0 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [0,0,0,0,0,0|3,0,1]=4 2 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [0,0,0,0,0,0|2,0,1]=3 3 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [0,0,0,0,0,0|1,0,2]=3 4 B10R1.18 CC(C)CC1=CC=CC=N1 9571AB [0,0,0,0,0,0|2,0,0]=2 5 B10R1.18 CC(C)CC1=CC=NC=C1 6191AJ [0,0,0,0,0,0|2,0,0]=2 6 B10R1.18 CC(C)CC1=NC=CN=C1 R582 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.18 CC(N)CC1=CC=CC=N1 4560AE [0,0,0,0,0,0|1,0,0]=1 8 B10R1.18 CC(N)CC1=CN=CC=N1 4220AC [0,0,0,0,0,0|2,0,0]=2 9 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [0,0,0,0,0,0|2,0,0]=2 10 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [0,0,0,0,0,0|1,0,0]=1 11 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [0,0,0,0,0,0|1,0,0]=1 12 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [0,0,0,0,0,0|1,0,1]=2 13 B10R1.18 N=C(N)CC1=NC=CC=C1 0398AD [0,0,0,0,0,0|2,0,1]=3 14 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [0,0,0,0,0,0|1,0,1]=2 15 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [0,0,0,0,0,0|3,0,1]=4 17 B9R1.8 BrCCC1=CC=CC=N1 5125AB [1,0,0,0,0,0|2,0,0]=3 18 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [1,0,0,0,0,0|1,0,0]=2 19 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [1,0,0,0,0,0|1,0,0]=2 20 B9R1.8 CCNC1=NC=CN=C1 Z2415 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.8 CNCC1=CC=CC=C1 3855AD [1,0,0,0,0,0|1,0,0]=2 22 B9R1.8 CNCC1=CC=CC=N1 7146AD [1,0,0,0,0,0|2,0,0]=3 23 B9R1.8 CNCC1=CC=NC=N1 6023AD [1,0,0,0,0,0|3,0,0]=4 24 B9R1.8 CNCC1=NC=CC=N1 X8879 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.8 CNCC1=NC=CN=C1 X9439 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.8 CNNC1=CC=CC=C1 V2456 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [1,0,0,0,0,0|0,0,2]=3 28 B9R1.8 ClCCC1=NC=CC=C1 X6257 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.8 N#CCC1=CC=NC=C1 Z9553 [1,0,0,0,0,0|1,0,2]=4 30 B9R1.8 N#CC[N+]1=CC=CC=C1 8359AL [1,0,0,0,0,0|1,0,2]=4 31 B9R1.8 NCCC1=CC=CN=C1 5033AC [1,0,0,0,0,0|1,0,0]=2 32 B9R1.8 NCCC1=CN=CC=N1 1878AJ [1,0,0,0,0,0|2,0,0]=3 33 B9R1.8 NCCC1=NC=CN=C1 Y9352 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 NNCC1=CC=CC=N1 4874AC [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 NNCC1=CN=CN=C1 2736AD [1,0,0,0,0,0|3,0,0]=4 36 B9R1.8 NOCC1=CC=CN=C1 7306AJ [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 OCCC1=CN=CN=C1 W8980 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 OCCC1=NC=CN=C1 Z5014 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.8 [N-]=[N+]=NC1=CC=CC=C1 0023AQ [1,0,0,0,0,0|2,0,1]=4 40 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.20 CC1=CC=C(N=C(N)N)C=C1 7745AB [0,1,0,0,0,0|2,0,1]=4 47 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,1,0,0,0,0|2,0,1]=4 48 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [0,1,0,0,0,0|2,0,1]=4 49 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [0,1,0,0,0,0|2,0,1]=4 50 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 V6143 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 6320AE [0,1,0,0,0,0|1,0,1]=3 52 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,1,0,0,0,0|2,0,1]=4 53 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [0,1,0,0,0,0|1,0,1]=3 54 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,1,0,0,0,0|2,0,1]=4 55 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 4488AD [0,1,0,0,0,0|1,0,1]=3 56 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,1,0,0,0,0|2,0,1]=4 57 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 6322AB [0,1,0,0,0,0|2,0,1]=4 58 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [0,1,0,0,0,0|1,0,0]=2 60 B11R1.36 CC(C)C(N)C1=CC=CC=N1 9319AH [0,1,0,0,0,0|2,0,0]=3 61 B11R1.36 CC(C)C(N)C1=CC=NC=C1 1775AJ [0,1,0,0,0,0|2,0,0]=3 62 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [0,1,0,0,0,0|1,0,1]=3 64 B11R1.36 O=C(C1=CC=CC=C1)C(Cl)Cl L006 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.36 O=C(C1=CC=CC=C1)C(F)F 2418AE [0,1,0,0,0,0|2,0,1]=4 66 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [0,1,0,0,0,0|2,0,1]=4 67 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [0,1,0,0,0,0|0,0,1]=2 68 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [0,1,0,0,0,0|1,0,1]=3 69 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,1,0,0,0,0|0,0,0]=1 70 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.40 CC(CN)OC1=CC=CN=C1 2002AF [0,1,0,0,0,0|2,0,0]=3 72 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,1,0,0,0,0|2,0,1]=4 73 B11R1.40 CNC(=O)CC1=CN=CC=C1 8304AC [0,1,0,0,0,0|2,0,1]=4 74 B11R1.40 CNC(=S)NC1=CC=CC=C1 S792 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.40 CNC(C)CC1=NC=CN=C1 3718AF [0,1,0,0,0,0|2,0,0]=3 76 B11R1.40 COC(=O)CC1=CC=CN=C1 7040AJ [0,1,0,0,0,0|2,0,1]=4 77 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 5715AL [0,1,0,0,0,0|1,0,2]=4 78 B11R1.40 N#CC(F)SC1=CC=CC=C1 7940AL [0,1,0,0,0,0|2,0,1]=4 79 B11R1.40 NCC(=O)NC1=CC=CC=C1 4165AE [0,1,0,0,0,0|2,0,1]=4 80 B11R1.40 NNC(=O)CC1=CC=NC=C1 Y5522 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [0,1,0,0,0,0|1,0,1]=3 82 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [0,1,0,0,0,0|1,0,1]=3 83 B11R1.86 CC(C)CC1=C(N)C=CC=C1 5195AJ [0,1,0,0,0,0|1,0,0]=2 84 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7575AH [0,1,0,0,0,0|2,0,1]=4 85 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7576AH [0,1,0,0,0,0|2,0,1]=4 86 B11R1.86 CC1=CC=CN=C1CC(C)O 9155AE [0,1,0,0,0,0|2,0,0]=3 87 B11R1.86 CN(C)CC1=C(F)C=CC=C1 1557AB [0,1,0,0,0,0|2,0,0]=3 88 B11R1.86 CN(C)CC1=C(N)C=CC=C1 9911AA [0,1,0,0,0,0|2,0,0]=3 89 B11R1.86 CN(C)CC1=C(O)C=CC=C1 8448AD [0,1,0,0,0,0|2,0,0]=3 90 B11R1.86 N=C(N)CC1=CC=CC=C1Br 3452AD [0,1,0,0,0,0|1,0,1]=3 91 B11R1.86 N=C(N)NC1=C(F)C=CC=C1 5657AB [0,1,0,0,0,0|2,0,1]=4 92 B11R1.86 NC(=S)CC1=CC=CC=C1Br Z6609 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.86 NC(=S)NC1=CC=CC=C1Br V6496 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [0,1,0,0,0,0|1,0,1]=3 95 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [0,1,0,0,0,0|1,0,1]=3 96 B11R1.157 CC(=O)CC1=NC(C)=CC=C1 9512AH [0,1,0,0,0,0|2,0,1]=4 97 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 3153AE [0,1,0,0,0,0|2,0,1]=4 98 B11R1.157 CC(C)NC1=NC(Br)=CC=C1 V8760 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.157 CC(C)OC1=CC=CC(Br)=N1 V6058 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.157 CC1=CC=CC(CC(C)N)=N1 1063AC [0,1,0,0,0,0|1,0,0]=2 101 B11R1.157 CC1=CC=CC(CC(C)O)=N1 7595AE [0,1,0,0,0,0|2,0,0]=3 102 B11R1.157 FC1=CC=CC(OC(F)F)=C1 1093AE [0,1,0,0,0,0|3,0,0]=4 103 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 9927AB [0,1,0,0,0,0|1,0,1]=3 104 B11R1.157 N=C(N)NC1=CC(Cl)=CC=C1 9218AB [0,1,0,0,0,0|2,0,1]=4 105 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 2129AB [0,1,0,0,0,0|2,0,1]=4 106 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [0,1,0,0,0,0|2,0,1]=4 107 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 5351AA [0,1,0,0,0,0|2,0,0]=3 108 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7156AL [0,1,0,0,0,0|2,0,0]=3 109 B11R1.509 C[Si](C)(C)OC1=CC=CC=C1 9306AL [0,1,0,0,0,0|2,1,0]=4 110 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 7150AL [0,1,0,0,0,0|1,1,0]=3 111 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [0,0,0,1,0,0|0,0,0]=1 112 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [0,0,0,1,0,0|0,0,0]=1 113 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [0,0,0,1,0,0|0,0,0]=1 114 B11R2.10 CC1=CC2=C(C=CC=C2)O1 X5959 [0,0,0,1,0,0|1,0,2]=4 115 B11R2.10 CC1=CC2=NC=CC=C2N1 W8141 [0,0,0,1,0,0|1,0,2]=4 116 B11R2.10 IC1=CC2=CC=CC=C2N1 2333AB [0,0,0,1,0,0|1,0,2]=4 117 B11R2.10 S=C1CC2=C(C=CC=C2)N1 6726AB [0,0,0,1,0,0|1,0,1]=3 118 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [0,0,0,0,1,0|1,0,0]=2 119 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [0,0,0,0,1,0|3,0,0]=4 120 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [0,0,0,0,1,0|3,0,0]=4 121 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [0,0,0,0,1,0|3,0,0]=4 122 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [0,0,0,0,1,0|3,0,0]=4 123 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [0,0,0,0,1,0|2,0,0]=3 124 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [0,0,0,0,1,0|3,0,0]=4 125 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [0,0,0,0,1,0|1,0,0]=2 126 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [0,0,0,0,1,0|1,0,0]=2 127 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [0,0,0,0,1,0|1,0,0]=2 128 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [0,0,0,0,1,0|3,0,0]=4 129 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [0,0,0,0,1,0|3,0,0]=4 130 B9R1.6 FC(F)C1=CC=NC=C1 0239AF [0,0,0,0,1,0|3,0,0]=4 131 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [0,0,0,0,1,0|1,0,1]=3 132 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [0,0,0,0,1,0|2,0,1]=4 133 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [0,0,0,0,1,0|2,0,1]=4 134 B9R1.13 CC(C)CN1C=CC=N1 Z0808 [0,0,0,0,1,0|3,0,0]=4 135 B9R1.13 CC(N)CC1=CC=CO1 8493AB [0,0,0,0,1,0|1,0,0]=2 136 B9R1.13 CC(N)CN1C=CN=C1 5070AH [0,0,0,0,1,0|2,0,0]=3 137 B9R1.13 CC(N)CN1C=NC=N1 1709AF [0,0,0,0,1,0|3,0,0]=4 138 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [0,0,0,0,1,0|2,0,0]=3 139 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [0,0,0,0,1,0|2,0,1]=4 140 B9R1.13 CN(C)CC1=CC=CS1 2203AB [0,0,0,0,1,0|3,0,0]=4 141 B9R1.13 N=C(N)CC1=CC=CS1 7341AE [0,0,0,0,1,0|2,0,1]=4 142 B9R1.13 NC(=O)CC1=CSC=C1 