0 B13R2.5190 CC1=CC2=CC(N)=CC=C2N1C SBB010426 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.5190 CN1C(=O)CC2=CC(Br)=CC=C21 SBB006876 [0,0,0,0,0,0|2,1,0]=3 2 B13R2.5190 CN1C(=O)OC2=CC(N)=CC=C21 SBB072948 [0,0,0,0,0,0|3,0,0]=3 3 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O SBB054674 [0,0,0,0,0,0|1,1,1]=3 4 B12R2.18 CN1C(=O)CC2=CC=CC=C21 SBB006878 [1,0,0,0,0,0|2,0,0]=3 5 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 SBB017054 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.18 CN1C(=O)SC2=C1C=CC=C2 SBB071442 [1,0,0,0,0,0|2,0,0]=3 7 B12R2.18 CN1C(=S)NC2=CC=CC=C21 SBB018392 [1,0,0,0,0,0|1,1,0]=3 8 B12R2.18 CN1C(=S)OC2=C1C=CC=C2 SBB012364 [1,0,0,0,0,0|2,1,0]=4 9 B12R2.18 CN1C(=S)SC2=CC=CC=C21 SBB007611 [1,0,0,0,0,0|2,1,0]=4 10 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 SBB004092 [1,0,0,0,0,0|2,0,1]=4 11 B12R2.18 CN1C2=CC=CC=C2N=C1Cl SBB079664 [1,0,0,0,0,0|2,0,1]=4 12 B12R2.18 CN1C2=CC=CC=C2N=C1S SBB039024 [1,0,0,0,0,0|1,1,1]=4 13 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SBB068426 [1,0,0,0,0,0|2,0,1]=4 14 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O SBB009100 [1,0,0,0,0,0|1,0,1]=3 15 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O SBB087795 [1,0,0,0,0,0|2,0,1]=4 16 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 SBB059280 [1,0,0,0,0,0|1,0,0]=2 17 B12R2.606 CC1=CC2=C(C=C1)NC(C)=N2 SBB045895 [1,0,0,0,0,0|2,0,1]=4 18 B12R2.606 CC1=CC2=C(C=CC(N)=C2)N1 SBB028277 [1,0,0,0,0,0|3,0,0]=4 19 B12R2.606 CC1=CC=C2NC(N)=NC2=C1 SBB051992 [1,0,0,0,0,0|2,0,1]=4 20 B12R2.606 CC1=CC=C2OC(=S)NC2=C1 SBB055993 [1,0,0,0,0,0|2,1,0]=4 21 B12R2.606 CC1=NC2=C(C=CC(F)=C2)O1 SBB059632 [1,0,0,0,0,0|2,0,1]=4 22 B12R2.606 CC1=NC2=C(C=CC(F)=C2)S1 SBB088093 [1,0,0,0,0,0|2,0,1]=4 23 B12R2.606 CC1=NC2=C(C=CC(N)=C2)N1 SBB000098 [1,0,0,0,0,0|2,0,1]=4 24 B12R2.606 ClC1=CC=C2NC(Cl)=NC2=C1 SBB054579 [1,0,0,0,0,0|1,1,1]=4 25 B12R2.606 FC1=CC2=C(C=C1)N=C(S)N2 SBB019016 [1,0,0,0,0,0|0,1,1]=3 26 B12R2.606 FC1=CC=C2N=C(Cl)NC2=C1 SBB054582 [1,0,0,0,0,0|1,0,1]=3 27 B12R2.606 N1C(=O)OC2=C1C=C(Cl)C=C2 SBB003864 [1,0,0,0,0,0|1,1,0]=3 28 B12R2.606 N1C(=S)OC2=C1C=CC(Cl)=C2 SBB003708 [1,0,0,0,0,0|1,2,0]=4 29 B12R2.606 N1C(C)=CC2=C1C=CC(Cl)=C2 SBB003903 [1,0,0,0,0,0|2,1,0]=4 30 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 SBB012801 [1,0,0,0,0,0|1,0,0]=2 31 B12R2.606 NC1=CC2=C(C=C1)NC(=O)O2 SBB010320 [1,0,0,0,0,0|2,0,0]=3 32 B12R2.606 NC1=CC2=C(C=C1)NC(S)=N2 SBB028358 [1,0,0,0,0,0|1,1,1]=4 33 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 SBB072177 [1,0,0,0,0,0|2,0,0]=3 34 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 SBB072398 [1,0,0,0,0,0|2,0,0]=3 35 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 SBB010120 [1,0,0,0,0,0|2,0,0]=3 36 B12R2.606 NC1=CC=C2NC(=O)SC2=C1 SBB302502 [1,0,0,0,0,0|2,0,0]=3 37 B12R2.606 NC1=CC=C2NC(=S)SC2=C1 