0 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [0,0,0,0,0,0|2,0,2]=4 2 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,0,0,0,0,0|1,0,3]=4 3 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,0,0,0,0,0|3,0,1]=4 5 B11R1.40 CNC(=S)NC1=CC=CC=C1 S792 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 5715AL [0,0,0,0,0,0|0,0,2]=2 7 B11R1.40 NCC(=O)NC1=CC=CC=C1 4165AE [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 N#C\C=C\C1=CC=NC=C1 8913AH [1,0,0,0,0,0|2,0,1]=4 9 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [1,0,0,0,0,0|1,0,1]=3 10 B10R1.17 O=CNNC1=CC=CC=C1 9369AB [1,0,0,0,0,0|2,0,0]=3 11 B10R1.17 OC\C=C\C1=CC=CN=C1 5644AJ [1,0,0,0,0,0|1,0,2]=4 12 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [1,0,0,0,0,0|1,0,1]=3 13 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [1,0,0,0,0,0|2,0,1]=4 14 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [1,0,0,0,0,0|1,1,0]=3 15 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [1,0,0,0,0,0|0,0,1]=2 16 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [1,0,0,0,0,0|0,0,3]=4 17 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [1,0,0,0,0,0|0,0,3]=4 18 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [1,0,0,0,0,0|2,0,1]=4 19 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [1,0,0,0,0,0|1,1,1]=4 20 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [1,0,0,0,0,0|2,1,0]=4 22 B12R1.32 O=C(\C=N\O)NC1=CC=CC=C1 9279AA [0,1,0,0,0,0|2,0,1]=4 23 B12R1.43 C=C(C)C(=O)OC1=CC=CC=C1 E406 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.43 CC(=O)C(C)CC1=CC=CC=C1 2082AB [0,1,0,0,0,0|0,0,2]=3 25 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O 0185AE [0,1,0,0,0,0|1,0,2]=4 26 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O 9529AF [0,1,0,0,0,0|1,0,1]=3 27 B12R1.43 CC(SC1=CC=CC=N1)C(=O)O 0108AE [0,1,0,0,0,0|2,0,1]=4 28 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O W3956 [0,1,0,0,0,0|1,0,2]=4 29 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 4343AE [0,1,0,0,0,0|2,0,0]=3 30 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 R761 [0,1,0,0,0,0|1,0,2]=4 31 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 4193AA [0,1,0,0,0,0|1,0,1]=3 32 B12R1.49 O=CC(Cl)CC1=CC=C(Cl)C=C1 Y6536 [0,1,0,0,0,0|1,0,2]=4 33 B12R1.194 CC(C)(C=O)SC1=CC=CC=C1 7249AE [0,1,0,0,0,0|1,0,1]=3 34 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 4843AB [0,0,0,1,0,0|2,0,0]=3 35 B12R2.18 CC1=C(N)N2C=CC=CC2=N1 2709AB [0,0,0,1,0,0|3,0,0]=4 36 B12R2.18 O=C1NC2=C(C=NC=C2)C1=O 8643AA [0,0,0,1,0,0|3,0,0]=4 37 B12R2.18 O=C1NC2=CC=CN=C2C1=O 9886AH [0,0,0,1,0,0|3,0,0]=4 38 B12R2.18 O=C1NC2=NC=CC=C2C1=O Y5473 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.24 BrC1=CC2=CC=CC=C2N=N1 Z5133 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 9421AA [0,0,0,1,0,0|3,0,0]=4 41 B12R2.24 BrC1=CC2=CN=CC=C2N=C1 Z4310 [0,0,0,1,0,0|3,0,0]=4 42 B12R2.24 CC1=CC2=C(C=C1)C=NN=C2 6869AL [0,0,0,1,0,0|3,0,0]=4 43 B12R2.24 ClC1=CC2=CC=CN=C2N=C1 4347AB [0,0,0,1,0,0|3,0,0]=4 44 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 V6583 [0,0,0,1,0,0|3,0,0]=4 45 B12R2.24 ClC1=NN=C2C=CC=CC2=C1 5859AJ [0,0,0,1,0,0|3,0,0]=4 46 B12R2.24 FC1=CC2=CN=CC=C2C=C1 Y5168 [0,0,0,1,0,0|3,0,0]=4 47 B12R2.24 FC1=CC=C2C=CC=CC2=C1 Z3465 [0,0,0,1,0,0|2,0,0]=3 48 B12R2.24 FC1=CC=C2N=CC=CC2=C1 V5066 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.24 IC1=CC=C2C=NC=CC2=C1 Y4007 [0,0,0,1,0,0|3,0,0]=4 50 B12R2.24 IC1=CN=C2C=CC=NC2=C1 4408AA [0,0,0,1,0,0|3,0,0]=4 51 B12R2.24 NC1=CC2=C(C=CN=C2)N=C1 7606AB [0,0,0,1,0,0|3,0,0]=4 52 B12R2.24 NC1=CC2=NC=CC=C2C=C1 6474AJ [0,0,0,1,0,0|3,0,0]=4 53 B12R2.24 NC1=CC2=NC=CC=C2N=C1 V3390 [0,0,0,1,0,0|3,0,0]=4 54 B12R2.24 S=C1C=CC2=CC=CC=C2N1 0779AQ [0,0,0,1,0,0|3,0,0]=4 55 B12R2.24 SC1=NC2=CC=CC=C2N=C1 8313AE [0,0,0,1,0,0|3,0,0]=4 56 B12R2.32 C=CC1=NC2=CC=CC=C2N1 4631AD [0,0,0,1,0,0|3,0,0]=4 57 B12R2.32 CCC1=CC2=C(C=CC=C2)C1 8751AA [0,0,0,1,0,0|1,0,1]=3 58 B12R2.32 N#CC1=CC2=C(C=CC=C2)N1 4573AB [0,0,0,1,0,0|2,0,1]=4 59 B12R2.32 NCC1=CC2=C(C=CC=C2)S1 8311AH [0,0,0,1,0,0|2,0,1]=4 60 B12R2.32 O=CC1=CC2=NC=CC=C2N1 8910AA [0,0,0,1,0,0|2,0,0]=3 61 B12R2.32 O=CC1=CN2C=CC=NC2=N1 7075AA [0,0,0,1,0,0|3,0,0]=4 62 B10R1.15 C#CC(=O)C1=CC=CC=C1 0047AQ [0,0,0,0,1,0|2,0,1]=4 63 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [0,0,0,0,1,0|1,0,2]=4 64 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [0,0,0,0,1,0|2,0,0]=3 65 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [0,0,0,0,1,0|0,0,3]=4 66 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [0,0,0,0,1,0|2,0,0]=3 67 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [0,0,0,0,1,0|2,0,1]=4 68 B9R1.8 CNCC1=CC=CC=C1 3855AD [2,0,0,0,0,0|1,0,1]=4 69 B9R1.8 CNNC1=CC=CC=C1 V2456 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [2,0,0,0,0,0|0,0,0]=2 71 B9R1.8 O=CNC1=NC=CC=C1 1807AL [2,0,0,0,0,0|2,0,0]=4 72 B11R1.1 CO\C=C\C1=CC=C(Br)C=C1 8849AB [1,1,0,0,0,0|2,0,0]=4 73 B11R1.1 ClC\C=C\C1=CC=C(Br)C=C1 Y1270 [1,1,0,0,0,0|1,0,1]=4 74 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [1,1,0,0,0,0|0,0,2]=4 75 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 3648AL [1,1,0,0,0,0|1,0,1]=4 76 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 0552AQ [1,1,0,0,0,0|0,0,0]=2 77 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 6705AB [1,1,0,0,0,0|1,0,0]=3 78 B11R1.16 O=C(\C=C\Cl)C1=CC=CC=C1 0138AQ [1,1,0,0,0,0|1,0,0]=3 79 B11R1.17 O=C\C=C\C1=CC=CC=C1Br Z3541 [1,1,0,0,0,0|0,0,0]=2 80 B11R1.17 O=C\C=C\C1=CC=CC=C1F Z3547 [1,1,0,0,0,0|0,0,0]=2 81 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 3971AD [1,1,0,0,0,0|0,0,2]=4 82 B11R1.24 O=CCCC1=CC=CC(F)=C1 1852AB [1,1,0,0,0,0|0,0,2]=4 83 B11R1.24 O=CNCC1=CC=CC(F)=C1 W3915 [1,1,0,0,0,0|1,0,1]=4 84 B11R1.24 O=C\C=C\C1=CC=CC(Br)=C1 W3315 [1,1,0,0,0,0|0,0,0]=2 85 B11R1.24 O=C\C=C\C1=CC=CC(Br)=C1 Z3561 [1,1,0,0,0,0|0,0,0]=2 86 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2381AJ [1,1,0,0,0,0|1,0,0]=3 87 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2382AJ [1,1,0,0,0,0|1,0,0]=3 88 B11R1.91 NC(=O)C#CC1=CC=CC=C1 2477AL [1,1,0,0,0,0|0,0,2]=4 89 B11R1.91 NC(=O)CNC1=CC=CC=C1 V4420 [1,1,0,0,0,0|1,0,1]=4 90 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 8155AF [1,1,0,0,0,0|0,0,2]=4 91 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CN=C1 Y6136 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.91 O=[N+]([O-])\C=C\C1=CN=CC=C1 0002AE [1,1,0,0,0,0|2,0,0]=4 93 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 0445AC [1,1,0,0,0,0|1,0,1]=4 94 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 Y8599 [1,1,0,0,0,0|2,0,0]=4 95 B11R1.20 CC(=O)NC1=CC=C(O)C=N1 8000AA [1,1,0,0,0,0|2,0,0]=4 96 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [1,1,0,0,0,0|2,0,0]=4 97 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [1,1,0,0,0,0|1,0,0]=3 99 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [1,1,0,0,0,0|2,0,0]=4 100 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [1,1,0,0,0,0|1,0,1]=4 101 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [1,1,0,0,0,0|1,0,1]=4 102 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [1,1,0,0,0,0|2,0,0]=4 103 B11R1.36 BrC(Br)=C(Br)C1=CC=CC=C1 O760 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [1,1,0,0,0,0|1,0,0]=3 105 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 Y1505 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [1,1,0,0,0,0|1,0,1]=4 107 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 5219AB [1,1,0,0,0,0|2,0,0]=4 108 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [1,1,0,0,0,0|1,0,1]=4 109 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [1,1,0,0,0,0|0,0,1]=3 110 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [1,1,0,0,0,0|0,0,1]=3 111 B11R1.86 CC(=O)NC1=C(Br)N=CC=C1 8863AJ [1,1,0,0,0,0|2,0,0]=4 112 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 Z3279 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 8398AE [1,1,0,0,0,0|2,0,0]=4 114 B11R1.86 CC(=O)NC1=CC=CNC1=O 9389AE [1,1,0,0,0,0|2,0,0]=4 115 B11R1.86 CC(=O)NC1=NC=CC=C1O 9933AD [1,1,0,0,0,0|2,0,0]=4 116 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [1,1,0,0,0,0|0,0,1]=3 117 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [1,1,0,0,0,0|0,0,1]=3 118 B11R1.157 CC(=O)CC1=NC(C)=CC=C1 9512AH [1,1,0,0,0,0|1,0,1]=4 119 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 3153AE [1,1,0,0,0,0|1,0,1]=4 120 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 1694AC [1,1,0,0,0,0|2,0,0]=4 121 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 2129AB [1,1,0,0,0,0|2,0,0]=4 122 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [1,1,0,0,0,0|1,0,1]=4 123 B11R1.7 C=C[Si](C)(Cl)C1=CC=CC=C1 0115AQ [0,1,0,0,1,0|1,1,0]=4 124 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,1,0,0,1,0|2,0,0]=4 125 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,1,0,0,1,0|1,0,0]=3 126 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [0,1,0,0,1,0|1,0,1]=4 127 