V2784 [0,0,0,0,1,0|2,0,1]=4 143 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [0,0,0,0,0,1|0,0,2]=3 144 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [0,0,0,0,0,1|0,0,2]=3 145 B11R1.91 CC(=O)OCC1=CC=NC=C1 N216 [0,0,0,0,0,1|2,0,1]=4 146 B11R1.91 CC(C)NCC1=CN=CC=C1 7190AJ [0,0,0,0,0,1|2,0,0]=3 147 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [0,0,0,0,0,1|1,0,0]=2 148 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [0,0,0,0,0,1|0,0,0]=1 149 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [0,0,0,0,0,1|1,0,1]=3 150 B11R1.91 N=C(N)COC1=CC=CC=C1 0368AC [0,0,0,0,0,1|1,0,1]=3 151 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2381AJ [0,0,0,0,0,1|1,0,2]=4 152 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2382AJ [0,0,0,0,0,1|1,0,2]=4 153 B11R1.91 NC(=O)C#CC1=CC=CC=C1 2477AL [0,0,0,0,0,1|1,0,2]=4 154 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [0,0,0,0,0,1|2,0,1]=4 155 B11R1.91 NC(=O)CNC1=CC=CC=C1 V4420 [0,0,0,0,0,1|1,0,1]=3 156 B11R1.91 NC(N)=NCC1=CC=CC=C1 7568AD [0,0,0,0,0,1|1,0,1]=3 157 B8R1.2 BrCC1=CC=NC=C1 V2331 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [2,0,0,0,0,0|2,0,0]=4 159 B8R1.2 CC[N+]1=CC=CC=C1 E438 [2,0,0,0,0,0|1,0,0]=3 160 B8R1.2 FCC1=CC=NC=C1 2557AL [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 ICC1=CN=CC=C1 5715AJ [2,0,0,0,0,0|2,0,0]=4 162 B8R1.2 NCC1=CC=CC=C1 7149AL [2,0,0,0,0,0|0,0,0]=2 163 B8R1.2 NCC1=CC=NC=N1 Y7101 [2,0,0,0,0,0|2,0,0]=4 164 B8R1.2 NCC1=CC=NN=C1 X9904 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.2 NCC1=CN=NC=C1 0175AP [2,0,0,0,0,0|2,0,0]=4 166 B8R1.2 NNC1=CC=NC=C1 0864AQ [2,0,0,0,0,0|2,0,0]=4 167 B8R1.2 NOC1=CC=CC=C1 X4801 [2,0,0,0,0,0|1,0,0]=3 168 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [2,0,0,0,0,0|2,0,0]=4 169 B8R1.2 ONC1=CC=CC=C1 0019AQ [2,0,0,0,0,0|2,0,0]=4 170 B8R1.2 SCC1=CC=CN=C1 Z2753 [2,0,0,0,0,0|2,0,0]=4 171 B10R1.1 C=CCC1=CC=C(C)C=C1 1127AQ [1,1,0,0,0,0|0,0,2]=4 172 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [1,1,0,0,0,0|0,0,2]=4 173 B10R1.1 CC1=CC=C(CNN)C=C1 8497AC [1,1,0,0,0,0|1,0,0]=3 174 B10R1.1 CC1=CC=C(SCCl)C=C1 7374AL [1,1,0,0,0,0|2,0,0]=4 175 B10R1.1 CC1=NC=C(CCO)C=C1 0118AA [1,1,0,0,0,0|2,0,0]=4 176 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [1,1,0,0,0,0|0,0,0]=2 177 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [1,1,0,0,0,0|0,0,0]=2 178 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [1,1,0,0,0,0|1,0,0]=3 179 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [1,1,0,0,0,0|1,0,0]=3 180 B10R1.1 CCNC1=NC=C(Br)C=C1 W8816 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.1 CCOC1=CN=C(Cl)C=C1 Z5197 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.1 CNCC1=CC=C(N)C=C1 Q169 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [1,1,0,0,0,0|1,0,0]=3 184 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [1,1,0,0,0,0|0,0,0]=2 185 B10R1.1 NNCC1=CC=C(F)C=C1 0826AC [1,1,0,0,0,0|1,0,0]=3 186 B10R1.1 NOCC1=CC=C(Br)C=C1 5547AB [1,1,0,0,0,0|1,0,0]=3 187 B10R1.4 C=CCC1=C(Cl)C=CC=C1 7969AA [1,1,0,0,0,0|0,0,2]=4 188 B10R1.4 C=CCC1=CC=CC=C1Br 0424AQ [1,1,0,0,0,0|0,0,2]=4 189 B10R1.4 CC1=C(CCN)N=CC=C1 3182AC [1,1,0,0,0,0|1,0,0]=3 190 B10R1.4 CC1=CC=CC=C1CNN 4794AE [1,1,0,0,0,0|1,0,0]=3 191 B10R1.4 CCCC1=C(Br)C=NC=N1 V9533 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.4 CCCC1=C(C)C=CC=C1 4903AL [1,1,0,0,0,0|0,0,0]=2 193 B10R1.4 CCNC1=C(N)C=CC=C1 8052AD [1,1,0,0,0,0|1,0,0]=3 194 B10R1.4 CCNC1=C(N)C=CC=N1 0189AE [1,1,0,0,0,0|2,0,0]=4 195 B10R1.4 CCOC1=C(Br)C=NC=C1 V5422 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.4 CCOC1=CC=CNC1=O 5869AJ [1,1,0,0,0,0|2,0,0]=4 197 B10R1.4 CCOC1=NC=CC=C1F 3378AC [1,1,0,0,0,0|2,0,0]=4 198 B10R1.4 CCSC1=CC=CC=C1Br I195 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.4 CNCC1=C(C)C=CC=N1 1508AF [1,1,0,0,0,0|2,0,0]=4 200 B10R1.4 NCCC1=CC=CC=C1N W6472 [1,1,0,0,0,0|0,0,0]=2 201 B10R1.4 NNCC1=CC=CC=C1Cl 3182AF [1,1,0,0,0,0|1,0,0]=3 202 B10R1.4 NNCC1=CC=CC=C1Cl 4668AE [1,1,0,0,0,0|1,0,0]=3 203 B10R1.4 NNCC1=CC=CC=C1F W6669 [1,1,0,0,0,0|1,0,0]=3 204 B10R1.4 NOCC1=CC=CC=C1I 3260AC [1,1,0,0,0,0|1,0,0]=3 205 B10R1.4 ONCC1=CC=CC=C1F Z3766 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.10 C=CCC1=CC=CC(C)=C1 0989AQ [1,1,0,0,0,0|0,0,2]=4 207 B10R1.10 CC1=CC(CCBr)=CC=C1 0637AQ [1,1,0,0,0,0|1,0,0]=3 208 B10R1.10 CC1=NC(CCN)=CC=C1 X7037 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.10 CCCC1=CC(C)=CC=C1 4908AL [1,1,0,0,0,0|0,0,0]=2 210 B10R1.10 CCCC1=CC(O)=CC=N1 2583AA [1,1,0,0,0,0|1,0,0]=3 211 B10R1.10 CCNC1=NC(Br)=CC=C1 V7492 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.10 CCNC1=NC=CC(N)=C1 W9213 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.10 CCOC1=CC(=O)C=CN1 0560AA [1,1,0,0,0,0|2,0,0]=4 214 B10R1.10 