0 B21R2.256138 CC(C)(C)C1=CC(=CC=C1)NC2=CC=CC=C2C(=O)O MCULE-6536956204 [0,0,0,0,0,0|4,0,0]=4 1 B21R2.256138 NC(=O)C1=C(C=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-4374720030 [0,0,0,0,0,0|2,0,0]=2 2 B21R2.256138 NC(=O)C1=C(N=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-8293316849 [0,0,0,0,0,0|1,0,0]=1 3 B21R2.256138 NC(=O)C1=C(N=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-9288347421 [0,0,0,0,0,0|1,0,0]=1 4 B21R2.256138 NC(=O)C1=NC=CN=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-7019458047 [0,0,0,0,0,0|3,0,0]=3 5 B21R2.256138 O=C(O)C1=C(C=CC=C1)OC2=CC(=CC=C2)C(F)(F)F MCULE-2575415432 [0,0,0,0,0,0|2,0,0]=2 6 B21R2.256138 O=C(O)C1=C(C=CC=C1)SC2=CC(=CC=C2)C(F)(F)F MCULE-5761370793 [0,0,0,0,0,0|2,0,0]=2 7 B21R2.256138 O=C(O)C1=C(N=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-1493395831 [0,0,0,0,0,0|0,0,0]=0 8 B21R2.256138 O=C(O)C1=C(N=CC=C1)SC2=CC(=CC=C2)C(F)(F)F MCULE-3197144905 [0,0,0,0,0,0|1,0,0]=1 9 B21R2.256138 O=C(O)C1=C(N=CC=N1)OC2=CC=CC(=C2)C(F)(F)F MCULE-4800212319 [0,0,0,0,0,0|2,0,0]=2 10 B21R2.256138 O=C(O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F MCULE-8606118307 [0,0,0,0,0,0|1,0,0]=1 11 B21R2.256138 O=C(O)C1=CC=CC=C1NC2=CC=NC(=C2)C(F)(F)F MCULE-8350075392 [0,0,0,0,0,0|2,0,0]=2 12 B21R2.256138 O=C(O)C1=CC=CN=C1NC2=CC=CC(=C2)C(F)(F)F MCULE-3027710274 [0,0,0,0,0,0|0,0,0]=0 13 B21R2.256138 O=C(O)C1=CC=CN=C1OC2=CC(=CC=C2)C(F)(F)F MCULE-6396951413 [0,0,0,0,0,0|1,0,0]=1 14 B21R2.256138 O=N(=O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-5506979338 [0,0,0,0,0,0|1,0,1]=2 15 B21R2.256138 O=N(=O)C1=C(N=CC=C1)OC2=CC=CC(=C2)C(F)(F)F MCULE-2567662087 [0,0,0,0,0,0|2,0,1]=3 16 B20R2.10688 O=C(O)C1=CC=CN=C1NC2=CC(=CC=C2)N(=O)=O MCULE-8448901064 [1,0,0,0,0,0|3,0,0]=4 17 B20R2.18947 N#CC1=C(N=CC=C1)OC2=CC=CC(=C2)C(F)(F)F MCULE-7789551817 [1,0,0,0,0,0|2,0,1]=4 18 B20R2.18947 NCC1=C(N=CC=C1)OC2=CC(=CC=C2)C(F)(F)F MCULE-8787456799 [1,0,0,0,0,0|2,0,1]=4 19 B20R2.18947 NCC1=CC=CN=C1OC2=CC(=CC=C2)C(F)(F)F