0 B11R1.91 NC(=O)CCC1=CN=CC=C1 BB31-6760 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.91 NC(=O)CNC1=CC=CC=C1 BB32-1447 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.91 O=C(O)C#CC1=CC=NC=C1 BB31-5726 [0,0,0,0,0,0|1,0,2]=3 3 B11R1.91 O=C(O)C#CC1=CN=CC=C1 BB32-3318 [0,0,0,0,0,0|1,0,2]=3 4 B11R1.91 O=C(O)CCC1=CC=NC=C1 BB52-8563 [0,0,0,0,0,0|1,0,2]=3 5 B11R1.91 O=C(O)CCC1=NC=CC=C1 BB52-8590 [0,0,0,0,0,0|1,0,2]=3 6 B11R1.91 O=C(O)COC1=CN=CC=C1 BB31-6546 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB52-3334 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.91 O=C(O)CSC1=NC=CC=N1 BB52-1566 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.17 OC\C=C\C1=CC=NC=C1 BB32-0874 [1,0,0,0,0,0|1,0,1]=3 10 B10R1.17 OC\C=C\C1=CN=CC=C1 BB31-9453 [1,0,0,0,0,0|1,0,1]=3 11 B10R1.17 OC\C=C\C1=NC=CC=C1 BB31-1899 [1,0,0,0,0,0|1,0,1]=3 12 B12R1.21 CC1=CC=C(C#CC(=O)O)C=C1 BB31-7651 [0,1,0,0,0,0|0,0,2]=3 13 B12R1.21 CC1=CC=C(\C=C\B(O)O)C=C1 BB31-5385 [0,1,0,0,0,0|1,0,1]=3 14 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 BB12-5413 [0,1,0,0,0,0|1,0,2]=4 15 B12R1.21 NC(=O)CCC1=CC=C(O)C=C1 BB31-8097 [0,1,0,0,0,0|1,0,2]=4 16 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB12-5412 [0,1,0,0,0,0|0,0,2]=3 17 B12R1.21 O=C(O)\C=C\C1=NC=C(F)C=C1 BB31-7518 [0,1,0,0,0,0|1,0,0]=2 18 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 BB31-2799 [0,1,0,0,0,0|2,0,1]=4 19 B12R1.27 COC(=O)C#CC1=NC=CC=C1 BB31-6213 [0,1,0,0,0,0|1,0,2]=4 20 B12R1.27 COC(=O)CCC1=NC=CC=C1 BB31-4510 [0,1,0,0,0,0|1,0,2]=4 21 B12R1.27 COC(=O)CNC1=CC=CC=C1 BB32-1728 [0,1,0,0,0,0|1,0,1]=3 22 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB31-3006 [0,1,0,0,0,0|1,0,1]=3 23 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 BB31-7674 [0,1,0,0,0,0|0,0,2]=3 24 B12R1.107 C=C(NC(C)=O)C1=CC=CC=C1 BB32-3562 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 BB31-5440 [0,1,0,0,0,0|0,0,2]=3 26 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 BB31-5414 [0,1,0,0,0,0|0,0,2]=3 27 B12R1.125 CC(=O)NCC1=C(Br)C=CC=C1 BB31-8714 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.125 CC(=O)NCC1=C(O)C=CC=C1 BB31-8656 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.125 O=C(O)C#CC1=C(F)C=CC=C1 BB32-3709 [0,1,0,0,0,0|0,0,2]=3 30 B12R1.226 O=C(O)C#CC1=CC=CC(Cl)=C1 BB31-6988 [0,1,0,0,0,0|0,0,2]=3 31 B12R1.226 