SBB016522 [1,0,0,0,0,0|2,1,0]=4 38 B12R2.606 NC1=NC2=C(C=C(F)C=C2)S1 SBB000158 [1,0,0,0,0,0|2,0,1]=4 39 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SBB058442 [1,0,0,0,0,0|1,1,0]=3 40 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SBB005897 [1,0,0,0,0,0|1,1,0]=3 41 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 SBB003879 [1,0,0,0,0,0|1,1,0]=3 42 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 SBB018719 [1,0,0,0,0,0|1,0,0]=2 43 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 SBB038172 [1,0,0,0,0,0|3,0,0]=4 44 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 SBB094871 [1,0,0,0,0,0|1,1,0]=3 45 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 SBB003865 [1,0,0,0,0,0|1,1,0]=3 46 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 SBB003866 [1,0,0,0,0,0|1,1,0]=3 47 B12R2.606 O=C1NC2=C(N=CC(Br)=C2)N1 SBB094874 [1,0,0,0,0,0|1,1,0]=3 48 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 SBB094734 [1,0,0,0,0,0|0,1,0]=2 49 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 SBB056005 [1,0,0,0,0,0|0,1,0]=2 50 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 SBB056008 [1,0,0,0,0,0|0,0,0]=1 51 B12R2.606 O=C1OC2=CC=C(O)C=C2S1 SBB012368 [1,0,0,0,0,0|3,0,0]=4 52 B12R2.606 OC1=CC2=C(C=C1)SC(=O)O2 SBB071406 [1,0,0,0,0,0|3,0,0]=4 53 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)O1 SBB003707 [1,0,0,0,0,0|1,2,0]=4 54 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)S1 SBB003526 [1,0,0,0,0,0|1,2,0]=4 55 B12R2.606 S=C1NC2=CC(Br)=CN=C2N1 SBB040266 [1,0,0,0,0,0|1,2,0]=4 56 B12R2.606 SC1=NC2=C(C=CC(C)=C2)N1 SBB017015 [1,0,0,0,0,0|1,1,1]=4 57 B12R2.606 SC1=NC2=CC(Cl)=CC=C2N1 SBB003718 [1,0,0,0,0,0|0,2,1]=4 58 B12R2.606 [NH+]1=C(C)NC2=CC([NH3+])=CC=C21 SBB111712 [1,0,0,0,0,0|2,0,1]=4 59 B12R2.612 CN1C=CC2=C1C=CC(N)=C2 SBB010309 [1,0,0,0,0,0|3,0,0]=4 60 B12R2.612 CN1C=NC2=CC(N)=CC=C21 SBB047718 [1,0,0,0,0,0|2,0,1]=4 61 B14R2.645 CC1=C(Br)C=C2NC(=O)C(=O)C2=C1 SBB071631 [0,1,0,0,0,0|1,1,1]=4 62 B14R2.4217 CCN1C(=O)OC2=CC(N)=CC=C21 SBB014673 [0,1,0,0,0,0|3,0,0]=4 63 B14R2.4217 CCN1C(C)=NC2=C1C=CC(F)=C2 SBB089416 [0,1,0,0,0,0|2,0,1]=4 64 B14R2.8716 CC1=CC=C2C(=C1)C(=O)C(=O)N2C SBB038752 [0,1,0,0,0,0|3,0,0]=4 65 B14R2.8716 CC1=CC=C2C(=C1)N(C)C(=O)N2C SBB000194 [0,1,0,0,0,0|2,0,0]=3 66 B14R2.8716 CN1C(=O)C(=O)C2=CC(Br)=CC=C21 SBB006833 [0,1,0,0,0,0|2,1,0]=4 67 B14R2.8716 CN1C(=O)C(=O)C2=CC(Cl)=CC=C21 SBB038756 [0,1,0,0,0,0|2,1,0]=4 68 B14R2.8716 CN1C(=O)C(=O)C2=CC(F)=CC=C21 SBB013309 [0,1,0,0,0,0|2,0,0]=3 69 B14R2.8716 CN1C(=O)N(C)C2=C1C=CC(N)=C2 SBB010610 [0,1,0,0,0,0|2,0,0]=3 70 B14R2.8716 CN1C(=O)N(C)C2=CC(Cl)=CC=C21 SBB009891 [0,1,0,0,0,0|1,1,0]=3 71 B14R2.8737 CC1=C(C)C2=C(C=C1)C(=O)C(=O)N2 SBB072811 [0,1,0,0,0,0|2,0,1]=4 72 B14R2.8737 CC1=C(Cl)C=CC2=C1NC(=O)C2=O SBB066731 [0,1,0,0,0,0|1,1,1]=4 73 B14R2.27750 O=C1NC2=C(C1=O)C(Cl)=CC(Cl)=C2 