MCULE-1354321512 [1,0,0,0,0,0|2,0,1]=4 20 B20R2.18947 O=CC1=CC=CC=C1OC2=CC(=CC=C2)C(F)(F)F MCULE-5780448698 [1,0,0,0,0,0|2,0,0]=3 21 B20R2.18947 OCC1=CC=CC=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-1961116663 [1,0,0,0,0,0|2,0,1]=4 22 B22R2.49754 NS(=O)(=O)C1=C(N=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-5454125619 [0,1,0,0,0,0|1,0,1]=3 23 B22R2.49754 O=S(=O)(O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-5080755607 [0,1,0,0,0,0|1,0,0]=2 24 B22R2.49754 O=S(=O)(O)C1=CN=CC=C1NC2=CC(=CC=C2)C(F)(F)F MCULE-3556164731 [0,1,0,0,0,0|3,0,0]=4 25 B22R2.518674 NC(=O)C1=C(N=CC=C1)NC2=CC=C(C(=C2)C(F)(F)F)Cl MCULE-7032258447 [0,1,0,0,0,0|1,0,0]=2 26 B22R2.552085 CNC(=O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-6255926568 [0,1,0,0,0,0|1,0,0]=2 27 B22R2.552085 COC(=O)C1=C(C=CC=C1)NC2=CC=NC(=C2)C(F)(F)F MCULE-4303681651 [0,1,0,0,0,0|2,0,0]=3 28 B22R2.552085 COC(=O)C1=C(N=CC=C1)OC2=CC(=CC=C2)C(F)(F)F MCULE-4776611062 [0,1,0,0,0,0|1,0,0]=2 29 B22R2.552085 COC(=O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F MCULE-8176435728 [0,1,0,0,0,0|1,0,0]=2 30 B22R2.552085 N/C(=N\O)/C1=NC=CN=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-6887413703 [0,1,0,0,0,0|3,0,0]=4 31 B22R2.552085 O=C(CCl)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F MCULE-6379048082 [0,1,0,0,0,0|2,0,0]=3 32 B22R2.4448112 CC1=C(C=CC=C1NC2=C(C=CC=N2)C(=O)O)C(F)(F)F MCULE-2942967314 [0,1,0,0,0,0|0,0,0]=1 33 B22R2.4555062 NC1=NC=NC(=C1N(=O)=O)NC2=CC=CC(=C2)C(F)(F)F MCULE-3713673217 [0,1,0,0,0,0|2,0,1]=4 34 B22R2.6170819 NC(=O)C1=CN=C(N=C1NC2=CC=CC(=C2)C(F)(F)F)Cl MCULE-6841714321 [0,1,0,0,0,0|2,0,0]=3 35 B22R2.6170819 NC1=NC(=C(C=N1)N(=O)=O)NC2=CC(=CC=C2)C(F)(F)F MCULE-8428681580 [0,1,0,0,0,0|2,0,1]=4 36 B22R2.6170819 O=C(O)C1=CN=C(N=C1NC2=CC=CC(=C2)C(F)(F)F)Cl MCULE-8050043560 [0,1,0,0,0,0|1,0,0]=2 37 B22R2.6173763 O=C(O)C1=CC(=CC=C1OC2=CC(=CC=C2)C(F)(F)F)Br MCULE-5464863291 [0,1,0,0,0,0|2,0,0]=3 38 B22R2.6173763 O=C(O)C1=CC(=CN=C1NC2=CC=CC(=C2)C(F)(F)F)O