OB(O)\C=C\C1=CC=CC(F)=C1 BB31-6629 [0,1,0,0,0,0|1,0,1]=3 32 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 BB32-3180 [0,0,0,1,0,0|1,0,2]=4 33 B12R2.24 ClC1=NC2=C(C=CC=C2)C=N1 BB54-4154 [0,0,0,1,0,0|3,0,0]=4 34 B12R2.24 ClC1=NC2=CN=CC=C2C=C1 BB32-2019 [0,0,0,1,0,0|3,0,0]=4 35 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 BB31-3061 [0,0,0,1,0,0|3,0,0]=4 36 B12R2.24 FC1=CC2=CC=CC=C2N=C1 BB32-1722 [0,0,0,1,0,0|3,0,0]=4 37 B12R2.24 FC1=NC2=CC=CC=C2C=C1 BB31-4902 [0,0,0,1,0,0|2,0,0]=3 38 B12R2.24 IC1=CC2=CC=CC=C2N=C1 BB31-6878 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.24 IC1=CC2=CC=NC=C2C=C1 BB31-7186 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.24 NC1=CC2=CC=CC=C2N=C1 BB52-6146 [0,0,0,1,0,0|3,0,0]=4 41 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 BB31-0331 [0,0,0,1,0,0|2,0,0]=3 42 B12R2.3190 O=C(O)C1CC2=C1C=CC=C2 BB31-2766 [0,0,0,1,0,0|0,0,2]=3 43 B10R1.18 CC(=O)CC1=CN=CC=C1 BB32-2986 [0,0,0,0,1,0|2,0,1]=4 44 B10R1.18 O=C(O)CC1=NC=CN=C1 BB31-2541 [0,0,0,0,1,0|2,0,1]=4 45 B10R1.66 O=C(O)CCC1=CC=CN1 BB32-1801 [0,0,0,0,1,0|1,0,2]=4 46 B12R1.252 O=C(O)CCSC1=NC=CC=C1 BB53-1033 [0,0,0,0,0,1|1,0,2]=4 47 B12R1.252 O=C(O)CNCC1=CC=NC=C1 BB52-9214 [0,0,0,0,0,1|1,0,2]=4 48 B12R1.252 O=C(O)CNCC1=CN=CC=C1 BB52-9756 [0,0,0,0,0,1|1,0,2]=4 49 B12R1.252 O=C(O)CNCC1=NC=CC=C1 BB52-9714 [0,0,0,0,0,1|1,0,2]=4 50 B12R1.252 OB(O)\C=C\CC1=CC=CC=C1 BB31-8109 [0,0,0,0,0,1|1,0,1]=3 51 B9R1.8 N\N=C\C1=CC=CC=C1 BB32-2520 [2,0,0,0,0,0|2,0,0]=4 52 B11R1.1 O=CCCC1=CC=C(Br)C=C1 BB31-6794 [1,1,0,0,0,0|0,0,2]=4 53 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 BB32-1043 [1,1,0,0,0,0|0,0,0]=2 54 B11R1.24 O=CCCC1=CC=CC(Br)=C1 BB31-4155 [1,1,0,0,0,0|0,0,2]=4 55 B11R1.40 O=C(CO)NC1=CC=CC=C1 BB32-2558 [1,1,0,0,0,0|1,0,1]=4 56 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 BB32-3859 [0,1,0,0,1,0|1,0,1]=4 57 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 BB31-0029 [0,1,0,0,1,0|1,0,1]=4 58 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 BB31-0032 [0,1,0,0,1,0|1,0,1]=4 59 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 BB32-1369 [0,1,0,0,1,0|1,0,1]=4 60 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 BB31-5646 [0,1,0,0,1,0|1,0,1]=4 61 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 BB31-8198 [0,1,0,0,1,0|2,0,0]=4 62 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 