CCOC1=CC(C)=NC=C1 V3972 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.10 CCOC1=CC(F)=NC=C1 9218AA [1,1,0,0,0,0|2,0,0]=4 216 B10R1.10 CCOC1=CC(N)=CN=C1 7168AB [1,1,0,0,0,0|2,0,0]=4 217 B10R1.10 CCOC1=CC(S)=CC=C1 L529 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.10 CCOC1=CC=CC(N)=N1 Y4042 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.10 CCOC1=CC=NC(Cl)=C1 R739 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.10 CNCC1=CC(O)=CC=C1 2952AD [1,1,0,0,0,0|1,0,0]=3 221 B10R1.10 CNCC1=NC(C)=CC=C1 0779AC [1,1,0,0,0,0|2,0,0]=4 222 B10R1.10 CNCC1=NC=CC(C)=C1 8285AC [1,1,0,0,0,0|2,0,0]=4 223 B10R1.10 NCCC1=CC(N)=CC=C1 1934AJ [1,1,0,0,0,0|0,0,0]=2 224 B10R1.10 NCCC1=CC(N)=CC=C1 4022AC [1,1,0,0,0,0|0,0,0]=2 225 B10R1.10 NCCC1=CC=CC(Br)=N1 5436AB [1,1,0,0,0,0|1,0,0]=3 226 B10R1.10 NCCC1=CC=CC(O)=C1 E330 [1,1,0,0,0,0|0,0,0]=2 227 B10R1.10 NCCC1=NC(Br)=CC=C1 5025AA [1,1,0,0,0,0|1,0,0]=3 228 B10R1.10 NNCC1=CC(F)=CC=C1 4670AE [1,1,0,0,0,0|1,0,0]=3 229 B10R1.10 NOCC1=CC(Cl)=CC=C1 3026AB [1,1,0,0,0,0|1,0,0]=3 230 B10R1.10 O=C1C=C(CCO)C=CC1 V0891 [1,1,0,0,0,0|1,0,1]=4 231 B10R1.10 O=CCC1=CC=CC(Br)=C1 Y7020 [1,1,0,0,0,0|1,0,1]=4 232 B10R1.10 OCCC1=CC=NC(Cl)=C1 1041AJ [1,1,0,0,0,0|2,0,0]=4 233 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [1,1,0,0,0,0|0,0,2]=4 234 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [1,1,0,0,0,0|0,0,2]=4 235 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [1,1,0,0,0,0|1,0,1]=4 237 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [1,1,0,0,0,0|0,0,0]=2 238 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [1,1,0,0,0,0|0,0,0]=2 239 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [1,1,0,0,0,0|1,0,0]=3 240 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [1,1,0,0,0,0|1,0,0]=3 241 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [1,1,0,0,0,0|1,0,0]=3 242 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [1,1,0,0,0,0|1,0,1]=4 243 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [1,1,0,0,0,0|1,0,0]=3 244 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [1,1,0,0,0,0|1,0,0]=3 245 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.15 NC(CO)C1=CC=NC=C1 1467AJ [1,1,0,0,0,0|2,0,0]=4 247 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [1,1,0,0,0,0|1,0,1]=4 248 B10R1.15 NCC(O)C1=CC=CC=N1 1453AJ [1,1,0,0,0,0|1,0,0]=3 249 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [1,1,0,0,0,0|1,0,0]=3 250 B10R1.15 NCC(O)C1=NC=CC=C1 9384AJ [1,1,0,0,0,0|1,0,0]=3 251 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [1,1,0,0,0,0|0,0,0]=2 252 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [1,1,0,0,0,0|1,0,0]=3 253 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.17 CCCCC1=CC=CN=C1 X7086 [1,1,0,0,0,0|1,0,0]=3 255 B10R1.17 CCCCC1=NC=CC=C1 S413 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.17 CCNCC1=CC=CN=C1 Y5832 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.17 CNCCC1=CC=CN=C1 7424AH [1,1,0,0,0,0|1,0,0]=3 258 B10R1.17 CNCCC1=CC=NC=C1 5552AE [1,1,0,0,0,0|1,0,0]=3 259 B10R1.17 CNCCC1=CC=NC=C1 X8552 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.17 CNCCC1=CN=CC=C1 6627AD [1,1,0,0,0,0|1,0,0]=3 261 B10R1.17 COCCC1=NC=CC=C1 4987AL [1,1,0,0,0,0|1,0,0]=3 262 B10R1.17 N#CCCC1=CC=CC=N1 1449AE [1,1,0,0,0,0|1,0,1]=4 263 B10R1.17 N#CCCC1=CC=NC=C1 2937AC [1,1,0,0,0,0|1,0,1]=4 264 B10R1.17 NCC#CC1=CC=CC=C1 1105AQ [1,1,0,0,0,0|0,0,1]=3 265 B10R1.17 NCCCC1=CC=CC=N1 7820AA [1,1,0,0,0,0|1,0,0]=3 266 B10R1.17 NCCNC1=CC=CC=N1 1624AC [1,1,0,0,0,0|1,0,0]=3 267 B10R1.17 NCCNC1=CC=CN=C1 4424AJ [1,1,0,0,0,0|1,0,0]=3 268 B10R1.17 NCCNC1=NC=CC=N1 4050AD [1,1,0,0,0,0|2,0,0]=4 269 B10R1.17 NCCOC1=CC=CN=C1 Z4583 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.17 NCCOC1=CC=NC=C1 1280AJ [1,1,0,0,0,0|1,0,0]=3 271 B10R1.17 NCCOC1=CC=NC=C1 2194AB [1,1,0,0,0,0|1,0,0]=3 272 B10R1.17 NCCSC1=CC=CC=C1 6800AD [1,1,0,0,0,0|0,0,0]=2 273 B10R1.17 NCCSC1=CC=CC=N1 3135AE [1,1,0,0,0,0|1,0,0]=3 274 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [1,1,0,0,0,0|1,0,1]=4 275 B10R1.17 OCCCC1=NC=CC=C1 5625AJ [1,1,0,0,0,0|1,0,0]=3 276 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [0,1,0,0,1,0|1,0,1]=4 277 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,1,0,0,1,0|1,0,1]=4 278 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,1,0,0,1,0|1,0,1]=4 279 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [0,1,0,0,1,0|1,0,0]=3 280 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [0,1,0,0,1,0|2,0,0]=4 281 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [0,1,0,0,1,0|1,0,0]=3 282 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [0,1,0,0,1,0|2,0,0]=4 283 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,1,0,0,1,0|0,0,0]=2 284 