MCULE-6645601955 [0,1,0,0,0,0|0,0,0]=1 39 B22R2.6173763 O=C(O)C1=CC(=CN=C1OC2=CC=CC(=C2)C(F)(F)F)Cl MCULE-8761002357 [0,1,0,0,0,0|1,0,0]=2 40 B22R2.6173763 O=N(=O)C1=CC(=CN=C1OC2=CC=CC(=C2)C(F)(F)F)Br MCULE-4568693941 [0,1,0,0,0,0|2,0,1]=4 41 B22R3.46255460 O=S1(=O)C2=CC=C(C=C2NC3=C1C=CC=C3)C(F)(F)F MCULE-2137157951 [0,0,0,1,0,0|2,0,1]=4 42 B20R2.170973 O=C(O)C1=C(C=CC=N1)C2=CC(=CC=C2)C(F)(F)F MCULE-8447710281 [0,0,0,0,1,0|2,0,0]=3 43 B20R2.170973 O=C(O)C1=C(C=NC=C1)C2=CC=CC(=C2)C(F)(F)F MCULE-7691150994 [0,0,0,0,1,0|2,0,0]=3 44 B20R2.170973 O=C(O)C1=C(N=CC=C1)C2=CC(=CC=C2)C(F)(F)F MCULE-7526604113 [0,0,0,0,1,0|0,0,0]=1 45 B20R2.170973 O=C(O)C1=CC=CC=C1C2=CC=CC(=C2)C(F)(F)F MCULE-2390190299 [0,0,0,0,1,0|1,0,0]=2 46 B20R2.173573 O=C(O)C1=CN=CN1CC2=CC(=CC=C2)C(F)(F)F MCULE-3567715693 [0,0,0,0,1,0|3,0,0]=4 47 B20R2.173573 O=C(O)C1=NC=CN1CC2=CC=CC(=C2)C(F)(F)F MCULE-2358788624 [0,0,0,0,1,0|3,0,0]=4 48 B22R2.358103 O=C(Cl)C1=CC=CC=C1OCC2=CC=CC(=C2)C(F)(F)F MCULE-9505982948 [0,0,0,0,0,1|3,0,0]=4 49 B22R2.358103 O=C(O)C1=CC=CC=C1OCC2=CC=CC(=C2)C(F)(F)F MCULE-6961663147 [0,0,0,0,0,1|2,0,0]=3 50 B22R2.358103 O=C(O)C1=CC=CC=C1SCC2=CC=CC(=C2)C(F)(F)F MCULE-2326105394 [0,0,0,0,0,1|2,0,0]=3 51 B22R2.358103 O=C(O)C1=CC=CN=C1SCC2=CC=CC(=C2)C(F)(F)F MCULE-2399782621 [0,0,0,0,0,1|1,0,0]=2 52 B22R2.358103 O=N(=O)C1=C(N=CC=C1)NCC2=CC(=CC=C2)C(F)(F)F MCULE-5882185486 [0,0,0,0,0,1|1,0,1]=3 53 B22R2.585341 O=C(O)CC1=CC=CC=C1SC2=CC(=CC=C2)C(F)(F)F MCULE-9342791730 [0,0,0,0,0,1|2,0,0]=3 54 B19R2.3260 COC1=CC(=CC=C1)NC2=NC=CC=C2C(=O)O MCULE-3698946038 [2,0,0,0,0,0|2,0,0]=4 55 B19R2.7520 FC(F)(F)C1=CC(=CC=C1)OC2=NC=CC=C2Cl MCULE-9399011015 [2,0,0,0,0,0|2,0,0]=4 56 B19R2.7520 FC(F)(F)C1=CC=CC(=C1)NC2=NC=CC=C2Br MCULE-7552194079 [2,0,0,0,0,0|1,0,0]=3 57 B19R2.7520 NC1=C(C=CC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-6761044357 [2,0,0,0,0,0|2,0,0]=4 58 B19R2.7520 OC1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-6660966237 [2,0,0,0,0,0|0,0,0]=2 59 B19R2.7520 