BB12-7660 [0,1,0,0,1,0|2,0,0]=4 63 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 BB31-5786 [0,1,0,0,1,0|1,0,1]=4 64 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 BB31-0028 [0,1,0,0,1,0|1,0,1]=4 65 B11R1.86 O=C(O)CN1C=CC=CC1=O BB52-8012 [0,1,0,0,1,0|1,0,1]=4 66 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 BB31-1635 [0,1,0,0,1,0|2,0,0]=4 67 B11R1.157 NC(=O)NC1=CC=CC(Br)=C1 BB31-5775 [0,1,0,0,1,0|2,0,0]=4 68 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 BB31-4723 [0,1,0,0,1,0|1,0,1]=4 69 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 BB32-2011 [0,1,0,0,1,0|1,0,1]=4 70 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 BB31-6394 [0,1,0,0,1,0|1,0,1]=4 71 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 BB31-0031 [0,1,0,0,1,0|1,0,1]=4 72 B13R1.45 N[C@@H](CCC(=O)O)C1=CC=CC=C1 BB32-3372 [0,1,0,0,0,1|0,0,2]=4 73 B13R1.45 N[C@H](CCC(=O)O)C1=CC=CC=C1 BB31-0164 [0,1,0,0,0,1|0,0,2]=4 74 B13R1.45 O=C(O)CNC(=O)C1=CC=CN=C1 BB52-0617 [0,1,0,0,0,1|1,0,1]=4 75 B13R1.45 O=C(O)CNC(=O)C1=CC=NC=C1 BB53-0208 [0,1,0,0,0,1|1,0,1]=4 76 B13R1.45 O=C(O)CNC(=O)C1=NC=CC=C1 BB53-0717 [0,1,0,0,0,1|1,0,1]=4 77 B13R1.149 O=C(O)CCOC1=CC=CC(Cl)=C1 BB31-6956 [0,1,0,0,0,1|0,0,2]=4 78 B13R1.158 O=C(O)CCCC1=C(F)C=CC=C1 BB32-0723 [0,1,0,0,0,1|0,0,2]=4 79 B13R1.158 O=C(O)CCCC1=C(O)C=CC=C1 BB32-1832 [0,1,0,0,0,1|0,0,2]=4 80 B13R1.158 O=C(O)CCOC1=C(Br)C=CC=C1 BB31-3294 [0,1,0,0,0,1|0,0,2]=4 81 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 BB32-1690 [0,1,0,0,0,1|1,0,1]=4 82 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 BB31-4405 [0,1,0,0,0,1|0,0,2]=4 83 B13R1.351 CC(CCC1=CC=CC=C1)C(=O)O BB32-0518 [0,1,0,0,0,1|0,0,2]=4 84 B13R1.351 O=C(O)C(=O)NCC1=CC=CN=C1 BB52-9157 [0,1,0,0,0,1|1,0,1]=4 85 B13R1.351 O=C(O)C(=O)NCC1=CC=NC=C1 BB52-9602 [0,1,0,0,0,1|1,0,1]=4 86 B13R1.351 O=C(O)C(=O)NCC1=NC=CC=C1 BB53-0207 [0,1,0,0,0,1|1,0,1]=4 87 B13R1.351 O=C(O)C(Br)CCC1=CC=CC=C1 BB31-3255 [0,1,0,0,0,1|0,0,2]=4 88 B13R1.3 COC1=CC=C(C#CC(=O)O)C=C1 BB32-1274 [0,2,0,0,0,0|0,0,2]=4 89 B13R1.3 COC1=CC=C(\C=C\B(O)O)C=C1 BB31-7336 [0,2,0,0,0,0|1,0,1]=4 90 B13R1.14 COC(=O)C#CC1=CC=C(F)C=C1 BB32-1958 [0,2,0,0,0,0|0,0,2]=4 91 B13R1.14 COC(=O)CCC1=CC=C(C)C=C1 BB32-3522 [0,2,0,0,0,0|0,0,2]=4 92 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 BB31-4540 [0,2,0,0,0,0|0,0,2]=4 