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 A977 [0,1,0,0,1,0|1,0,0]=3 128 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,1,0,0,1,0|1,0,0]=3 129 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 W4184 [0,1,0,0,1,0|1,0,0]=3 130 B11R1.23 O=CC(=O)C1=CC=CC(Br)=C1 X8794 [0,1,0,0,1,0|1,0,0]=3 131 B13R1.351 CC(=O)C(C)OCC1=CC=CC=C1 4595AF [0,1,0,0,0,1|0,0,2]=4 132 B13R1.351 CC(CCC1=CC=CC=C1)C(=O)O 1797AJ [0,1,0,0,0,1|0,0,2]=4 133 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O Y8576 [0,1,0,0,0,1|0,0,2]=4 134 B13R1.417 O=C[C@H](CO)OCC1=CC=CC=C1 5493AA [0,1,0,0,0,1|0,0,2]=4 135 B13R1.348 C\C(=C/C1=CC=CC=C1)CC(N)=O 5994AL [0,2,0,0,0,0|0,0,0]=2 136 B13R1.22 O=C\C(F)=C(/F)C1=CC=CC(F)=C1 Z3569 [0,2,0,0,0,0|1,0,0]=3 137 B13R1.152 CN(C(=O)C(=O)O)C1=CC=CC=C1 3650AD [0,2,0,0,0,0|2,0,0]=4 138 B13R1.133 CC(CC1=CC=C(Br)C=C1)C(=O)O Y5507 [0,2,0,0,0,0|0,0,2]=4 139 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O 0111AE [0,2,0,0,0,0|1,0,1]=4 140 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O X6269 [0,2,0,0,0,0|1,0,1]=4 141 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)O 8891AE [0,2,0,0,0,0|1,0,1]=4 142 B13R1.133 CC1=CC=C(OC(C)C(=O)O)C=C1 7688AD [0,2,0,0,0,0|1,0,1]=4 143 B13R1.133 CC1=CC=C(\C=C(\C)[N+](=O)[O-])C=C1 X6155 [0,2,0,0,0,0|1,0,0]=3 144 B13R1.133 C[C@H](OC1=CC=C(O)C=C1)C(=O)O V2122 [0,2,0,0,0,0|1,0,1]=4 145 B13R1.133 NC1=CC=C(NC(=O)C(=O)O)C=C1 8057AF [0,2,0,0,0,0|2,0,0]=4 146 B13R1.148 CC(OC1=CC(Br)=CC=C1)C(=O)O 2882AE [0,2,0,0,0,0|1,0,1]=4 147 B13R1.148 CC(OC1=CC=CC(Br)=C1)C(N)=O 3098AF [0,2,0,0,0,0|1,0,1]=4 148 B13R1.148 CC1=CC=CC(OC(C)C(=O)O)=C1 8403AD [0,2,0,0,0,0|1,0,1]=4 149 B13R1.148 O=C(O)C(=O)NC1=CC=CC(F)=C1 1494AF [0,2,0,0,0,0|2,0,0]=4 150 B13R1.202 CC(=O)C(C)OC1=CC=CC=C1O 2892AF [0,2,0,0,0,0|1,0,1]=4 151 B13R1.202 CC(OC1=CC=CC=C1Br)C(=O)O 9058AE [0,2,0,0,0,0|1,0,1]=4 152 B13R1.202 CC(OC1=CC=CC=C1F)C(=O)O 5506AD [0,2,0,0,0,0|1,0,1]=4 153 B13R1.202 CC1=CC=CC=C1NC(=O)C(=O)O 2766AE [0,2,0,0,0,0|2,0,0]=4 154 B13R1.418 N#C\C(=C/C1=CC=CN=C1)C(=O)O 7717AC [0,2,0,0,0,0|1,0,1]=4 155 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O 5357AA [0,2,0,0,0,0|0,0,2]=4 156 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O 9592AA [0,2,0,0,0,0|0,0,2]=4 157 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O 5874AA [0,2,0,0,0,0|0,0,2]=4 158 B13R1.249 CC(C)(C=O)SC1=CC=C(Cl)C=C1 5707AE [0,2,0,0,0,0|1,0,1]=4 159 B11R2.1 BrC1=COC2=CC=CC=C12 Y9562 [1,0,0,1,0,0|2,0,0]=4 160 B11R2.1 NC1=CSC2=CC=CC=C12 W5550 [1,0,0,1,0,0|2,0,0]=4 161 B11R2.1 NC1=CSC2=CC=CC=C12 Y5306 [1,0,0,1,0,0|2,0,0]=4 162 B11R2.1 O=C1C=CC2=C1C=CC=C2 Y5096 [1,0,0,1,0,0|0,0,0]=2 163 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 0677AQ [1,0,0,1,0,0|2,0,0]=4 164 B11R2.988 OCC1=CC2=CC=CC=C21 K959 [1,0,0,1,0,0|0,0,2]=4 165 B11R2.10 CC1=CC2=C(C=CC=C2)O1 X5959 [1,0,0,1,0,0|0,0,1]=3 166 B11R2.10 CC1=CC2=NC=CC=C2N1 W8141 [1,0,0,1,0,0|2,0,0]=4 167 B11R2.10 IC1=CC2=C(C=CC=C2)S1 7957AJ [1,0,0,1,0,0|1,1,0]=4 168 B11R2.10 IC1=CC2=CC=CC=C2N1 