SBB013560 [0,1,0,0,0,0|1,1,1]=4 74 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 SBB080453 [0,0,1,0,0,0|3,0,0]=4 75 B12R1.20 CC(=O)N(C)C1=CC=C(O)C=C1 SBB072886 [0,0,1,0,0,0|3,0,0]=4 76 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 SBB065020 [0,0,1,0,0,0|3,0,0]=4 77 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 SBB028364 [0,0,1,0,0,0|3,0,0]=4 78 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 SBB057734 [0,0,1,0,0,0|2,1,0]=4 79 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 SBB008325 [0,0,1,0,0,0|2,1,0]=4 80 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 SBB063787 [0,0,1,0,0,0|2,0,0]=3 81 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 SBB065018 [0,0,1,0,0,0|3,0,0]=4 82 B12R1.50 CC1=CC(NC(=O)CCl)=CC=C1 SBB004509 [0,0,1,0,0,0|3,0,0]=4 83 B12R1.50 CC1=CC=CC(NC(=O)CBr)=C1 SBB050419 [0,0,1,0,0,0|3,0,0]=4 84 B12R1.50 CCC(=O)NC1=CC(N)=CC=C1 SBB027266 [0,0,1,0,0,0|3,0,0]=4 85 B12R1.50 CCC(=O)NC1=CC(O)=CC=C1 SBB080003 [0,0,1,0,0,0|3,0,0]=4 86 B12R1.50 NNC(=O)CC1=CC(Cl)=CC=C1 SBB055220 [0,0,1,0,0,0|2,1,0]=4 87 B12R1.50 NNC(=S)NC1=CC(Cl)=CC=C1 SBB092836 [0,0,1,0,0,0|1,2,0]=4 88 B12R1.50 NNC(=S)NC1=CC(F)=CC=C1 SBB048278 [0,0,1,0,0,0|1,1,0]=3 89 B12R1.50 O=C(CBr)NC1=CC(Cl)=CC=C1 SBB050436 [0,0,1,0,0,0|2,1,0]=4 90 B12R1.50 O=C(CCl)NC1=CC(Cl)=CC=C1 SBB037894 [0,0,1,0,0,0|2,1,0]=4 91 B12R1.50 O=C(CCl)NC1=CC(I)=CC=C1 SBB303363 [0,0,1,0,0,0|2,1,0]=4 92 B12R1.50 O=C(CCl)NC1=CC=CC(Br)=C1 SBB016594 [0,0,1,0,0,0|2,1,0]=4 93 B12R1.50 O=C(CCl)NC1=CC=CC(F)=C1 SBB040612 [0,0,1,0,0,0|2,0,0]=3 94 B12R1.50 O=C(CCl)NC1=CC=CC(O)=C1 SBB072813 [0,0,1,0,0,0|3,0,0]=4 95 B14R2.8239 CC1OC2=CC=C(N)C=C2NC1=O SBB010625 [0,0,0,0,0,1|3,0,0]=4 96 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 SBB010604 [0,0,0,0,0,1|2,0,1]=4 97 B14R2.29365 CC1=CC(=O)NC2=C1C=CC(N)=C2 SBB059405 [0,0,0,0,0,1|3,0,0]=4 98 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [1,0,1,0,0,0|2,0,0]=4 99 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SBB054161 [1,0,1,0,0,0|1,1,0]=4 100 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [1,0,1,0,0,0|2,0,0]=4 101 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SBB058218 [1,0,1,0,0,0|1,1,0]=4 102 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SBB086906 [1,0,1,0,0,0|1,0,0]=3 103 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB028292 [1,0,1,0,0,0|2,0,0]=4 104 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB090514 [1,0,1,0,0,0|2,0,0]=4 105 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SBB043758 [1,0,1,0,0,0|2,0,0]=4 106 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [1,0,1,0,0,0|2,0,0]=4 107 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 SBB028290 [1,0,1,0,0,0|1,0,0]=3 108 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 SBB061970 [1,0,1,0,0,0|1,1,0]=4 109 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SBB028300 [1,0,1,0,0,0|2,0,0]=4 110 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 SBB062099 [1,0,1,0,0,0|0,0,0]=2 111 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 SBB041175 [1,0,1,0,0,0|0,2,0]=4 112 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 SBB041176 [1,0,1,0,0,0|0,2,0]=4 113 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 SBB038551 [1,0,1,0,0,0|0,1,0]=3 114 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SBB067909 [1,0,1,0,0,0|2,0,0]=4 115 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [1,0,1,0,0,0|2,0,0]=4 116 B11R1.20 SC1=CC=C(NC(C)=O)C=C1 SBB003881 [1,0,1,0,0,0|2,0,0]=4 117 B11R1.22 O=CC(=O)C1=CC=C(F)C=C1 SBB088374 [1,0,1,0,0,0|1,0,1]=4 118 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SBB086654 [1,0,1,0,0,0|2,0,0]=4 119 B11R1.36 CC(=O)N(O)C1=CC=CC=C1 SBB058639 [1,0,1,0,0,0|1,0,0]=3 120 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 SBB055419 [1,0,1,0,0,0|1,1,0]=4 121 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 SBB017231 [1,0,1,0,0,0|2,0,0]=4 122 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 SBB028298 [1,0,1,0,0,0|1,0,0]=3 123 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 SBB007730 [1,0,1,0,0,0|2,0,0]=4 124 B11R1.40 C1=CC=C(NC(=S)NC)C=C1 SBB003887 [1,0,1,0,0,0|1,1,0]=4 125 B11R1.40 CNC(=O)NC1=CC=CC=C1 SBB008334 [1,0,1,0,0,0|1,0,0]=3 126 B11R1.40 NCC(=O)NC1=CC=CC=C1 SBB004992 [1,0,1,0,0,0|2,0,0]=4 127 B11R1.40 NNC(=O)CC1=CC=CC=C1 SBB046750 [1,0,1,0,0,0|2,0,0]=4 128 B11R1.40 NNC(=O)NC1=CC=CC=C1 SBB028305 [1,0,1,0,0,0|1,0,0]=3 129 B11R1.40 NNC(=S)NC1=CC=CC=C1 SBB007538 [1,0,1,0,0,0|1,1,0]=4 130 B11R1.40 O=C(CBr)NC1=CC=CC=C1 SBB051003 [1,0,1,0,0,0|2,0,0]=4 131 B11R1.40 O=C(CC1=CC=CC=C1)NO SBB086771 [1,0,1,0,0,0|1,0,0]=3 132 B11R1.40 O=C(CCl)NC1=CC=CC=C1 SBB030441 [1,0,1,0,0,0|2,0,0]=4 133 B11R1.40 O=C(CS)NC1=CC=CC=C1 SBB008339 [1,0,1,0,0,0|1,1,0]=4 134 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 SBB086850 [1,0,1,0,0,0|2,0,0]=4 135 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 SBB051044 [1,0,1,0,0,0|1,1,0]=4 136 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [1,0,1,0,0,0|2,0,0]=4 137 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 SBB088343 [1,0,1,0,0,0|1,1,0]=4 138 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 SBB086915 [1,0,1,0,0,0|1,0,0]=3 139 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 SBB008515 [1,0,1,0,0,0|2,0,0]=4 140 B11R1.157 CC(=O)NC1=CC(O)=CC=C1 SBB055395 [1,0,1,0,0,0|2,0,0]=4 141 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SBB086985 [1,0,1,0,0,0|2,0,0]=4 142 B11R1.157 CC1=CC(NC(N)=O)=CC=C1 SBB028291 [1,0,1,0,0,0|1,0,0]=3 143 B11R1.157 CC1=CC(NC(N)=S)=CC=C1 SBB017678 [1,0,1,0,0,0|1,1,0]=4 144 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 SBB068547 [1,0,1,0,0,0|2,0,0]=4 145 B11R1.157 