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [0,1,0,0,1,0|0,0,0]=2 285 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [0,1,0,0,1,0|1,0,0]=3 286 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [0,1,0,0,1,0|1,0,0]=3 287 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [0,1,0,0,1,0|1,0,0]=3 288 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [0,1,0,0,1,0|1,0,0]=3 289 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [0,1,0,0,1,0|0,0,0]=2 290 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [0,1,0,0,1,0|2,0,0]=4 291 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [0,1,0,0,1,0|0,0,0]=2 292 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,1,0,0,1,0|0,0,0]=2 293 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [0,1,0,0,1,0|1,0,0]=3 294 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,1,0,0,1,0|0,0,0]=2 295 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [0,1,0,0,1,0|1,0,0]=3 296 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2844AJ [0,1,0,0,1,0|1,0,1]=4 297 B10R1.13 N=C(N)C1=CC=C(N)C=C1 W8418 [0,1,0,0,1,0|1,0,1]=4 298 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [0,1,0,0,1,0|2,0,0]=4 299 B10R1.28 CC(C)(N)C1=CC=NC=C1 5311AJ [0,1,0,0,1,0|1,0,0]=3 300 B10R1.28 CC(F)(F)C1=CC=NC=C1 9493AC [0,1,0,0,1,0|2,0,0]=4 301 B10R1.28 CC(F)(F)C1=CN=CC=C1 9489AC [0,1,0,0,1,0|2,0,0]=4 302 B10R1.28 CC(F)(F)C1=NC=CC=C1 9488AC [0,1,0,0,1,0|2,0,0]=4 303 B10R1.61 C=C(C)C1=C(C)C=CC=C1 5671AL [0,1,0,0,1,0|1,0,1]=4 304 B10R1.61 CC(Br)C1=CC=CC=C1F Y9030 [0,1,0,0,1,0|1,0,0]=3 305 B10R1.61 CC(N)C1=CC=CC=C1Br Z7493 [0,1,0,0,1,0|0,0,0]=2 306 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 6296AA [0,1,0,0,1,0|1,0,0]=3 307 B10R1.61 CC(O)C1=CC=CN=C1N 9393AH [0,1,0,0,1,0|2,0,0]=4 308 B10R1.61 CC1=C(C(C)C)C=CC=C1 8715AL [0,1,0,0,1,0|1,0,0]=3 309 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 3317AC [0,1,0,0,1,0|0,0,0]=2 310 B10R1.61 CC1=CC=CN=C1C(C)N 9674AE [0,1,0,0,1,0|1,0,0]=3 311 B10R1.61 CS(=O)C1=CC=CC=C1Br 8910AE [0,1,0,0,1,0|2,0,0]=4 312 B10R1.61 CS(=O)C1=CC=CC=C1O Z7171 [0,1,0,0,1,0|2,0,0]=4 313 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 8346AH [0,1,0,0,1,0|0,0,0]=2 314 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br 2344AA [0,1,0,0,1,0|0,0,0]=2 315 B10R1.61 C[C@@H](N)C1=CC=CC=C1F X9177 [0,1,0,0,1,0|0,0,0]=2 316 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 N446 [0,1,0,0,1,0|1,0,0]=3 317 B10R1.61 C[C@H](N)C1=CC=CC=C1Br Z4151 [0,1,0,0,1,0|0,0,0]=2 318 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 8791AA [0,1,0,0,1,0|1,0,0]=3 319 B10R1.61 C[C@H](O)C1=CC=CC=C1Br N448 [0,1,0,0,1,0|1,0,0]=3 320 B10R1.61 C[C@H](O)C1=CC=CN=C1N 5914AC [0,1,0,0,1,0|2,0,0]=4 321 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 1622AJ [0,1,0,0,1,0|1,0,1]=4 322 B10R1.61 N=C(N)C1=CC=CC=C1F 1049AC [0,1,0,0,1,0|1,0,1]=4 323 B10R1.61 NC(=S)C1=CC=CC=C1Br 1055AQ [0,1,0,0,1,0|1,0,1]=4 324 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 Y3806 [0,1,0,0,1,0|2,0,0]=4 325 B10R1.113 CC(C)C1=CC=CC(N)=N1 W8437 [0,1,0,0,1,0|2,0,0]=4 326 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 6890AC [0,1,0,0,1,0|2,0,0]=4 327 B10R1.113 CC(N)C1=CC(O)=CC=C1 Y9690 [0,1,0,0,1,0|0,0,0]=2 328 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V5733 [0,1,0,0,1,0|0,0,0]=2 329 B10R1.113 CC1=CC(C(=N)N)=CC=C1 2354AJ [0,1,0,0,1,0|1,0,1]=4 330 B10R1.113 CC1=CC(C(C)N)=NC=C1 5999AE [0,1,0,0,1,0|1,0,0]=3 331 B10R1.113 CC1=CC=CC(C(C)C)=C1 5135AE [0,1,0,0,1,0|1,0,0]=3 332 B10R1.113 CC1=NC(C(C)N)=CC=C1 9513AH [0,1,0,0,1,0|1,0,0]=3 333 B10R1.113 CN(C)C1=CC=CC(N)=C1 2773AB [0,1,0,0,1,0|2,0,0]=4 334 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 W5401 [0,1,0,0,1,0|0,0,0]=2 335 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 Z5107 [0,1,0,0,1,0|0,0,0]=2 336 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 3482AA [0,1,0,0,1,0|1,0,0]=3 337 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 5245AA [0,1,0,0,1,0|1,0,0]=3 338 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 W5400 [0,1,0,0,1,0|0,0,0]=2 339 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 6219AA [0,1,0,0,1,0|1,0,0]=3 340 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 5244AA [0,1,0,0,1,0|1,0,0]=3 341 B10R1.113 FC1=CC(C(Br)Br)=CC=C1 O150 [0,1,0,0,1,0|2,0,0]=4 342 B10R1.113 FC1=CC=CC(C(F)F)=C1 8582AD [0,1,0,0,1,0|2,0,0]=4 343 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 2211AJ [0,1,0,0,1,0|1,0,1]=4 344 B10R1.23 CC(C)C(N)C1=CC=CS1 5649AE [0,1,0,0,1,0|2,0,0]=4 345 B10R1.27 CCC(N)CN1C=CN=C1 V9130 [0,1,0,0,1,0|2,0,0]=4 346 B10R1.27 N[C@H](CO)CC1=CNC=N1 E175 [0,1,0,0,1,0|2,0,0]=4 347 B10R1.54 CC1=CC(CC(C)N)=NN1 7648AC [0,1,0,0,1,0|2,0,0]=4 348 B10R1.54 CC1=CN(CC(C)N)N=C1 7236AC [0,1,0,0,1,0|2,0,0]=4 349 B12R1.21 CC(=O)CCC1=CC=C(Cl)C=C1 