93 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 BB32-1808 [0,2,0,0,0,0|0,0,2]=4 94 B13R1.133 CC(CC1=CC=C(F)C=C1)C(=O)O BB32-0888 [0,2,0,0,0,0|0,0,2]=4 95 B13R1.133 O=C(O)C(O)CC1=CC=C(Cl)C=C1 BB31-4228 [0,2,0,0,0,0|0,0,2]=4 96 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(F)C=C1 BB31-1106 [0,2,0,0,0,0|0,0,2]=4 97 B13R1.164 CC1=CC(Cl)=C(OCC(=O)O)C=C1 BB32-3371 [0,2,0,0,0,0|1,0,1]=4 98 B13R1.164 NC(=O)\C=C\C1=C(Cl)C=C(Cl)C=C1 BB12-5131 [0,2,0,0,0,0|1,0,0]=3 99 B13R1.164 O=C(Cl)\C=C\C1=C(Cl)C=C(Cl)C=C1 BB12-5132 [0,2,0,0,0,0|1,0,0]=3 100 B13R1.164 O=C(O)CCC1=C(Cl)C=C(Br)C=C1 BB31-1524 [0,2,0,0,0,0|0,0,2]=4 101 B13R1.164 O=C(O)COC1=C(F)C=C(Br)C=C1 BB32-2853 [0,2,0,0,0,0|1,0,1]=4 102 B13R1.164 OC(=O)\C=C\C1=CC=C(Cl)C=C1Cl BB12-5130 [0,2,0,0,0,0|0,0,0]=2 103 B13R1.511 O=C(O)CCC1=CC(Br)=C(O)C=C1 BB31-3957 [0,2,0,0,0,0|0,0,2]=4 104 B13R1.15 COC(=O)CCC1=CC=CC(F)=C1 BB32-2078 [0,2,0,0,0,0|0,0,2]=4 105 B13R1.135 COC(=O)C(Br)CC1=CC=CC=C1 BB32-1982 [0,2,0,0,0,0|0,0,2]=4 106 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 BB31-4052 [0,2,0,0,0,0|0,0,2]=4 107 B13R1.148 C\C(=C/C1=CC=CC(Br)=C1)[N+](=O)[O-] BB32-0338 [0,2,0,0,0,0|1,0,1]=4 108 B13R1.148 N[C@@H](CC1=CC=CC(I)=C1)C(=O)O BB31-4114 [0,2,0,0,0,0|0,0,2]=4 109 B13R1.418 N#CC(CC1=CC=CC=C1)C(=O)O BB32-2248 [0,2,0,0,0,0|0,0,2]=4 110 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O BB31-3737 [0,2,0,0,0,0|0,0,2]=4 111 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 BB31-0992 [0,2,0,0,0,0|0,0,2]=4 112 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O BB12-7957 [0,2,0,0,0,0|1,0,1]=4 113 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1F BB52-3340 [0,2,0,0,0,0|0,0,2]=4 114 B13R1.201 N[C@H](CC(=O)O)C1=C(O)C=CC=C1 BB31-7273 [0,2,0,0,0,0|0,0,2]=4 115 B13R1.90 COC1=C(\C=C\C(=O)O)C=CC=N1 BB31-1900 [0,2,0,0,0,0|1,0,0]=3 116 B13R1.90 N#CC1=C(CCC(=O)O)C=CC=C1 BB31-8035 [0,2,0,0,0,0|0,0,2]=4 117 B13R1.150 CC1=CC=CC(CCC(=O)O)=C1C BB32-1098 [0,2,0,0,0,0|0,0,2]=4 118 B13R1.893 O=C(O)CCC1=C(Br)C=CC(F)=C1 BB31-0071 [0,2,0,0,0,0|0,0,2]=4 119 B13R1.893 O=C(O)CCC1=C(Cl)C=CC(Cl)=C1 BB32-3755 [0,2,0,0,0,0|0,0,2]=4 120 B13R1.3787 CC1=CC=CC(C)=C1NCC(=O)O BB31-8478 [0,2,0,0,0,0|1,0,1]=4 121 B13R1.3787 CC1=CC=CC(Cl)=C1OCC(=O)O BB31-3990 [0,2,0,0,0,0|1,0,1]=4 122 B13R1.3787 O=C(O)COC1=C(Cl)C=CC=C1Cl BB32-2967 [0,2,0,0,0,0|1,0,1]=4 123 