NC(=O)NC1=CC(Br)=CC=C1 SBB055210 [1,0,1,0,0,0|0,1,0]=3 146 B11R1.157 NC(=S)NC1=CC(Cl)=CC=C1 SBB041173 [1,0,1,0,0,0|0,2,0]=4 147 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 SBB055209 [1,0,1,0,0,0|0,1,0]=3 148 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 SBB062112 [1,0,1,0,0,0|1,1,0]=4 149 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 SBB068772 [1,0,1,0,0,0|2,0,0]=4 150 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 SBB088714 [1,0,1,0,0,0|2,0,0]=4 151 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SBB037935 [1,0,1,0,0,0|1,1,0]=4 152 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SBB063159 [1,0,1,0,0,0|1,1,0]=4 153 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SBB063367 [1,0,1,0,0,0|1,0,0]=3 154 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SBB064349 [1,0,1,0,0,0|1,1,0]=4 155 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SBB063147 [1,0,1,0,0,0|2,0,0]=4 156 B11R1.37 COC1=CC=C(F)C=C1C=O SBB052144 [1,0,1,0,0,0|2,0,0]=4 157 B11R1.166 CC1=CC(F)=CC=C1C(=O)O SBB062990 [1,0,1,0,0,0|2,0,0]=4 158 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 SBB052651 [1,0,1,0,0,0|2,0,0]=4 159 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 SBB028134 [1,0,1,0,0,0|1,1,0]=4 160 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 SBB006590 [1,0,1,0,0,0|1,0,0]=3 161 B11R1.166 NC1=CC(Br)=CC=C1C(=O)O SBB052622 [1,0,1,0,0,0|1,1,0]=4 162 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SBB003795 [1,0,1,0,0,0|2,0,0]=4 163 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br SBB063576 [1,0,1,0,0,0|2,0,0]=4 164 B11R1.166 O=C(O)C1=CC=C(F)C=C1F SBB063446 [1,0,1,0,0,0|2,0,0]=4 165 B11R1.166 O=C(O)C1=CC=C(F)C=C1O SBB052701 [1,0,1,0,0,0|2,0,0]=4 166 B11R2.1 CC1=CNC2=CC=CC=C12 SBB055975 [2,0,0,0,0,0|2,0,0]=4 167 B11R2.1 NC1=CNC2=C1C=CC=C2 SBB010263 [2,0,0,0,0,0|2,0,0]=4 168 B11R2.1 ON1N=NC2=C1C=CC=C2 SBB000114 [2,0,0,0,0,0|1,0,1]=4 169 B11R2.1 ON1N=NC2=CC=CC=C21 SBB056385 [2,0,0,0,0,0|1,0,1]=4 170 B11R2.10 BrC1=NC2=CC=CC=C2N1 SBB054573 [2,0,0,0,0,0|1,0,1]=4 171 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SBB058480 [2,0,0,0,0,0|2,0,0]=4 172 B11R2.10 CC1=NC2=CC=CC=C2N1 SBB046157 [2,0,0,0,0,0|1,0,1]=4 173 B11R2.10 ClC1=NC2=CC=CC=C2N1 SBB006585 [2,0,0,0,0,0|1,0,1]=4 174 B11R2.10 NC1=NC2=C(C=CC=C2)N1 SBB028244 [2,0,0,0,0,0|1,0,1]=4 175 B11R2.10 O=C1CC2=CC=CC=C2N1 SBB004215 [2,0,0,0,0,0|1,0,0]=3 176 B11R2.10 O=C1NC2=C(C=CC=C2)N1 SBB000067 [2,0,0,0,0,0|0,0,0]=2 177 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SBB058504 [2,0,0,0,0,0|1,0,0]=3 178 B11R2.10 O=C1NC2=C(C=CC=C2)S1 SBB037873 [2,0,0,0,0,0|1,0,0]=3 179 B11R2.10 OC1=NC2=C(C=CC=C2)N1 SBB004209 [2,0,0,0,0,0|0,0,2]=4 180 B11R2.10 S=C1NC2=CC=CC=C2S1 SBB037840 [2,0,0,0,0,0|1,1,0]=4 181 B11R2.10 SC1=NC2=C(C=CC=C2)N1 SBB004069 [2,0,0,0,0,0|0,1,1]=4 182 B11R2.36 BrC1=CC=C2C=CNC2=C1 