1146AE [0,1,0,0,0,1|1,0,1]=4 350 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 0960AQ [0,1,0,0,0,1|1,0,1]=4 351 B12R1.21 CC(C)CNC1=CC=C(Br)C=C1 0111AB [0,1,0,0,0,1|1,0,0]=3 352 B12R1.21 CC(C)CNC1=NC=C(Br)C=C1 9457AD [0,1,0,0,0,1|2,0,0]=4 353 B12R1.21 CC(C)COC1=CC=C(Br)C=C1 Z0494 [0,1,0,0,0,1|1,0,0]=3 354 B12R1.21 CC(C)NCC1=CC=C(N)C=C1 7280AJ [0,1,0,0,0,1|1,0,0]=3 355 B12R1.21 CC(O)CCC1=CC=C(O)C=C1 6197AL [0,1,0,0,0,1|1,0,0]=3 356 B12R1.21 CC1=CC=C(OCC(C)O)C=C1 4293AL [0,1,0,0,0,1|1,0,0]=3 357 B12R1.21 C[C@H](O)CCC1=CC=C(O)C=C1 9964AJ [0,1,0,0,0,1|1,0,0]=3 358 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 6319AE [0,1,0,0,0,1|1,0,1]=4 359 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 0097AE [0,1,0,0,0,1|1,0,1]=4 360 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 1170AJ [0,1,0,0,0,1|1,0,1]=4 361 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 6031AE [0,1,0,0,0,1|1,0,1]=4 362 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 9422AE [0,1,0,0,0,1|1,0,1]=4 363 B12R1.27 CC(CO)NCC1=CC=CC=C1 8255AE [0,1,0,0,0,1|1,0,0]=3 364 B12R1.27 CCC(=O)CCC1=CC=CC=C1 U874 [0,1,0,0,0,1|1,0,1]=4 365 B12R1.27 CCC(O)C#CC1=CC=CC=C1 1009AQ [0,1,0,0,0,1|1,0,1]=4 366 B12R1.27 COC(=O)NCC1=CC=CC=C1 6020AE [0,1,0,0,0,1|1,0,1]=4 367 B12R1.27 N\C(COC1=CC=CC=C1)=N/O 2638AF [0,1,0,0,0,1|1,0,1]=4 368 B12R1.43 CC(=O)C(C)CC1=CC=CC=C1 2082AB [0,1,0,0,0,1|1,0,1]=4 369 B12R1.43 CC(Br)C(=O)NC1=CC=CC=C1 3918AF [0,1,0,0,0,1|1,0,1]=4 370 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 2901AB [0,1,0,0,0,1|1,0,0]=3 371 B12R1.43 CC(C)C(=O)CC1=NC=CC=C1 2329AJ [0,1,0,0,0,1|2,0,0]=4 372 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 7223AD [0,1,0,0,0,1|1,0,1]=4 373 B12R1.43 CC(N)C(=O)NC1=CC=CC=C1 4801AD [0,1,0,0,0,1|0,0,1]=3 374 B12R1.43 CN(C)C(=S)CC1=CC=CC=C1 5910AD [0,1,0,0,0,1|2,0,0]=4 375 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 W6216 [0,1,0,0,0,1|1,0,0]=3 376 B12R1.107 CC(C)CC(N)C1=NC=CC=C1 V7883 [0,1,0,0,0,1|2,0,0]=4 377 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 X9200 [0,1,0,0,0,1|1,0,0]=3 378 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 W6864 [0,1,0,0,0,1|1,0,1]=4 379 B12R1.107 CC(C)NC(C)C1=CC=CC=C1 W4133 [0,1,0,0,0,1|1,0,0]=3 380 B12R1.107 CC(NC(N)=S)C1=CC=CC=C1 V7228 [0,1,0,0,0,1|1,0,1]=4 381 B12R1.107 CN(C)C[C@@H](N)C1=CC=CC=C1 0890AC [0,1,0,0,0,1|2,0,0]=4 382 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 7718AL [0,1,0,0,0,1|2,0,0]=4 383 B12R1.125 CC(=O)CCC1=CC=CC=C1Cl 3201AF [0,1,0,0,0,1|1,0,1]=4 384 B12R1.125 CC(C)CNC1=C(N)C=CC=N1 7592AC [0,1,0,0,0,1|2,0,0]=4 385 B12R1.125 CC(C)COC1=CC=CC=C1N 3123AD [0,1,0,0,0,1|1,0,0]=3 386 B12R1.125 CC(C)SCC1=CC=CC=C1Br Z8854 [0,1,0,0,0,1|1,0,0]=3 387 B12R1.226 C=C(C)COC1=CC(N)=CC=C1 8114AC [0,1,0,0,0,1|1,0,1]=4 388 B12R1.226 CC(=O)CCC1=CC=CC(F)=C1 1147AE [0,1,0,0,0,1|1,0,1]=4 389 B12R1.226 CC1=CC(CNC(C)C)=CC=C1 3093AF [0,1,0,0,0,1|1,0,0]=3 390 B12R1.226 NC(=O)CCC1=CC(Br)=CC=C1 5635AJ [0,1,0,0,0,1|1,0,1]=4 391 B12R1.891 C[Si](C)(C)NCC1=CC=CC=C1 8511AL [0,1,0,0,0,1|1,1,0]=4 392 B12R1.4 C=C(C)CC1=CC=C(OC)C=C1 7091AD [0,2,0,0,0,0|1,0,1]=4 393 B12R1.4 CC(C)NC1=CC=C(C#N)C=C1 V4214 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 7098AC [0,2,0,0,0,0|2,0,0]=4 395 B12R1.4 CC(C)OC1=CC=C(CO)C=C1 1352AL [0,2,0,0,0,0|2,0,0]=4 396 B12R1.4 CC(C)OC1=CC=C(NN)C=C1 8783AH [0,2,0,0,0,0|2,0,0]=4 397 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 V5334 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 Z2397 [0,2,0,0,0,0|1,0,1]=4 399 B12R1.4 COC1=CC=C(NC(C)C)C=C1 8375AA [0,2,0,0,0,0|2,0,0]=4 400 B12R1.19 CC(C)OC1=CC=C(F)C(F)=C1 V4196 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.19 CC(C)OC1=CC=C(N)C(F)=C1 V8041 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.19 N=C(N)CC1=CC(F)=C(F)C=C1 4424AC [0,2,0,0,0,0|1,0,1]=4 403 B12R1.20 CC(=O)C(Br)C1=CC=C(O)C=C1 6547AC [0,2,0,0,0,0|1,0,1]=4 404 B12R1.20 CC(Br)C(=O)C1=CC=C(Cl)C=C1 V8545 [0,2,0,0,0,0|1,0,1]=4 405 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 Y1670 [0,2,0,0,0,0|1,0,1]=4 406 B12R1.20 CC(C)C(N)C1=CC=C(F)C=C1 0986AF [0,2,0,0,0,0|1,0,0]=3 407 B12R1.20 CC(C)[C@@H](N)C1=CC=C(F)C=C1 3800AA [0,2,0,0,0,0|1,0,0]=3 408 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 3802AA [0,2,0,0,0,0|1,0,0]=3 409 B12R1.20 CC(C1=CC=C(Br)C=C1)N(C)C 4167AD [0,2,0,0,0,0|2,0,0]=4 410 B12R1.20 CC(N)C(O)C1=CC=C(O)C=C1 V1268 [0,2,0,0,0,0|0,0,0]=2 411 B12R1.49 CC(CN)OC1=CC=C(F)C=C1 8141AC [0,2,0,0,0,0|1,0,0]=3 412 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 5933AE [0,2,0,0,0,0|1,0,1]=4 413 B12R1.49 CC1=CC=C(OC(C)CN)C=C1 7330AE [0,2,0,0,0,0|1,0,0]=3 414 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 6254AE [0,2,0,0,0,0|2,0,0]=4 415 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 