B11R1.53 C=CC1=C([N+](=O)[O-])C=CC=C1 BB32-3396 [0,0,1,1,0,0|1,0,1]=4 124 B11R1.266 CCC1=CC=CC(C(=O)O)=C1 BB32-3000 [0,0,1,1,0,0|0,0,2]=4 125 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 BB31-5735 [0,0,1,1,0,0|1,0,1]=4 126 B11R1.266 O=CC1=CC(C(=O)O)=CN=C1 BB31-6334 [0,0,1,1,0,0|2,0,0]=4 127 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 BB31-0664 [0,0,1,1,0,0|2,0,0]=4 128 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 BB32-3325 [0,0,1,1,0,0|2,0,0]=4 129 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [1,0,0,1,0,0|2,0,0]=4 130 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [1,0,0,1,0,0|2,0,0]=4 131 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [1,0,0,1,0,0|1,0,1]=4 132 B11R2.10 BrC1=CC2=C(C=CC=C2)N1 BB31-2458 [0,0,0,1,1,0|2,0,0]=4 133 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 BB32-2216 [0,0,0,1,1,0|1,0,0]=3 134 B11R2.10 IC1=CC2=C(C=CC=C2)N1 BB31-4420 [0,0,0,1,1,0|2,0,0]=4 135 B11R2.10 IC1=CC2=C(C=CC=C2)S1 BB32-1612 [0,0,0,1,1,0|1,1,0]=4 136 B11R2.10 NC1=NC2=CC=CC=C2O1 BB52-8718 [0,0,0,1,1,0|2,0,0]=4 137 B11R2.10 O=C1NC2=C(C=NC=C2)O1 BB32-3787 [0,0,0,1,1,0|2,0,0]=4 138 B11R2.10 O=C1O[N+]2=C(C=CC=C2)S1 BB31-5543 [0,0,0,1,1,0|2,0,0]=4 139 B11R2.36 O=C1C=CC2=C(NC=C2)N1 BB31-4946 [0,0,0,1,1,0|2,0,0]=4 140 B11R2.36 OC1=CC2=C(C=C1)SC=C2 BB32-0598 [0,0,0,1,1,0|2,0,0]=4 141 B11R2.36 OC1=CC2=C(C=CO2)C=C1 BB31-1913 [0,0,0,1,1,0|2,0,0]=4 142 B13R2.10 BrC1=CNC(C2=CC=CC=C2)=N1 BB52-6872 [0,0,0,1,0,1|2,0,0]=4 143 B13R2.10 BrC1=CSC(C2=CC=CC=C2)=N1 BB31-9648 [0,0,0,1,0,1|2,0,0]=4 144 B13R2.10 BrC1=NC=C(C2=CC=CC=C2)O1 BB31-7732 [0,0,0,1,0,1|1,0,0]=3 145 B13R2.10 ClC1=NC(C2=CC=CC=C2)=CS1 BB52-6862 [0,0,0,1,0,1|2,0,0]=4 146 B13R2.10 ClC1=NC=C(C2=CC=CC=C2)O1 BB32-3059 [0,0,0,1,0,1|1,0,0]=3 147 B13R2.10 ClC1=NC=C(C2=CC=CC=C2)S1 BB32-1600 [0,0,0,1,0,1|1,1,0]=4 148 B13R2.10 N=C1NC(C2=CC=CC=C2)=CO1 BB32-1992 [0,0,0,1,0,1|2,0,0]=4 149 B13R2.10 NC1=CC(C2=CC=CC=C2)=CS1 BB32-3827 [0,0,0,1,0,1|2,0,0]=4 150 B13R2.10 O=C1C=CN(C2=CC=CC=C2)N1 BB31-0127 [0,0,0,1,0,1|1,0,0]=3 151 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 BB31-2554 [0,0,0,1,0,1|2,0,0]=4 152 B13R2.72 CC(=O)C1=C2C=CC=CN2N=C1 BB32-3344 [0,0,0,1,0,1|2,0,0]=4 153 B13R2.72 CC(=O)C1=CN=C2C=CC=CN12 BB31-4529 [0,0,0,1,0,1|2,0,0]=4 154 B13R2.72 CC(=O)C1=CSC2=C1C=CC=C2 BB31-5757 [0,0,0,1,0,1|1,0,0]=3 