SBB054567 [2,0,0,0,0,0|1,1,0]=4 183 B11R2.36 BrC1=CC=C2NC=CC2=C1 SBB054557 [2,0,0,0,0,0|1,1,0]=4 184 B11R2.36 BrC1=CC=C2NC=NC2=C1 SBB054576 [2,0,0,0,0,0|0,1,1]=4 185 B11R2.36 CC1=CC2=C(C=CN2)C=C1 SBB047999 [2,0,0,0,0,0|2,0,0]=4 186 B11R2.36 CC1=CC=C2NC=CC2=C1 SBB055972 [2,0,0,0,0,0|2,0,0]=4 187 B11R2.36 CC1=CC=C2NC=NC2=C1 SBB046249 [2,0,0,0,0,0|1,0,1]=4 188 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 SBB048045 [2,0,0,0,0,0|1,1,0]=4 189 B11R2.36 ClC1=CC=C2NC=NC2=C1 SBB086876 [2,0,0,0,0,0|0,1,1]=4 190 B11R2.36 FC1=CC2=C(C=C1)NN=C2 SBB085922 [2,0,0,0,0,0|2,0,0]=4 191 B11R2.36 FC1=CC2=C(C=CN2)C=C1 SBB054568 [2,0,0,0,0,0|1,0,0]=3 192 B11R2.36 FC1=CC=C2NC=CC2=C1 SBB085893 [2,0,0,0,0,0|1,0,0]=3 193 B11R2.36 FC1=CC=C2NCCC2=C1 SBB085967 [2,0,0,0,0,0|1,0,1]=4 194 B11R2.36 IC1=CC=C2NC=CC2=C1 SBB054565 [2,0,0,0,0,0|1,1,0]=4 195 B11R2.36 N1C=CC2=C1C=C(Cl)C=C2 SBB004059 [2,0,0,0,0,0|1,1,0]=4 196 B11R2.36 NC1=CC2=C(C=C1)NC=C2 SBB004219 [2,0,0,0,0,0|2,0,0]=4 197 B11R2.36 NC1=CC2=C(C=CN2)C=C1 SBB014556 [2,0,0,0,0,0|2,0,0]=4 198 B11R2.36 NC1=CC=C2N=CNC2=C1 SBB010145 [2,0,0,0,0,0|1,0,1]=4 199 B11R2.36 OC1=CC2=C(C=C1)NC=C2 SBB004214 [2,0,0,0,0,0|2,0,0]=4 200 B11R2.36 OC1=CC=C2C=CNC2=C1 SBB085833 [2,0,0,0,0,0|2,0,0]=4 201 B13R1.21 CN(C(=O)CCl)C1=CC=C(F)C=C1 SBB037892 [0,1,1,0,0,0|2,0,0]=4 202 B13R1.163 CC(=O)N(C)C1=C(F)C=C(F)C=C1 SBB090265 [0,1,1,0,0,0|2,0,0]=4 203 B13R1.163 O=C(O)C(O)C1=CC=C(F)C=C1F SBB063858 [0,1,1,0,0,0|2,0,0]=4 204 B13R1.510 O=C(O)C(O)C1=CC=C(F)C(F)=C1 SBB063857 [0,1,1,0,0,0|2,0,0]=4 205 B13R1.20 NCCC(=O)NC1=CC=CC(F)=C1 SBB018518 [0,1,1,0,0,0|2,0,0]=4 206 B13R1.40 CC1=C(F)C=CC=C1NC(=O)CCl SBB027567 [0,1,1,0,0,0|2,0,0]=4 207 B13R1.2872 CC1=CC=C(F)C=C1NC(=O)CCl SBB002363 [0,1,1,0,0,0|2,0,0]=4 208 B13R1.2872 O=C(CCl)NC1=CC(F)=CC=C1F SBB002361 [0,1,1,0,0,0|2,0,0]=4 209 B13R1.2879 CC1=CC=C(NC(=O)CCl)C=C1F SBB027765 [0,1,1,0,0,0|2,0,0]=4 210 B13R1.2879 CC1=CC=C(NC(=S)NN)C=C1F SBB071907 [0,1,1,0,0,0|1,1,0]=4 211 B13R1.2879 NNC(=S)NC1=CC(F)=C(F)C=C1 SBB093126 [0,1,1,0,0,0|1,1,0]=4 212 B13R1.2879 O=C(CCl)NC1=CC(F)=C(F)C=C1 SBB002364 [0,1,1,0,0,0|2,0,0]=4 213 B13R2.45 C(=O)C1=NC2=C(C=CC=C2)N1C SBB010051 [1,1,0,0,0,0|1,0,1]=4 214 B13R2.45 CC1=C(C=O)NC2=CC=CC=C21 SBB010412 [1,1,0,0,0,0|2,0,0]=4 215 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)N1 SBB004425 [1,1,0,0,0,0|2,0,0]=4 216 B13R2.135 N\N=C1/C(=O)NC2=C1C=CC=C2 SBB062318 [1,1,0,0,0,0|2,0,0]=4 217 B13R2.135 O=C1NC2=C(C=CC=C2)\C1=N/O SBB048293 [1,1,0,0,0,0|1,0,0]=3 218 B13R2.135 O=C1SC2=CC=CC=C2N1CO SBB056345 [1,1,0,0,0,0|1,0,0]=3 219 B13R2.135 O=CC1C(=O)NC2=CC=CC=C21 SBB005557 [1,1,0,0,0,0|1,0,1]=4 220 B13R2.359 CC1(C)C(=O)NC2=C1C=CC=C2 SBB082470 [1,1,0,0,0,0|2,0,0]=4 221 B13R2.359 O=C1NC2=C(C=CC=C2)C1(Cl)Cl SBB041802 [1,1,0,0,0,0|2,0,0]=4 222 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 SBB038748 [1,1,0,0,0,0|1,0,1]=4 223 B13R2.3028 CN1C(=O)OC2=CC=C(N)C=C21 SBB072555 [1,1,0,0,0,0|2,0,0]=4 224 B13R2.3028 N1C(=O)C(=O)C2=C1C=CC(Cl)=C2 SBB003741 [1,1,0,0,0,0|1,0,1]=4 225 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O SBB061707 [1,1,0,0,0,0|1,0,1]=4 226 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O SBB012610 [1,1,0,0,0,0|1,0,1]=4 227 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O SBB038749 [1,1,0,0,0,0|1,0,1]=4 228 B13R2.3028 O=C1NC2=CC=C(I)C=C2C1=O SBB061948 [1,1,0,0,0,0|1,0,1]=4 229 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 SBB006835 [1,1,0,0,0,0|1,0,1]=4 230 B13R2.3085 O=C1C(=O)N(Cl)C2=C1C=CC=C2 SBB007868 [1,1,0,0,0,0|1,0,1]=4 231 B13R2.4825 CC1=C2NC(=O)C(=O)C2=CC=C1 SBB002431 [1,1,0,0,0,0|1,0,1]=4 232 B13R2.4825 O=C1NC2=C(C=CC=C2Br)C1=O SBB066728 [1,1,0,0,0,0|1,0,1]=4 233 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O SBB067159 [1,1,0,0,0,0|1,0,1]=4 234 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O SBB045989 [1,1,0,0,0,0|1,0,1]=4 235 B13R2.4856 CC1=CC=CC2=C1C(=O)C(=O)N2 SBB066733 [1,1,0,0,0,0|1,0,1]=4 236 B13R2.4856 O=C1NC2=C(C1=O)C(Cl)=CC=C2 SBB068371 [1,1,0,0,0,0|1,0,1]=4 237 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O SBB054675 [1,1,0,0,0,0|1,0,1]=4 238 B13R2.43 FC1=CC=C2NC(CCl)=NC2=C1 SBB046349 [1,1,0,0,0,0|1,0,1]=4 239 B13R2.43 NNC1=NC2=C(C=CC(F)=C2)N1 SBB018696 [1,1,0,0,0,0|1,0,1]=4 240 B13R2.43 O=CC1=CC2=CC=C(Br)C=C2N1 SBB096585 [1,1,0,0,0,0|1,1,0]=4 241 B13R2.43 OCC1=NC2=CC=C(F)C=C2N1 SBB018533 [1,1,0,0,0,0|0,0,2]=4 242 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)N2 SBB059283 [1,1,0,0,0,0|1,0,0]=3 243 B13R2.2121 N#CC1=CC=C2NC(=O)NC2=C1 SBB051484 [1,1,0,0,0,0|1,0,0]=3 244 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)N2 SBB010440 [1,1,0,0,0,0|1,0,0]=3 245 B13R2.3050 CC1=NC2=C(C=CC(F)=C2F)N1 SBB088144 [1,1,0,0,0,0|1,0,1]=4 246 B13R2.5397 O=C1CC2=CC(F)=CC(F)=C2N1 SBB088241 [1,1,0,0,0,0|1,0,0]=3 247 B13R2.13083 CC1=C(C)C=C2NC(=O)NC2=C1 SBB056006 [1,1,0,0,0,0|1,0,0]=3 248 B13R2.13083 CC1=C(N)C=C2NC(=O)NC2=C1 SBB010150 [1,1,0,0,0,0|1,0,0]=3 249 B13R2.13083 FC1=C(Cl)C=C2N=C(Cl)NC2=C1 SBB054578 [1,1,0,0,0,0|1,0,1]=4 250 B13R2.13083 O=C1NC2=CC(Cl)=C(Cl)C=C2N1 SBB056003 [1,1,0,0,0,0|0,1,0]=3 251 B13R2.13083 O=C1NC2=CC(F)=C(Cl)C=C2N1 SBB056004 [1,1,0,0,0,0|0,0,0]=2 252 B13R2.13083 SC1=NC2=CC(F)=C(Cl)C=C2N1 SBB003521 [1,1,0,0,0,0|0,1,1]=4 253 B13R2.662 O=CC1=CNC2=C1C=CC(F)=C2 SBB066670 [1,1,0,0,0,0|1,0,1]=4 254 B15R2.45549 CN1C(=O)N(C)C2=CC(Br)=C(N)C=C21 SBB028122 [0,2,0,0,0,0|1,1,0]=4 255 B15R2.14758 CN1C(C(=O)O)=CC2=CC(F)=CC=C21 SBB010884 [0,2,0,0,0,0|2,0,0]=4 256 B15R2.22335 CN1C(=O)N(C)C2=CC(C=O)=CC=C21 SBB010828 [0,2,0,0,0,0|2,0,0]=4 257 B15R2.22335 CN1C(=O)N(C)C2=CC(CN)=CC=C21 SBB005676 [0,2,0,0,0,0|2,0,0]=4 258 B13R2.155 CC1=CC2=C(C=C1)OCC(=O)N2 SBB087684 [0,0,1,1,0,0|2,0,0]=4 