OC1=C(N=CC=C1)SC2=CC(=CC=C2)C(F)(F)F MCULE-7603308713 [2,0,0,0,0,0|1,0,0]=3 60 B21R2.38382 ON=CC1=CC=CC=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-8096965094 [1,1,0,0,0,0|2,0,0]=4 61 B21R2.109294 NC1=CC=C(C(=C1)C2=CC=CC(=C2)C(F)(F)F)C(=O)O MCULE-6850318265 [0,1,0,0,1,0|1,0,0]=3 62 B21R2.226744 CC1=CC(=C(C=C1)C2=CC=CC(=C2)C(F)(F)F)C(=O)O MCULE-3890569486 [0,1,0,0,1,0|1,0,0]=3 63 B21R2.226744 NC1=NC=C(C(=C1)C(=O)O)C2=CC(=CC=C2)C(F)(F)F MCULE-4600884536 [0,1,0,0,1,0|2,0,0]=4 64 B21R2.226744 O=C(O)C1=C(C=CC(=C1)F)C2=CC(=CC=C2)C(F)(F)F MCULE-5540145640 [0,1,0,0,1,0|1,0,0]=3 65 B21R2.226744 O=C(O)C1=CC(=CN=C1C2=CC=CC(=C2)C(F)(F)F)F MCULE-8105610391 [0,1,0,0,1,0|0,0,0]=2 66 B21R2.379763 COC(=O)C1=C(C=CS1)NC2=CC=NC(=C2)C(F)(F)F MCULE-5035242956 [0,1,0,0,1,0|2,0,0]=4 67 B23R2.8322191 O=C(O)C1=CC(=CC=C1OC2=CC(=CC=C2)OC(F)(F)F)Br MCULE-4184981385 [0,1,0,0,0,1|2,0,0]=4 68 B23R2.475123 NC(=O)C1=C(C=CC=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F MCULE-1620644374 [0,1,0,0,0,1|2,0,0]=4 69 B23R2.475327 O=C(O)C1=C(C=CC=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F MCULE-6988212277 [0,1,0,0,0,1|1,0,0]=3 70 B23R2.475327 O=C(O)C1=CN=CC=C1C(=O)NC2=CC(=CC=C2)C(F)(F)F MCULE-4796668980 [0,1,0,0,0,1|2,0,0]=4 71 B23R2.475327 O=C(O)C1=NC=CN=C1C(=O)NC2=CC=CC(=C2)C(F)(F)F MCULE-1531114517 [0,1,0,0,0,1|1,0,0]=3 72 B23R2.764534 COC(=O)C1=CC=CC=C1N(C)C2=CC(=NC=C2)C(F)(F)F MCULE-1768187250 [0,2,0,0,0,0|2,0,0]=4 73 B23R2.12205734 COC(=O)C1=CC=CC=C1OC2=CC=C(C(=C2)C(F)(F)F)Cl MCULE-9497045015 [0,2,0,0,0,0|2,0,0]=4 74 B23R2.641532 CCNC(=O)C1=C(N=CC=C1)NC2=CC(=CC=C2)C(F)(F)F MCULE-1287834676 [0,2,0,0,0,0|1,0,0]=3 75 B23R2.739349 COC(=O)C1=CC(=CC=C1OC2=CC=CC(=C2)C(F)(F)F)N MCULE-4254578767 [0,2,0,0,0,0|2,0,0]=4 76 B23R2.8322215 CC1=C(C=CC=C1C(F)(F)F)NC2=NC=C(C=C2C(=O)O)Br MCULE-3167287375 [0,2,0,0,0,0|0,0,0]=2 77 B23R2.8322215 CC1=C(C=CC=C1NC2=C(C=C(C=N2)O)C(=O)O)C(F)(F)F MCULE-8314688399 [0,2,0,0,0,0|0,0,0]=2 78 B23R2.1134321 COC1=C(C(=NC=C1)OC2=CC=CC(=C2)C(F)(F)F)C(=O)N