155 B13R2.72 CC(=O)N1N=CC2=C1C=CC=C2 BB31-9673 [0,0,0,1,0,1|2,0,0]=4 156 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 BB31-7917 [0,0,0,1,0,1|1,0,0]=3 157 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 BB31-5182 [0,0,0,1,0,1|1,0,0]=3 158 B13R2.72 O=C(O)C1=C2C=NC=CN2N=C1 BB32-2782 [0,0,0,1,0,1|2,0,0]=4 159 B13R2.72 O=C(O)C1=CN=C2C=CC=NN12 BB32-0189 [0,0,0,1,0,1|2,0,0]=4 160 B13R2.72 O=C(O)C1=CN=C2C=NC=CN12 BB31-1577 [0,0,0,1,0,1|2,0,0]=4 161 B13R2.72 O=C(O)C1=CN=C2N=CC=CN12 BB32-3352 [0,0,0,1,0,1|2,0,0]=4 162 B13R2.72 O=C(O)C1=CNC2=C1C=CN=C2 BB31-7098 [0,0,0,1,0,1|1,0,0]=3 163 B13R2.72 O=C(O)C1=CNC2=NC=CN=C12 BB32-2689 [0,0,0,1,0,1|2,0,0]=4 164 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 BB31-4435 [0,0,0,1,0,1|0,0,0]=2 165 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 BB31-7561 [0,0,0,1,0,1|0,0,2]=4 166 B13R2.163 O=C1CC2=C(C=CC=C2)C=CN1 BB31-5524 [0,0,0,1,0,1|1,0,0]=3 167 B13R2.163 O=C1CCCC2=C(C=CC=C2)O1 BB31-4594 [0,0,0,1,0,1|0,0,2]=4 168 B13R2.155 CC1=CC=C2C=CC(O)=CC2=C1 BB31-4440 [0,1,0,1,0,0|1,0,0]=3 169 B13R2.155 NC1=CC=C2C=CC(Br)=CC2=N1 BB31-0461 [0,1,0,1,0,0|2,0,0]=4 170 B13R2.155 O=C1C=CC2=C(N=C(Cl)C=C2)N1 BB31-3066 [0,1,0,1,0,0|2,0,0]=4 171 B13R2.155 O=C1N=CC2=C(C=C(Br)C=C2)N1 BB31-7113 [0,1,0,1,0,0|2,0,0]=4 172 B13R2.155 OC1=CC=C2C=CC(Cl)=CC2=C1 BB31-7817 [0,1,0,1,0,0|1,0,0]=3 173 B13R2.155 OC1=CC=C2C=CC(Cl)=NC2=C1 BB32-2025 [0,1,0,1,0,0|2,0,0]=4 174 B13R2.32 CC1=C(Br)C=CC2=CC=CC=C21 BB31-3846 [0,1,0,1,0,0|2,0,0]=4 175 B13R2.32 CC1=C(O)C=CC2=CC=CC=C21 BB31-8753 [0,1,0,1,0,0|1,0,0]=3 176 B13R2.32 NC1=C(F)C2=CC=CC=C2C=C1 BB31-2550 [0,1,0,1,0,0|2,0,0]=4 177 B13R2.32 OC1=C(Cl)C=CC2=CC=CN=C21 BB31-6071 [0,1,0,1,0,0|2,0,0]=4 178 B13R2.32 OC1=C(Cl)N=CC2=CC=CC=C21 BB31-0238 [0,1,0,1,0,0|2,0,0]=4 179 B13R2.32 OC1=C(F)C=CC2=CC=CN=C21 BB32-1899 [0,1,0,1,0,0|2,0,0]=4 180 B13R2.32 OC1=C(O)C2=CC=CC=C2C=C1 BB31-5482 [0,1,0,1,0,0|0,0,1]=3 181 B13R2.57 CNC1=CC2=CC=CC=C2C=C1 BB32-1489 [0,1,0,1,0,0|2,0,0]=4 182 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 BB31-3393 [0,1,0,1,0,0|2,0,0]=4 183 B13R2.57 O=CC1=NC2=NC=CC=C2C=C1 BB32-3134 [0,1,0,1,0,0|2,0,0]=4 184 B13R2.57 OCC1=CC2=CC=NC=C2C=C1 BB32-0574 [0,1,0,1,0,0|2,0,0]=4 185 B13R2.15272 COC(=O)C1CC2=C1C=CC=C2 BB32-2031 [0,1,0,1,0,0|0,0,2]=4 186 B13R2.369 CC1=CC2=CC=CC=C2C=C1O BB31-5686 [0,1,0,1,0,0|1,0,0]=3 