2333AB [1,0,0,1,0,0|2,0,0]=4 169 B11R2.10 O=C1C=C2C=CC=CN2N1 8937AB [1,0,0,1,0,0|2,0,0]=4 170 B11R2.10 O=C1CN2C=CC=CC2=N1 7452AB [1,0,0,1,0,0|2,0,0]=4 171 B11R2.10 O=C1OC2=C(C=CC=C2)O1 1033AB [1,0,0,1,0,0|2,0,0]=4 172 B11R2.10 S=C1CC2=C(C=CC=C2)N1 6726AB [1,0,0,1,0,0|1,1,0]=4 173 B13R2.10 BrC1=COC(C2=CC=CC=C2)=N1 Y4361 [0,0,0,1,0,1|1,0,1]=4 174 B13R2.10 BrC1=CSC(C2=CC=CC=C2)=N1 Y7505 [0,0,0,1,0,1|1,1,0]=4 175 B13R2.10 CC1=COC(C2=CC=CC=C2)=N1 Y4446 [0,0,0,1,0,1|0,0,1]=3 176 B13R2.10 CC1=CSC(C2=CC=CC=C2)=C1 4298AD [0,0,0,1,0,1|0,1,0]=3 177 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 3448AA [0,0,0,1,0,1|2,0,0]=4 178 B13R2.10 CC1=NC=C(C2=CC=CC=C2)S1 0265AB [0,0,0,1,0,1|2,0,0]=4 179 B13R2.10 IC1=CN(C2=CC=CC=C2)N=C1 8066AD [0,0,0,1,0,1|2,0,0]=4 180 B13R2.10 OC1=CSC(C2=CC=CC=C2)=N1 0220AF [0,0,0,1,0,1|1,1,0]=4 181 B13R2.32 CC1=C(Br)C2=C(C=C1)C=NC=C2 2405AA [0,0,0,1,0,1|2,0,0]=4 182 B13R2.32 CC1=C(Br)C2=CC=CC=C2C=N1 2705AJ [0,0,0,1,0,1|1,0,0]=3 183 B13R2.32 CC1=C(C)C2=NC=CC=C2C=C1 V4250 [0,0,0,1,0,1|2,0,0]=4 184 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 9598AB [0,0,0,1,0,1|1,0,0]=3 185 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 4399AE [0,0,0,1,0,1|2,0,0]=4 186 B13R2.32 CC1=C(N)C=NC2=CC=CC=C21 Y9270 [0,0,0,1,0,1|2,0,0]=4 187 B13R2.32 CC1=CC=C2C=CC=NC2=C1C Z8420 [0,0,0,1,0,1|2,0,0]=4 188 B13R2.32 CN1C=CC2=C(C=CC=C2)C1=O 6318AB [0,0,0,1,0,1|1,0,0]=3 189 B13R2.32 ClC1=C2C=CC=CC2=NC=C1Br 1586AC [0,0,0,1,0,1|2,0,0]=4 190 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 W5793 [0,0,0,1,0,1|2,0,0]=4 191 B13R2.32 NC1=C(Br)N=CC2=CC=CC=C21 W6046 [0,0,0,1,0,1|2,0,0]=4 192 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 W5578 [0,0,0,1,0,1|2,0,0]=4 193 B13R2.32 NC1=C2C=CC=CC2=CC=C1O D097 [0,0,0,1,0,1|2,0,0]=4 194 B13R2.32 NN1C=NC2=CC=CC=C2C1=O 0810AQ [0,0,0,1,0,1|2,0,0]=4 195 B13R2.32 O=C1C(I)=COC2=CC=CC=C12 5346AH [0,0,0,1,0,1|1,0,0]=3 196 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=N1 4705AB [0,0,0,1,0,1|2,0,0]=4 197 B13R2.32 OC1=CC=C2C=CC=CC2=C1O 4452AL [0,0,0,1,0,1|1,0,1]=4 198 B13R2.57 C=CC1=CC=C2C=CC=CC2=N1 Y4059 [0,0,0,1,0,1|2,0,0]=4 199 B13R2.57 O=CC1=CC2=C(C=CC=N2)N=C1 4506AF [0,0,0,1,0,1|1,0,1]=4 200 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 W8938 [0,0,0,1,0,1|1,0,1]=4 201 B13R2.57 O=CC1=CC=C2C=NC=CC2=C1 Y5303 [0,0,0,1,0,1|1,0,1]=4 202 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 2369AL [0,1,0,1,0,0|0,0,2]=4 203 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)O1 5577AE [0,1,0,1,0,0|1,0,0]=3 204 B13R2.135 CC1=C(C=O)C2=CC=CN=C2N1 Z5200 [0,1,0,1,0,0|2,0,0]=4 205 B13R2.135 CN1N=C2C=CC=CC2=C1C=O W5574 [0,1,0,1,0,0|2,0,0]=4 206 B13R2.328 CC1=CC(=O)N2C=CC=CC2=N1 Y6083 [0,1,0,1,0,0|2,0,0]=4 207 B13R2.328 CC1=CC(Br)=C2N=CC=CC2=C1 V7964 [0,1,0,1,0,0|2,0,0]=4 208 B13R2.328 CC1=CC(C)=C2C=CC=CC2=C1 4571AL [0,1,0,1,0,0|1,0,0]=3 209 B13R2.328 CC1=CC(Cl)=C2N=CC=CC2=C1 Z4361 [0,1,0,1,0,0|2,0,0]=4 210 B13R2.328 CC1=CC2=CC=CC=C2C(=O)N1 2357AJ [0,1,0,1,0,0|0,0,0]=2 