MCULE-8699858021 [0,2,0,0,0,0|2,0,0]=4 79 B23R2.3022393 CC(=O)C1=C(OC(=CC1=O)C)NC2=CC(=CC=C2)C(F)(F)F MCULE-5673154098 [0,2,0,0,0,0|2,0,0]=4 80 B23R2.1387997 COC1=CC(=C(C=C1)NC2=CC=CC(=C2)C(F)(F)F)C(=O)N MCULE-3049390443 [0,2,0,0,0,0|2,0,0]=4 81 B21R2.358533 CC(=O)C1=CN(C(=O)C=C1)C2=CC=CC(=C2)C(F)(F)F MCULE-2782527924 [0,0,1,1,0,0|2,0,0]=4 82 B21R2.358533 CC1=CC=C(C=C1C2=CC=CC(=C2)C(F)(F)F)C(=O)O MCULE-5293683914 [0,0,1,1,0,0|2,0,0]=4 83 B21R2.358533 O=C(O)C1=CC(=C(C=C1)F)C2=CC=CC(=C2)C(F)(F)F MCULE-3162876288 [0,0,1,1,0,0|2,0,0]=4 84 B21R2.358533 O=C(O)C1=CC(=C(C=C1)I)C2=CC=CC(=C2)C(F)(F)F MCULE-6232965481 [0,0,1,1,0,0|2,0,0]=4 85 B21R2.358533 O=C(O)C1=CN(C(=O)C=C1)C2=CC(=CC=C2)C(F)(F)F MCULE-3147668905 [0,0,1,1,0,0|1,0,0]=3 86 B21R2.107500 O=C(NC1=CC(=CC=C1)C(F)(F)F)C2=C(C=CC=C2)O MCULE-6904950250 [0,0,1,1,0,0|2,0,0]=4 87 B21R2.3561000 O=C(O)C1=CC=CC(=C1F)C2=CC=CC(=C2)C(F)(F)F MCULE-4572270116 [0,0,1,1,0,0|2,0,0]=4 88 B21R3.4971853 O=S1C2=C(C=CC=C2)NC3=C1C=CC(=C3)C(F)(F)F MCULE-3064211143 [1,0,0,1,0,0|2,0,0]=4 89 B23R3.94741352 O=C1OC(=CC2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C13 MCULE-4765706237 [0,0,0,1,0,1|2,0,0]=4 90 B23R3.94741352 O=C1OC(C2=C1C=CC=C2)NC3=CC=CC(=C3)C(F)(F)F MCULE-9980702904 [0,0,0,1,0,1|1,0,0]=3 91 B23R3.740213 O=C1N=CN(C2=C1C=CC=N2)C3=CC=CC(=C3)C(F)(F)F MCULE-7170676545 [0,1,0,1,0,0|1,0,0]=3 92 B19R2.17124 O=CC1=C(C=CC=C1)C2=CC(=CC=C2)C(F)(F)F MCULE-4632629174 [1,0,0,0,1,0|1,0,0]=3 93 B19R2.17124 O=CC1=CC=CN=C1C2=CC(=CC=C2)C(F)(F)F MCULE-6391952998 [1,0,0,0,1,0|0,0,0]=2 94 B19R2.17124 OCC1=CC=CN=C1C2=CC=CC(=C2)C(F)(F)F MCULE-5760469269 [1,0,0,0,1,0|0,0,1]=3 95 B19R2.111140 O=C(O)C1=C(NN=C1)C2=CC=CC(=C2)C(F)(F)F MCULE-1414140890 [0,0,0,0,2,0|1,0,1]=4 96 B19R2.111140 O=C(O)C1=C(OC=N1)C2=CC(=CC=C2)C(F)(F)F MCULE-3122339917 [0,0,0,0,2,0|2,0,0]=4 97 B19R2.111140 O=C(O)C1=CC=CN1C2=CC(=CC=C2)C(F)(F)F MCULE-5944713686 [0,0,0,0,2,0|1,0,0]=3 98 B19R2.111140 O=C(O)C1=CN=CN1C2=CC=CC(=C2)C(F)(F)F MCULE-1078367605 [0,0,0,0,2,0|2,0,0]=4 