187 B13R2.369 CC1=NC2=CC=CC=C2C=C1Cl BB31-0296 [0,1,0,1,0,0|2,0,0]=4 188 B13R2.369 NC1=CC2=CC=CC=C2C=C1Br BB32-2439 [0,1,0,1,0,0|2,0,0]=4 189 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Br BB31-7389 [0,1,0,1,0,0|0,0,0]=2 190 B13R2.369 OC1=NC2=CC=CC=C2C=C1Br BB31-7203 [0,1,0,1,0,0|1,0,0]=3 191 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 BB32-0448 [0,1,0,1,0,0|1,0,0]=3 192 B13R2.435 NC(=O)C1=CC2=C(N=CC=C2)N1 BB32-1130 [0,1,0,1,0,0|2,0,0]=4 193 B13R2.435 NC(=O)C1=CC2=CC=CC=C2O1 BB52-4124 [0,1,0,1,0,0|1,0,0]=3 194 B13R2.435 NC(=O)C1=CN2C=CC=CC2=N1 BB32-2117 [0,1,0,1,0,0|2,0,0]=4 195 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)N1 BB31-5523 [0,1,0,1,0,0|2,0,0]=4 196 B13R2.435 NC(=O)C1=NN2C=CC=CC2=C1 BB31-6403 [0,1,0,1,0,0|2,0,0]=4 197 B13R2.435 NC(=S)C1=CC2=C(C=CC=C2)N1 BB32-3186 [0,1,0,1,0,0|1,1,0]=4 198 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)N1 BB32-0944 [0,1,0,1,0,0|1,0,0]=3 199 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 BB31-4928 [0,1,0,1,0,0|1,0,0]=3 200 B13R2.435 O=C(O)C1=CN2C=CC=CC2=C1 BB32-1633 [0,1,0,1,0,0|1,0,0]=3 201 B13R2.435 O=C(O)C1=CN2C=CC=NC2=N1 BB31-4743 [0,1,0,1,0,0|2,0,0]=4 202 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 BB31-5215 [0,1,0,1,0,0|2,0,0]=4 203 B13R2.435 O=C(O)C1=CN2N=CC=CC2=N1 BB31-3273 [0,1,0,1,0,0|2,0,0]=4 204 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 BB51-0827 [0,1,0,1,0,0|1,0,0]=3 205 B13R2.435 O=C(O)C1=NN2C=CC=CC2=N1 BB31-6515 [0,1,0,1,0,0|2,0,0]=4 206 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 BB31-1387 [0,1,0,1,0,0|2,0,0]=4 207 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 BB52-1533 [0,1,0,1,0,0|1,0,0]=3 208 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 BB32-1704 [0,1,0,1,0,0|2,0,0]=4 209 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)N1 BB31-7409 [0,1,0,1,0,0|1,0,0]=3 210 B13R2.328 O=C1C=C(O)C2=CC=CN=C2N1 BB32-3345 [0,1,0,1,0,0|2,0,0]=4 211 B13R2.328 OC1=CC(Br)=CC2=CC=CC=C12 BB31-5300 [0,1,0,1,0,0|2,0,0]=4 212 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 BB31-8676 [0,1,0,1,0,0|2,0,0]=4 213 B13R2.5179 BrC1=CC=C2C(Br)=CC=CC2=C1 BB31-3997 [0,1,0,1,0,0|2,0,0]=4 214 B13R2.5179 CC1=CC=C2C(Cl)=CC=CC2=N1 BB32-2473 [0,1,0,1,0,0|2,0,0]=4 215 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 BB31-6036 [0,1,0,1,0,0|2,0,0]=4 216 B13R2.5179 