211 B13R2.328 CC1=NC(C)=C2C=CC=CC2=N1 W7989 [0,1,0,1,0,0|2,0,0]=4 212 B13R2.328 CC1=NC(Cl)=C2C=CC=CC2=C1 9786AH [0,1,0,1,0,0|1,0,0]=3 213 B13R2.328 CC1=NC2=CC=CC=C2C(I)=C1 2842AJ [0,1,0,1,0,0|2,0,0]=4 214 B13R2.328 FC1=CC(Br)=CC2=CC=CC=C12 6609AA [0,1,0,1,0,0|2,0,0]=4 215 B13R2.328 NC1=CC(=O)C2=C(C=CC=C2)O1 1973AL [0,1,0,1,0,0|2,0,0]=4 216 B13R2.328 NC1=CC(=O)C2=CC=CC=C2N1 5894AB [0,1,0,1,0,0|2,0,0]=4 217 B13R2.328 NC1=CC(Br)=CC2=CC=CC=C12 9672AH [0,1,0,1,0,0|2,0,0]=4 218 B13R2.328 NC1=NC(Br)=C2C=CC=CC2=C1 Y7393 [0,1,0,1,0,0|2,0,0]=4 219 B13R2.328 [O-][N+]1=C2C=CC=CC2=CC(Br)=C1 Y8341 [0,1,0,1,0,0|1,0,1]=4 220 B13R2.45 CCC1=C(C)C2=CC=CC=C2O1 2498AC [0,1,0,1,0,0|2,0,0]=4 221 B13R2.45 CCC1CC2=C(C=CC=C2)C1=O 1301AB [0,1,0,1,0,0|0,0,2]=4 222 B13R2.45 CN1C(CN)=CC2=C1C=CC=C2 8110AB [0,1,0,1,0,0|1,0,1]=4 223 B13R2.45 CN1C(CO)=CC2=C1C=CC=C2 8337AH [0,1,0,1,0,0|0,0,2]=4 224 B13R2.45 ClCC1=C(Cl)C2=C(C=CC=C2)S1 2231AJ [0,1,0,1,0,0|2,0,0]=4 225 B13R2.45 N#CC1=C(N)C2=CC=CC=C2C1 5779AJ [0,1,0,1,0,0|1,0,1]=4 226 B13R2.45 O=C1C2=C(C=CC=C2)C\C1=N/O V3441 [0,1,0,1,0,0|1,0,1]=4 227 B13R2.45 O=CC1=C(Br)C2=CC=CC=C2S1 0373AQ [0,1,0,1,0,0|1,0,0]=3 228 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2S1 Z5457 [0,1,0,1,0,0|1,0,0]=3 229 B13R2.369 BrC1=C(I)N=C2C=CC=CC2=C1 Z1044 [0,1,0,1,0,0|2,0,0]=4 230 B13R2.369 CC1=C(Br)C=C2C=CC=NC2=C1 4355AA [0,1,0,1,0,0|2,0,0]=4 231 B13R2.369 CC1=C(Br)N=C2C=CC=CC2=N1 5473AJ [0,1,0,1,0,0|2,0,0]=4 232 B13R2.369 CC1=C(N)C=C2C=CC=CC2=N1 W4438 [0,1,0,1,0,0|2,0,0]=4 233 B13R2.369 CC1=C(N)N=C2C=CC=CC2=C1 1634AC [0,1,0,1,0,0|1,0,0]=3 234 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl 3650AB [0,1,0,1,0,0|2,0,0]=4 235 B13R2.369 CN1CC2=C(C=CC=C2)NC1=O 2084AJ [0,1,0,1,0,0|1,0,1]=4 236 B13R2.369 ClC1=C(Cl)N=C2C=CC=CC2=C1 W7358 [0,1,0,1,0,0|2,0,0]=4 237 B13R2.369 ClC1=C(I)C=C2C=CC=CC2=N1 X9732 [0,1,0,1,0,0|2,0,0]=4 238 B13R2.369 NC1=CC2=CC=CC=C2C=C1I 9743AC [0,1,0,1,0,0|2,0,0]=4 239 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br 6011AC [0,1,0,1,0,0|1,0,0]=3 240 B13R2.369 O=C1NC2=CC=CC=C2C=C1Cl 6012AC [0,1,0,1,0,0|1,0,0]=3 241 B13R2.369 O=C1NC2=CC=CC=C2C=C1O 8747AD [0,1,0,1,0,0|1,0,0]=3 242 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1O 1581AE [0,1,0,1,0,0|2,0,0]=4 243 B13R2.369 OC1=CC2=CC=CC=C2N=C1Cl 5432AA [0,1,0,1,0,0|2,0,0]=4 244 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 6031AC [0,1,0,1,0,0|0,0,2]=4 245 B13R2.435 CC(=O)C1=NC2=CC=CC=C2N1 S727 [0,1,0,1,0,0|2,0,0]=4 246 B13R2.435 NC(=O)C1=CC2=CC=CC=C2S1 7065AE [0,1,0,1,0,0|1,0,0]=3 247 B13R2.435 NC(=O)C1=CC2=CC=CN=C2N1 Y8330 [0,1,0,1,0,0|2,0,0]=4 248 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)O1 1563AJ [0,1,0,1,0,0|2,0,0]=4 249 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)S1 Y2101 [0,1,0,1,0,0|2,0,0]=4 250 B13R2.435 NC(=S)C1=CC2=CC=CC=C2N1 7047AE [0,1,0,1,0,0|1,1,0]=4 251 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 5744AB [0,1,0,1,0,0|0,0,0]=2 252 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 