259 B13R2.155 NC1=CC=C2OCC(=O)NC2=C1 SBB016739 [0,0,1,1,0,0|2,0,0]=4 260 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)N1 SBB003725 [0,0,1,1,0,0|1,1,0]=4 261 B13R2.155 O=C1COC2=CC=C(F)C=C2N1 SBB019002 [0,0,1,1,0,0|1,0,0]=3 262 B13R2.5179 O=C1COC2=C(Cl)C=CC=C2N1 SBB014314 [0,0,1,1,0,0|1,1,0]=4 263 B13R2.2136 O=CC1=CNC2=C1C=C(F)C=C2 SBB002930 [0,0,1,1,0,0|2,0,0]=4 264 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 SBB005141 [0,0,1,0,1,0|2,0,0]=4 265 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SBB086852 [0,0,1,0,1,0|2,0,0]=4 266 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 SBB051764 [0,0,1,0,1,0|2,0,0]=4 267 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 SBB055221 [0,0,1,0,1,0|1,0,0]=3 268 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 SBB000110 [0,0,1,0,1,0|2,0,0]=4 269 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 SBB032276 [0,0,1,0,1,0|1,1,0]=4 270 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 SBB040978 [0,0,1,0,1,0|1,1,0]=4 271 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 SBB102485 [0,0,1,0,1,0|1,1,0]=4 272 B11R1.23 NNC(=O)C1=CC=CC(N)=C1 SBB028304 [0,0,1,0,1,0|2,0,0]=4 273 B11R1.23 O=CC(=O)C1=CC(F)=CC=C1 SBB071511 [0,0,1,0,1,0|1,0,1]=4 274 B13R1.132 NC(=O)CC(N)C1=CC=C(F)C=C1 SBB303223 [0,0,1,0,0,1|2,0,0]=4 275 B13R1.15 CC1=CC(NCC(=O)NN)=CC=C1 SBB111638 [0,0,1,0,0,1|2,0,0]=4 276 B13R2.32 CN1C(=O)C=CC2=C1C=CC=C2 SBB087359 [1,0,0,0,0,1|2,0,0]=4 277 B13R2.32 CN1C(=O)COC2=CC=CC=C21 SBB056034 [1,0,0,0,0,1|2,0,0]=4 278 B13R2.328 N1C(=O)OC(=O)C2=C1C=CC=C2 SBB003928 [1,0,0,0,0,1|1,0,1]=4 279 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 SBB048184 [1,0,0,0,0,1|1,0,0]=3 280 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 SBB038533 [1,0,0,0,0,1|2,0,0]=4 281 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)N1 SBB087583 [1,0,0,0,0,1|1,0,1]=4 282 B13R2.369 CC1NC2=CC=CC=C2NC1=O SBB056026 [1,0,0,0,0,1|2,0,0]=4 283 B13R2.369 CN1CC2=C(C=CC=C2)NC1=O SBB057720 [1,0,0,0,0,1|1,0,0]=3 284 B13R2.369 N=C1NC2=C(C=CC=C2)NC1=O SBB018775 [1,0,0,0,0,1|2,0,0]=4 285 B13R2.369 NC1CC2=CC=CC=C2NC1=O SBB050350 [1,0,0,0,0,1|2,0,0]=4 286 B13R2.369 O=C1NC2=CC=CC=C2OC1=O SBB108834 [1,0,0,0,0,1|1,0,1]=4 287 B13R2.369 O=C1OC2=CC=CC=C2C=C1O SBB056328 [1,0,0,0,0,1|2,0,0]=4 288 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CS2 SBB037930 [1,0,0,0,0,1|2,0,0]=4 289 B13R2.3683 N1C(=O)CSC2=C1C=CC(Cl)=C2 SBB003549 [1,0,0,0,0,1|1,1,0]=4 290 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 SBB013234 [1,0,0,0,0,1|2,0,0]=4 291 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CO2 SBB010445 [1,0,0,0,0,1|2,0,0]=4 292 B13R2.3683 O=C1CCC2=CC(F)=CC=C2N1 SBB054597 [1,0,0,0,0,1|1,0,0]=3 293 B13R2.3683 O=C1CCC2=CC(O)=CC=C2N1 SBB056015 [1,0,0,0,0,1|2,0,0]=4 294 B13R2.3683 O=C1CSC2=C(C=CC(Br)=C2)N1 SBB005888 [1,0,0,0,0,1|1,1,0]=4