NC1=CC=CC2=C1C=CC(=O)N2 BB32-3197 [0,1,0,1,0,0|1,0,0]=3 217 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2N1 BB31-7109 [0,1,0,1,0,0|1,0,0]=3 218 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 BB31-4990 [0,1,0,1,0,0|1,0,0]=3 219 B13R2.5179 O=C1C=CC2=C(F)C=CC=C2N1 BB32-3348 [0,1,0,1,0,0|1,0,0]=3 220 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 BB31-5139 [0,1,0,1,0,0|2,0,0]=4 221 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 BB31-8653 [0,1,0,1,0,0|2,0,0]=4 222 B13R2.5179 OC1=CC=C2C(Br)=CC=NC2=C1 BB31-3573 [0,1,0,1,0,0|2,0,0]=4 223 B13R2.162 CC1=C2C=C(Br)C=CC2=CC=C1 BB31-5144 [0,1,0,1,0,0|2,0,0]=4 224 B13R2.162 CC1=CC=C2C=CC=C(N)C2=C1 BB31-5030 [0,1,0,1,0,0|2,0,0]=4 225 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 BB52-5214 [0,1,0,1,0,0|2,0,0]=4 226 B13R2.162 ClC1=C2N=C(Br)C=CC2=CC=C1 BB31-7056 [0,1,0,1,0,0|2,0,0]=4 227 B13R2.162 N=C1C=CC2=CC=CC(Cl)=C2N1 BB32-1492 [0,1,0,1,0,0|2,0,0]=4 228 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 BB31-2047 [0,1,0,1,0,0|2,0,0]=4 229 B13R2.162 OC1=C2C=C(Br)C=CC2=CC=C1 BB31-5043 [0,1,0,1,0,0|2,0,0]=4 230 B13R2.162 OC1=C2C=C(Cl)C=CC2=CC=C1 BB32-3263 [0,1,0,1,0,0|2,0,0]=4 231 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 BB32-2013 [0,1,0,1,0,0|2,0,0]=4 232 B13R2.162 OC1=C2N=C(Br)C=CC2=CC=C1 BB31-2451 [0,1,0,1,0,0|2,0,0]=4 233 B13R2.162 OC1=CC=C2N=CC=C(Cl)C2=C1 BB31-2642 [0,1,0,1,0,0|2,0,0]=4 234 B13R2.3683 BrC1=CC=C2C=C(I)C=CC2=C1 BB32-1777 [0,1,0,1,0,0|2,0,0]=4 235 B13R2.3683 CC1=CC=C2C=C(I)C=CC2=N1 BB31-8212 [0,1,0,1,0,0|2,0,0]=4 236 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 BB31-6037 [0,1,0,1,0,0|0,0,0]=2 237 B13R2.3683 NC1=CC=C2OC(=O)C=CC2=C1 BB52-5081 [0,1,0,1,0,0|0,0,0]=2 238 B13R2.3683 O=C1CCC2=C(C=CC(I)=C2)O1 BB32-0105 [0,1,0,1,0,0|0,0,2]=4 239 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 BB31-6835 [0,1,0,1,0,0|2,0,0]=4 240 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 BB32-1301 [0,1,0,1,0,0|1,0,0]=3 241 B13R2.3683 OC1=CC=C2C=C(Cl)C=NC2=C1 BB31-1518 [0,1,0,1,0,0|2,0,0]=4 242 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 BB31-1684 [0,1,0,1,0,0|1,0,0]=3 243 B13R1.337 O=C(O)CCCSC1=CC=CC=C1 BB31-3639 [0,0,0,0,0,2|0,0,2]=4 244 B13R1.337 O=C(O)\C=C\CCC1=CC=CC=C1 BB32-2862 [0,0,0,0,0,2|0,0,0]=2 245 B13R1.337 O=C(O)\C=N\OCC1=CC=CC=C1 BB31-8681 [0,0,0,0,0,2|0,0,1]=3