8940AC [0,1,0,1,0,0|2,0,0]=4 253 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 7649AH [0,1,0,1,0,0|2,0,0]=4 254 B13R2.435 OB(O)C1=CC2=CC=CC=C2C1 9857AH [0,1,0,1,0,0|1,0,1]=4 255 B13R2.43 CC1=CC2=C(C=C1)NC(C=O)=N2 3264AJ [0,1,0,1,0,0|2,0,0]=4 256 B13R2.43 CC1=CC2=C(C=C1)SC(C=O)=C2 8888AD [0,1,0,1,0,0|1,0,0]=3 257 B13R2.43 CC1=CC2=NC(C=O)=CN2C=C1 W4272 [0,1,0,1,0,0|2,0,0]=4 258 B13R2.43 CC1=CC=C2NC(C=O)=NC2=C1 0537AD [0,1,0,1,0,0|2,0,0]=4 259 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)S1 9916AA [0,1,0,1,0,0|1,0,0]=3 260 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)N1 Z2968 [0,1,0,1,0,0|1,0,0]=3 261 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)S1 9146AD [0,1,0,1,0,0|1,0,0]=3 262 B13R2.43 O=CC1=CC2=C(C=CC(F)=C2)N1 1193AB [0,1,0,1,0,0|1,0,0]=3 263 B13R2.43 O=CC1=CC2=CC(Br)=CC=C2O1 Y8365 [0,1,0,1,0,0|1,0,0]=3 264 B13R2.43 O=CC1=CC2=CC(Br)=CC=C2S1 1358AC [0,1,0,1,0,0|1,0,0]=3 265 B13R2.43 O=CC1=CN2C=C(Cl)C=CC2=N1 5981AH [0,1,0,1,0,0|2,0,0]=4 266 B13R2.43 O=CC1=CN2C=CC(Br)=CC2=N1 0504AA [0,1,0,1,0,0|2,0,0]=4 267 B13R2.43 O=CC1=NC2=CC(Br)=CC=C2S1 Y5620 [0,1,0,1,0,0|2,0,0]=4 268 B13R2.43 O=CC1=NC2=CC=C(Br)C=C2N1 3440AJ [0,1,0,1,0,0|2,0,0]=4 269 B13R2.43 O=CC1=NC2=CC=C(Cl)C=C2N1 3495AJ [0,1,0,1,0,0|2,0,0]=4 270 B13R2.3028 CC1=C(C)C2=C(C=CC(N)=C2)N1 5357AD [0,1,0,1,0,0|2,0,0]=4 271 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 7444AB [0,1,0,1,0,0|2,0,0]=4 272 B13R2.3028 CC1CC2=C(C=C(Br)C=C2)C1=O V3829 [0,1,0,1,0,0|0,0,2]=4 273 B13R2.3028 CN1CC2=C(C=C(N)C=C2)C1=O 8222AE [0,1,0,1,0,0|1,0,1]=4 274 B13R2.3028 NC1=CC2=C(C=C1)NC(=O)C2=O 5907AB [0,1,0,1,0,0|2,0,0]=4 275 B13R2.3683 CC1=CC2=C(C=C1)C=C(F)C=C2 3624AB [0,1,0,1,0,0|1,0,0]=3 276 B13R2.3683 CC1=CC2=CC=C(O)C=C2C=C1 9205AA [0,1,0,1,0,0|1,0,0]=3 277 B13R2.3683 ClC1=CC2=C(C=C1)C=C(Cl)C=C2 0591AB [0,1,0,1,0,0|2,0,0]=4 278 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2C=C1 X2007 [0,1,0,1,0,0|2,0,0]=4 279 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2N=C1 4689AA [0,1,0,1,0,0|2,0,0]=4 280 B13R2.3683 FC1=CC2=CC=C(Br)C=C2C=C1 X0176 [0,1,0,1,0,0|2,0,0]=4 281 B13R2.3683 NC1=CC2=C(C=C(Br)C=C2)N=C1 5261AA [0,1,0,1,0,0|2,0,0]=4 282 B13R2.3683 NC1=CC2=C(C=C(Cl)C=C2)N=C1 3352AA [0,1,0,1,0,0|2,0,0]=4 283 B13R2.3683 NC1=CC2=C(C=C1)C=C(Br)C=C2 1114AC [0,1,0,1,0,0|2,0,0]=4 284 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 6736AA [0,1,0,1,0,0|2,0,0]=4 285 B13R2.54 CC1=CC=CC2=C1NC(C=O)=C2 6013AD [0,1,0,1,0,0|1,0,0]=3 286 B13R2.54 CC1=CC=CN2C=C(C=O)N=C12 W3139 [0,1,0,1,0,0|2,0,0]=4 287 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2N1 6518AA [0,1,0,1,0,0|1,0,0]=3 288 B13R2.54 O=CC1=CN2C=CC=C(Cl)C2=N1 4225AC [0,1,0,1,0,0|2,0,0]=4 289 B13R2.155 BrC1=CC2=CC(I)=CN=C2C=C1 Y2863 [0,1,0,1,0,0|2,0,0]=4 290 B13R2.155 BrC1=CN=C2C=CC(Br)=CC2=C1 0683AC [0,1,0,1,0,0|2,0,0]=4 291 B13R2.155 CC1=CC2=C(C=CC(=O)O2)C=C1 8231AD [0,1,0,1,0,0|2,0,0]=4 292 B13R2.155 CC1=CC2=C(C=CC(=O)O2)C=C1 8231AE [0,1,0,1,0,0|2,0,0]=4 