99 B21R2.414039 O=CC1=CC=CC=C1OCC2=CC=CC(=C2)C(F)(F)F MCULE-6058598371 [1,0,0,0,0,1|2,0,0]=4 100 B21R2.252187 NC(=O)C1=C(C=CC=C1)C2=CC=CC(=C2)OC(F)(F)F MCULE-6875764604 [0,0,0,0,1,1|2,0,0]=4 101 B21R2.252187 O=C(O)C1=CC=CN=C1C2=CC=CC(=C2)OC(F)(F)F MCULE-6817101702 [0,0,0,0,1,1|0,0,0]=2 102 B21R2.252187 O=C(O)C1=CC=NC=C1C2=CC=CC(=C2)OC(F)(F)F MCULE-2948632679 [0,0,0,0,1,1|2,0,0]=4 103 B21R2.254892 NC(=O)C1=NC(=CC=C1)OC2=CC=CC(=C2)C(F)(F)F MCULE-3870643934 [0,0,0,0,1,1|2,0,0]=4 104 B21R2.254892 O=C(O)C1=CC(=CC=C1)NC2=NC(=CC=N2)C(F)(F)F MCULE-8399943808 [0,0,0,0,1,1|2,0,0]=4 105 B21R2.254892 O=C(O)C1=CC(=CC=C1)OC2=CC(=CC=C2)C(F)(F)F MCULE-2309502237 [0,0,0,0,1,1|1,0,0]=3 106 B21R2.254892 O=C(O)C1=CC(=CC=C1)OC2=NC=CC(=C2)C(F)(F)F MCULE-7427133737 [0,0,0,0,1,1|2,0,0]=4 107 B21R2.254892 O=C(O)C1=CC(=NC=C1)NC2=CC=CC(=C2)C(F)(F)F MCULE-4016074111 [0,0,0,0,1,1|0,0,0]=2 108 B21R2.254892 O=C(O)C1=CC(=NC=C1)OC2=CC=CC(=C2)C(F)(F)F MCULE-8843010251 [0,0,0,0,1,1|1,0,0]=3 109 B21R2.254892 O=C(O)C1=CC=CC(=C1)NC2=CC=NC(=N2)C(F)(F)F MCULE-3436680767 [0,0,0,0,1,1|2,0,0]=4 110 B21R2.254892 O=C(O)C1=CC=CC(=C1)OC2=CC=CC(=N2)C(F)(F)F MCULE-7416111822 [0,0,0,0,1,1|2,0,0]=4 111 B21R2.254892 O=C(O)C1=NC(=CC=C1)OC2=CC=CC(=C2)C(F)(F)F MCULE-9944908697 [0,0,0,0,1,1|1,0,0]=3 112 B21R2.256134 O=C(O)C1=C(C=CC=C1)SC2=NC=C(C=C2)C(F)(F)F MCULE-5059354569 [0,0,0,0,1,1|2,0,0]=4 113 B21R2.256134 O=C(O)C1=C(N=CC=C1)OC2=CC=C(C=C2)C(F)(F)F MCULE-2321221423 [0,0,0,0,1,1|1,0,0]=3 114 B21R2.256134 O=C(O)C1=CC=CC=C1OC2=CC=C(C=C2)C(F)(F)F MCULE-4348981141 [0,0,0,0,1,1|2,0,0]=4 115 B21R2.256134 O=C(O)C1=CC=CC=C1SC2=CC=C(C=C2)C(F)(F)F MCULE-9305786858 [0,0,0,0,1,1|2,0,0]=4 116 B23R2.475144 O=[N+]([O-])C1=CC=CN=C1NN=CC2=CC=CC(=C2)C(F)(F)F MCULE-2867601743 [0,0,0,0,0,2|1,0,1]=4 117 B23R2.469013 O=C(O)/C=C/C1=CC=CC=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-4967432400 [0,0,0,0,0,2|2,0,0]=4 118 B23R2.469013 O=C(O)C=CC1=CC=CC=C1OC2=CC=CC(=C2)C(F)(F)F MCULE-7420647786 [0,0,0,0,0,2|2,0,0]=4