0275AE [0,2,0,0,0,0|1,0,1]=4 416 B12R1.49 NNC(=O)CC1=CC=C(Br)C=C1 5932AE [0,2,0,0,0,0|1,0,1]=4 417 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 C822 [0,2,0,0,0,0|0,0,0]=2 418 B12R1.49 O=CC(Cl)CC1=CC=C(Cl)C=C1 Y6536 [0,2,0,0,0,0|1,0,1]=4 419 B12R1.106 CC(C)(C)SC1=CC=C(Br)C=C1 V4719 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 3475AA [0,2,0,0,0,0|0,0,0]=2 421 B12R1.106 CC(C)(O)CC1=CC=C(Cl)C=C1 Q321 [0,2,0,0,0,0|1,0,0]=3 422 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 7376AE [0,2,0,0,0,0|2,0,0]=4 423 B12R1.106 CC1=CC=C(OC(C)(C)C)C=C1 1467AL [0,2,0,0,0,0|2,0,0]=4 424 B12R1.106 CS(=O)(=O)CC1=CC=C(N)C=C1 8158AD [0,2,0,0,0,0|2,0,0]=4 425 B12R1.233 CC(=O)CC1=CC=C(Cl)C=C1Br 5576AA [0,2,0,0,0,0|1,0,1]=4 426 B12R1.233 CC(C)OC1=C(Cl)C=C(N)C=C1 7320AB [0,2,0,0,0,0|2,0,0]=4 427 B12R1.233 CC(C)OC1=C(N)C=C(F)C=C1 3211AJ [0,2,0,0,0,0|2,0,0]=4 428 B12R1.233 CC(C)OC1=CC=C(Cl)C=C1Br Z0343 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.233 CC(C)OC1=CC=C(F)C=C1Cl V4195 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.233 CC(C)OC1=CC=C(N)C=C1Br Z8827 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.233 CC(C)OC1=CC=C(O)C=C1Cl Y3853 [0,2,0,0,0,0|2,0,0]=4 432 B12R1.233 CC1=CC(Br)=CC=C1OC(C)C Z0826 [0,2,0,0,0,0|2,0,0]=4 433 B12R1.233 CN(C)CC1=CC=C(Br)C=C1Cl Y3726 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.233 CN(C)CC1=CC=C(Br)C=C1F Y3727 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 3740AF [0,2,0,0,0,0|1,0,1]=4 436 B12R1.124 OC(C1=CC=CC=C1Cl)C(Cl)Cl 2651AB [0,2,0,0,0,0|2,0,0]=4 437 B12R1.225 CC(C)C(=O)C1=CC=CC(Br)=C1 V4617 [0,2,0,0,0,0|1,0,1]=4 438 B12R1.225 CC(C)S(=O)C1=CC(Br)=CC=C1 Z9771 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.225 CC1=CC(C(=O)C(C)Br)=CC=C1 V3354 [0,2,0,0,0,0|1,0,1]=4 440 B12R1.478 CC(=O)C(CO)C1=CC=CC=C1 9433AB [0,2,0,0,0,0|1,0,1]=4 441 B12R1.478 N#CC(C(N)=O)C1=CC=CC=C1 2051AC [0,2,0,0,0,0|1,0,1]=4 442 B12R1.564 FC(F)(F)C(Br)C1=CC=CC=C1 3336AE [0,2,0,0,0,0|2,0,0]=4 443 B12R1.564 N[C@@H](C1=CC=CC=C1)C(F)(F)F 9123AH [0,2,0,0,0,0|2,0,0]=4 444 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F W4548 [0,2,0,0,0,0|2,0,0]=4 445 B12R1.564 O[C@H](C1=CC=CC=C1)C(F)(F)F 4126AL [0,2,0,0,0,0|2,0,0]=4 446 B12R1.32 CN(CC#N)CC1=CC=CC=C1 1817AL [0,2,0,0,0,0|1,0,1]=4 447 B12R1.32 N#CCC(=O)CC1=CC=CC=C1 2472AL [0,2,0,0,0,0|1,0,1]=4 448 B12R1.50 CCC(C)OC1=CC(N)=CC=C1 7479AE [0,2,0,0,0,0|2,0,0]=4 449 B12R1.118 COC(CN)CC1=CC=CC=C1 1715AF [0,2,0,0,0,0|0,0,0]=2 450 B12R1.194 CC(C)(C#N)NC1=CC=CC=C1 7424AD [0,2,0,0,0,0|1,0,1]=4 451 B12R1.194 CC(C)(C=O)SC1=CC=CC=C1 7249AE [0,2,0,0,0,0|2,0,0]=4 452 B12R1.371 CNC(=O)CC1=CC=CC=C1Br V3106 [0,2,0,0,0,0|1,0,1]=4 453 B12R1.75 C=C(C)CC1=C(OC)C=CC=C1 3235AF [0,2,0,0,0,0|1,0,1]=4 454 B12R1.75 C=CC1=C(CN(C)C)C=CC=C1 1425AB [0,2,0,0,0,0|2,0,0]=4 455 B12R1.75 CC(C)NC1=CC=CC=C1C#N V3388 [0,2,0,0,0,0|2,0,0]=4 456 B12R1.75 CC(C)OC1=CC=CC=C1CN W4641 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.75 CN(C)CC1=C(C=O)C=CC=C1 6697AD [0,2,0,0,0,0|2,0,0]=4 458 B12R1.75 CN(C)CC1=CC=CC=C1C#N V6457 [0,2,0,0,0,0|2,0,0]=4 459 B12R1.75 CN(C)CC1=CC=CC=C1CN 0145AD [0,2,0,0,0,0|2,0,0]=4 460 B12R1.75 CN(C)CC1=CC=CC=C1CN V6458 [0,2,0,0,0,0|2,0,0]=4 461 B12R1.75 COC1=C(CC(N)=O)C=CC=C1 3093AH [0,2,0,0,0,0|1,0,1]=4 462 B12R1.127 CC(C)CC1=CC(Br)=CC=C1O 3594AC [0,2,0,0,0,0|1,0,0]=3 463 B12R1.127 CC(C)OC1=CC(Br)=CC=C1F Z1147 [0,2,0,0,0,0|2,0,0]=4 464 B12R1.127 CC1=CC=C(Br)C=C1OC(C)C Y3663 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.127 CN(C)CC1=CC(Br)=CC=C1F Z0311 [0,2,0,0,0,0|2,0,0]=4 466 B12R1.224 CC(C)OC1=C(F)C(F)=CC=C1 Y3749 [0,2,0,0,0,0|2,0,0]=4 467 B12R1.1009 CN(C)CC1=C(F)C=CC=C1Br Z9963 [0,2,0,0,0,0|2,0,0]=4 468 B12R1.101 CC(C)OC1=CC(Cl)=CC(Br)=C1 Z8764 [0,2,0,0,0,0|2,0,0]=4 469 B12R1.119 CC(C)(C)SC1=CC(Br)=CC=C1 V2517 [0,2,0,0,0,0|2,0,0]=4 470 B12R1.119 NC1=CC=CC(CS(N)(=O)=O)=C1 0980AE [0,2,0,0,0,0|2,0,0]=4 471 B12R1.438 CC(=O)CC1=CC=CC(C#N)=C1 3203AH [0,2,0,0,0,0|1,0,1]=4 472 B12R1.438 CN(C)CC1=CC=CC(CN)=C1 1880AB [0,2,0,0,0,0|2,0,0]=4 473 B12R1.438 COC1=CC=CC(CC(=N)N)=C1 1110AJ [0,2,0,0,0,0|1,0,1]=4 474 B10R1.66 CC(N)CCC1=CC=CO1 9476AE [0,0,1,1,0,0|1,0,1]=4 475 B10R2.6 C1=CC(C2CC2)=CC=N1 Z0635 [1,0,0,1,0,0|1,0,0]=3 476 B10R2.7 C1=CC2=C(C=C1)CSC2 1903AB [1,0,0,1,0,0|1,0,0]=3 477 B10R2.7 C1=CC2=C(C=N1)CCN2 1361AJ [1,0,0,1,0,0|1,0,0]=3 478 B10R2.7 C1=CC2=C(C=N1)NCC2 1831AC [1,0,0,1,0,0|1,0,0]=3 479 B10R2.7 C1=CN=C2CCNC2=C1 1360AJ [1,0,0,1,0,0|1,0,0]=3 480 B10R2.7 C1=CN=C2CNCC2=C1 V7126 [1,0,0,1,0,0|2,0,0]=4 481 B10R2.7 C1=CN=C2CNCC2=C1 W3225 [1,0,0,1,0,0|2,0,0]=4 482 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 8284AB [0,0,0,1,0,1|1,0,1]=4 483 B12R2.24 CC1CNC2=CC=CC=C2O1 V6799 [0,0,0,1,0,1|1,0,0]=3 484 B12R2.24 CC1COC2=CC=CC=C2N1 