293 B13R2.155 CC1=CC2=CC(Br)=CC=C2C=C1 9790AA [0,1,0,1,0,0|1,0,0]=3 294 B13R2.155 CC1=CC2=CC(Cl)=CC=C2C=N1 6863AA [0,1,0,1,0,0|2,0,0]=4 295 B13R2.155 CC1=CC2=NC(C)=CC=C2C=C1 5835AC [0,1,0,1,0,0|2,0,0]=4 296 B13R2.155 CC1=NC2=CC(O)=CC=C2C=C1 8385AA [0,1,0,1,0,0|2,0,0]=4 297 B13R2.155 NC1=CC2=CC(Br)=CC=C2N=C1 3484AJ [0,1,0,1,0,0|2,0,0]=4 298 B13R2.155 NC1=CC2=CC(Cl)=CC=C2N=C1 1182AA [0,1,0,1,0,0|2,0,0]=4 299 B13R2.155 OC1=CC2=CC(Br)=CC=C2N=C1 Z4874 [0,1,0,1,0,0|2,0,0]=4 300 B13R2.155 OC1=CC=C2N=CC(Br)=CC2=C1 Z4121 [0,1,0,1,0,0|2,0,0]=4 301 B13R2.155 SC1=CC=C2C=CC(S)=CC2=C1 8663AE [0,1,0,1,0,0|2,0,0]=4 302 B13R2.4856 O=C1NC2=C(C1=O)C(F)=CC=C2 X7069 [0,1,0,1,0,0|2,0,0]=4 303 B13R2.5179 CC1=CC2=CC=CC(C)=C2C=C1 5914AE [0,1,0,1,0,0|1,0,0]=3 304 B13R2.5179 CC1=CC2=NC=CC(Cl)=C2C=C1 9599AB [0,1,0,1,0,0|2,0,0]=4 305 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 3093AL [0,1,0,1,0,0|2,0,0]=4 306 B13R2.5179 NC1=C2C=CC(O)=CC2=CC=C1 6750AL [0,1,0,1,0,0|2,0,0]=4 307 B13R2.5179 OC1=CC=CC2=C1N=CC(Cl)=C2 2407AL [0,1,0,1,0,0|2,0,0]=4 308 B13R2.5179 OC1=CC=CC2=CC(Br)=CC=C12 5253AC [0,1,0,1,0,0|2,0,0]=4 309 B13R2.5190 CC1=CC2=CC(N)=CC=C2N1C 1760AC [0,1,0,1,0,0|2,0,0]=4 310 B13R2.5190 CC1CC2=C(C=CC(Br)=C2)C1=O 3122AJ [0,1,0,1,0,0|0,0,2]=4 311 B13R2.5190 CC1CC2=C(C=CC(F)=C2)C1=O P434 [0,1,0,1,0,0|0,0,2]=4 312 B13R2.5190 O=C1NC2=C(C=CC(I)=C2)C1=O 0637AB [0,1,0,1,0,0|2,0,0]=4 313 B13R2.162 CC1=CC2=C(Br)C=CN=C2C=C1 Z6916 [0,1,0,1,0,0|2,0,0]=4 314 B13R2.162 CC1=CC2=C(C=CC=C2Br)N=C1 5231AB [0,1,0,1,0,0|1,0,0]=3 315 B13R2.162 CC1=CC2=C(C=CN=C2O)C=C1 6494AJ [0,1,0,1,0,0|2,0,0]=4 316 B13R2.162 CC1=CC2=C(Cl)C=CN=C2C=C1 V3946 [0,1,0,1,0,0|2,0,0]=4 317 B13R2.162 CC1=CC2=C(Cl)N=CC=C2C=C1 V4620 [0,1,0,1,0,0|2,0,0]=4 318 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 Z3892 [0,1,0,1,0,0|2,0,0]=4 319 B13R2.162 OC1=CC2=C(C=CC=C2Br)C=C1 9029AE [0,1,0,1,0,0|2,0,0]=4 320 B13R2.162 OC1=CC=C2C=CC=C(F)C2=C1 6737AA [0,1,0,1,0,0|2,0,0]=4 321 B13R2.4825 CC1CC2=C(Br)C=CC=C2C1=O 9045AA [0,1,0,1,0,0|0,0,2]=4 322 B13R2.4825 CN1CC2=C(C=CC=C2Br)C1=O Y9109 [0,1,0,1,0,0|1,0,1]=4 323 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,0,0,0,1,0|1,0,1]=4 324 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,0,0,0,1,0|1,0,1]=4 325 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,0,0,0,1,0|2,0,0]=4 326 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [1,0,0,0,1,0|2,0,0]=4 327 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [1,0,0,0,1,0|2,0,0]=4 328 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [1,0,0,0,1,0|2,0,0]=4 329 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [1,0,0,0,1,0|2,0,0]=4 330 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [1,0,0,0,1,0|1,0,1]=4 331 B9R1.13 CC(=O)NC1=CC=CS1 D141 [1,0,0,0,1,0|2,0,0]=4 332 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [1,0,0,0,1,0|1,0,1]=4 333 B9R1.11 O=CC(=O)C1=CC=CO1 8783AA [0,0,0,0,2,0|2,0,0]=4 334 B9R1.11 O=CC(=O)C1=CC=CS1 W3018 [0,0,0,0,2,0|2,0,0]=4