,0,0]=4 712 B21R2.2711827 COc1coc(cc1=O)COc2ccc(c(c2)Cl)C#N 7a_100000716493_100000081511 [0,2,0,0,0,0|1,1,0]=4 713 B21R2.2711827 COc1coc(cc1=O)COc2ccc(c(c2)Cl)CO 7a_200000075811_100000081511 [0,2,0,0,0,0|1,1,0]=4 714 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)Br)C#N 62a_100012349582_100000081511 [0,2,0,0,0,0|1,1,0]=4 715 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)Br)C=O 62a_100010185650_100000081511 [0,2,0,0,0,0|1,1,0]=4 716 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)Br)CO 62a_100010240206_100000081511 [0,2,0,0,0,0|1,1,0]=4 717 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)C)C=O 62a_100000766358_100000081511 [0,2,0,0,0,0|2,0,0]=4 718 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)C)CF 62a_200010711859_100000081511 [0,2,0,0,0,0|1,1,0]=4 719 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)C)CN 62a_100000753881_100000081511 [0,2,0,0,0,0|2,0,0]=4 720 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)C)CO 62a_100000748258_100000081511 [0,2,0,0,0,0|2,0,0]=4 721 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)C)NN 62a_100000751375_100000081511 [0,2,0,0,0,0|2,0,0]=4 722 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)Cl)C=O 62a_100000727542_100000081511 [0,2,0,0,0,0|1,0,0]=3 723 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)Cl)SC 62a_206447510565_100000081511 [0,2,0,0,0,0|1,0,0]=3 724 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)F)C=O 62a_100000211676_100000081511 [0,2,0,0,0,0|1,1,0]=4 725 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)F)CN 62a_100000754580_100000081511 [0,2,0,0,0,0|1,1,0]=4 726 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)F)CO 62a_100011191541_100000081511 [0,2,0,0,0,0|1,1,0]=4 727 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)F)NN 62a_100000751572_100000081511 [0,2,0,0,0,0|1,1,0]=4 728 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)F)SC 62a_100010161220_100000081511 [0,2,0,0,0,0|1,1,0]=4 729 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)N)C=O 62a_100009814810_100000081511 [0,2,0,0,0,0|2,0,0]=4 730 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)N)CO 62a_100000718831_100000081511 [0,2,0,0,0,0|2,0,0]=4 731 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)O)C=O 62a_100011277552_100000081511 [0,2,0,0,0,0|2,0,0]=4 732 B21R2.2711827 COc1coc(cc1=O)CSc2ccc(c(c2)O)CO 62a_100000071718_100000081511 [0,2,0,0,0,0|2,0,0]=4 733 B21R2.4982052 CCOc1ccc(cc1C)SCc2cc(=O)c(co2)O 62a_100011308936_100000010605 [0,2,0,0,0,0|2,0,0]=4 734 B21R2.4982052 CCOc1ccc(cc1Cl)NCc2cc(=O)c(co2)O 2230a_100000741444_100000010605 [0,2,0,0,0,0|2,0,0]=4 735 B21R2.4982052 CCOc1ccc(cc1Cl)NCc2cc(=O)c(co2)O 7a_100000741444_100000010605 [0,2,0,0,0,0|2,0,0]=4 736 B21R2.4982052 CCOc1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_200000171753_100000010605 [0,2,0,0,0,0|1,1,0]=4 737 B21R2.4982052 CCOc1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100000751366_100000010605 [0,2,0,0,0,0|2,0,0]=4 738 B21R2.4982052 COCc1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100013084866_100000010605 [0,2,0,0,0,0|2,0,0]=4 739 B21R2.4982052 Cc1cc(ccc1CC#N)SCc2cc(=O)c(co2)O 62a_100000697864_100000010605 [0,2,0,0,0,0|2,0,0]=4 740 B21R2.4982052 N#CCc1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100011295474_100000010605 [0,2,0,0,0,0|1,1,0]=4 741 B21R2.4982052 N#CSc1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100025703542_100000010605 [0,2,0,0,0,0|1,1,0]=4 742 B21R2.4982052 O=c1cc(occ1O)CSc2ccc(c(c2)F)CCO 62a_100011962869_100000010605 [0,2,0,0,0,0|1,1,0]=4 743 B21R2.361527 O=c1cc(occ1O)CNCCc2ccc(c(c2)Cl)Cl 2230a_100011207230_100000010605 [0,0,0,0,0,2|1,0,0]=3 744 B21R2.361527 O=c1cc(occ1O)CNCCc2ccc(c(c2)Cl)F 2230a_200011997520_100000010605 [0,0,0,0,0,2|1,1,0]=4 745 B21R2.361527 O=c1cc(occ1O)COCCc2ccc(c(c2)Cl)Cl 7a_100011709245_100000010605 [0,0,0,0,0,2|0,1,0]=3 746 B21R2.361527 O=c1cc(occ1O)COCCc2ccc(c(c2)Cl)F 7a_100011830478_100000010605 [0,0,0,0,0,2|0,2,0]=4 747 B21R2.361527 O=c1cc(occ1O)COCCc2ccc(c(c2)F)Cl 7a_100011934464_100000010605 [0,0,0,0,0,2|0,2,0]=4 748 B21R2.361527 O=c1cc(occ1O)CSCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100000010605 [0,0,0,0,0,2|0,0,0]=2 749 B21R2.361527 O=c1cc(occ1O)CSCCc2ccc(c(c2)Cl)F 62a_100012361305_100000010605 [0,0,0,0,0,2|0,1,0]=3 750 B21R2.361527 O=c1cc(occ1O)CSCCc2ccc(c(c2)F)F 62a_100000690553_100000010605 [0,0,0,0,0,2|0,2,0]=4 751 B21R2.361527 Oc1ccc(cc1O)CCSCc2ccc(c(c2)Cl)Cl 62a_100000184707_200010393615 [0,0,0,0,0,2|1,0,1]=4