0197AE [0,0,0,1,0,1|0,0,0]=2 485 B12R2.24 CN1CCC2=C(C=CC=C2)C1 8158AA [0,0,0,1,0,1|2,0,0]=4 486 B12R2.24 NC1CCC2=C(C=CC=C2)C1 W3803 [0,0,0,1,0,1|0,0,0]=2 487 B12R2.24 NC1CCC2=CC=CC=C2C1 3016AB [0,0,0,1,0,1|0,0,0]=2 488 B12R2.24 NC1CNC2=CC=CC=C2C1 5514AB [0,0,0,1,0,1|0,0,0]=2 489 B12R2.24 NC1COC2=C(C=CC=C2)C1 9046AB [0,0,0,1,0,1|0,0,0]=2 490 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 V4626 [0,0,0,1,0,1|1,0,1]=4 491 B12R2.24 O=C1COC2=CC=CC=C2C1 9923AA [0,0,0,1,0,1|1,0,1]=4 492 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 2076AJ [0,0,0,1,0,1|1,0,1]=4 493 B12R2.24 OC1COC2=C(C=CC=C2)O1 5942AE [0,0,0,1,0,1|2,0,0]=4 494 B12R2.2057 C1=CC(CNC2CC2)=CC=N1 6521AD [0,0,0,1,0,1|2,0,0]=4 495 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 V5734 [0,0,0,1,0,1|1,0,0]=3 496 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 Z9695 [0,0,0,1,0,1|1,0,0]=3 497 B12R2.2057 C1=CC=C(CNC2CC2)N=C1 6937AE [0,0,0,1,0,1|2,0,0]=4 498 B12R2.2057 C1=CN=CC(CNC2CC2)=C1 V3942 [0,0,0,1,0,1|2,0,0]=4 499 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 1156AJ [0,1,0,1,0,0|0,0,0]=2 500 B12R2.294 BrC1=CC=C(OC2CC2)C=C1 Y8943 [0,1,0,1,0,0|2,0,0]=4 501 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 Z4891 [0,1,0,1,0,0|0,0,2]=4 502 B12R2.606 CC1=CC2=C(C=C1)NC(C)C2 1404AJ [0,1,0,1,0,0|0,0,0]=2 503 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 5410AB [0,1,0,1,0,0|0,0,2]=4 504 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 V4553 [0,1,0,1,0,0|1,0,1]=4 505 B12R2.606 NC1CC2=C(C=C(I)C=C2)C1 V6001 [0,1,0,1,0,0|0,0,0]=2 506 B12R2.606 NC1CC2=C(C=C(I)C=C2)C1 X9829 [0,1,0,1,0,0|0,0,0]=2 507 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 V2187 [0,1,0,1,0,0|1,0,1]=4 508 B12R2.606 S=C1CC2=CC=C(Br)C=C2N1 3437AJ [0,1,0,1,0,0|1,0,1]=4 509 B12R2.18 O[C@H]1C2=C(C=CC=C2)C[C@@H]1Br 0883AA [0,1,0,1,0,0|1,0,0]=3 510 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 X6396 [0,1,0,1,0,0|1,0,0]=3 511 B12R2.2075 NC(C1=NC=CC=C1)C2CC2 X2985 [0,1,0,1,0,0|2,0,0]=4 512 B12R2.2075 N[C@H](C1=CC=CC=C1)C2CC2 W8707 [0,1,0,1,0,0|1,0,0]=3 513 B12R2.2075 OC(C1=CN=CC=C1)C2CC2 6518AJ [0,1,0,1,0,0|2,0,0]=4 514 B12R2.27 OCC1CC1C2=CC=CC=C2 9271AB [0,1,0,1,0,0|1,0,0]=3 515 B12R2.27 OC[C@H]1O[C@@H]1C2=CC=CC=C2 7395AJ [0,1,0,1,0,0|1,0,0]=3 516 B12R2.32 CCC1=CC2=C(C=CC=C2)C1 8751AA [0,1,0,1,0,0|1,0,1]=4 517 B12R2.32 CNC1CC2=CC=CC=C2C1 0955AA [0,1,0,1,0,0|0,0,0]=2 518 B12R2.32 NCC1CC2=C(C=CC=C2)C1 1348AJ [0,1,0,1,0,0|0,0,0]=2 519 B12R2.32 NCC1CC2=C(C=CC=C2)O1 0279AB [0,1,0,1,0,0|1,0,0]=3 520 B12R2.32 NCC1CC2=C(C=CC=C2)O1 0817AB [0,1,0,1,0,0|1,0,0]=3 521 B12R2.32 NNC1CC2=C(C=CC=C2)C1 0304AD [0,1,0,1,0,0|0,0,0]=2 522 B12R2.32 SCC1=NC2=CC=CC=C2N1 X5686 [0,1,0,1,0,0|1,0,1]=4 523 B12R2.94 NC1(CC2=CC=CC=C2)CC1 8899AD [0,1,0,1,0,0|0,0,0]=2 524 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 2376AJ [0,1,0,1,0,0|1,0,0]=3 525 B12R2.202 CC1=CC2=C(C=CC=C2Br)N1 W7354 [0,1,0,1,0,0|0,0,2]=4 526 B12R2.202 CC1=CC2=C(N1)C(Br)=CC=C2 0325AQ [0,1,0,1,0,0|0,0,2]=4 527 B12R2.202 CC1=CC2=C(N1)C(C)=CC=C2 Z1704 [0,1,0,1,0,0|0,0,2]=4 528 B12R2.202 O=C1CC2=C(C1)C(Br)=CC=C2 3012AC [0,1,0,1,0,0|1,0,1]=4 529 B12R2.202 O=C1CC2=C(C1)C(Cl)=CC=C2 Z5087 [0,1,0,1,0,0|1,0,1]=4 530 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 Y7437 [0,1,0,1,0,0|1,0,1]=4 531 B12R2.202 OC1CC2=CC=CC(Br)=C2C1 6113AJ [0,1,0,1,0,0|1,0,0]=3 532 B12R2.80 NC1CC1C2=CC(Cl)=CC=C2 5207AJ [0,1,0,1,0,0|0,0,0]=2 533 B12R2.1286 BrC1=CC=CC(SC2CC2)=C1 Z9407 [0,1,0,1,0,0|2,0,0]=4 534 B8R1.8 BrCCC1=CC=CS1 Z5496 [1,0,0,0,1,0|2,0,0]=4 535 B8R1.8 CCCC1=CC=CO1 Z5525 [1,0,0,0,1,0|1,0,0]=3 536 B8R1.8 CCCC1=CSC=C1 Z5466 [1,0,0,0,1,0|1,0,0]=3 537 B8R1.8 CCNC1=CC=CS1 W4294 [1,0,0,0,1,0|2,0,0]=4 538 B8R1.8 CNCC1=CC=CO1 7008AC [1,0,0,0,1,0|2,0,0]=4 539 B8R1.8 NCCC1=CC=CN1 1070AJ [1,0,0,0,1,0|1,0,0]=3 540 B8R1.8 NCCC1=CNN=C1 Y9068 [1,0,0,0,1,0|2,0,0]=4 541 B8R1.8 NCCC1=CSC=C1 8829AB [1,0,0,0,1,0|1,0,0]=3 542 B8R1.8 NCCC1=NC=CN1 9985AA [1,0,0,0,1,0|2,0,0]=4 543 B8R1.8 NCCC1=NC=CS1 5806AE [1,0,0,0,1,0|2,0,0]=4 544 B8R1.8 NCCN1C=CC=C1 3045AB [1,0,0,0,1,0|1,0,0]=3 545 B8R1.8 NCCN1C=CN=C1 4503AH [1,0,0,0,1,0|2,0,0]=4 546 B8R1.8 NCCN1C=CN=C1 W3356 [1,0,0,0,1,0|2,0,0]=4 547 B8R1.8 OCCN1C=CC=C1 4278AL [1,0,0,0,1,0|2,0,0]=4 548 B8R1.7 CC(N)C1=CC=CS1 9580AB [0,0,0,0,2,0|1,0,0]=3 549 B8R1.7 CC(N)C1=CSC=C1 0073AD [0,0,0,0,2,0|1,0,0]=3 550 B8R1.7 CC(N)C1=CSC=N1 4743AH [0,0,0,0,2,0|2,0,0]=4 551 B8R1.7 CC(O)C1=CC=CN1 Z2357 [0,0,0,0,2,0|2,0,0]=4 552 B8R1.7 CC(O)C1=CC=CO1 0311AQ [0,0,0,0,2,0|2,0,0]=4 553 B8R1.7 CC(O)C1=COC=C1 3660AD [0,0,0,0,2,0|2,0,0]=4 554 B12R1.252 CC(C)NCCC1=CC=CC=C1 2161AE [0,0,0,0,0,2|1,0,0]=3 555 B12R1.252 CC(N)CCCC1=CC=CC=C1 7584AD [0,0,0,0,0,2|0,0,0]=2 556 B12R1.252 CC(O)CNCC1=CC=CC=C1 2537AB [0,0,0,0,0,2|1,0,0]=3