0 B10R1.15 C=C(CC)C1=CC=CC=C1 BB31-3793 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.15 CCC(N)C1=CC=CN=C1 BB31-0914 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.15 COC(=N)C1=CC=CC=C1 BB31-6235 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 BB31-4000 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.15 C[C@H](CO)C1=CC=CC=C1 BB31-5425 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.15 NC(CO)C1=NC=CC=C1 BB31-5647 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C=C(C)C1=CC=CN=C1 BB32-0833 [1,0,0,0,0,0|1,0,2]=4 7 B9R1.6 CC(N)C1=NC=CC=N1 BB31-3285 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.6 CN(C)C1=NC=NC=C1 BB32-2121 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.6 C[C@@H](N)C1=CC=NC=C1 BB31-0181 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.6 C[C@@H](N)C1=NC=CC=C1 BB31-9751 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.8 CCNC1=NC=CC=C1 BB31-5587 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.8 CNCC1=CC=NC=C1 BB52-3970 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.8 NNCC1=NC=CC=C1 BB32-1215 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.8 N\N=C\C1=CC=CC=C1 BB32-2520 [1,0,0,0,0,0|1,0,1]=3 15 B9R1.8 OCCC1=CN=CN=C1 BB31-8537 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.7 NCC(F)(F)C1=NC=CC=C1 BB32-1469 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.7 OCC(F)(F)C1=NC=CC=C1 BB32-0897 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.12 CCC(C=O)C1=CC=CC=C1 BB31-7584 [0,1,0,0,0,0|1,0,1]=3 19 B11R1.16 COCC(=O)C1=CC=CC=C1 BB31-5695 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 BB31-7522 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.16 COC[C@H](N)C1=CC=CC=C1 BB32-3222 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.16 N#CCC(O)C1=CC=CC=C1 BB31-7914 [0,1,0,0,0,0|1,0,1]=3 23 B11R1.16 OCCC(O)C1=CC=CC=C1 BB32-2523 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 BB32-1297 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 BB32-1953 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.22 CCN(C)C1=CC=C(N)C=C1 BB12-5200 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 BB31-0492 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 BB31-0570 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 BB31-4005 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 BB32-1300 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 BB32-3014 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 BB31-3734 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 BB31-5650 [0,1,0,0,0,0|1,0,1]=3 34 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 BB31-9590 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 BB31-4154 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-0148 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-1793 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.36 C=C(C1=CC=CC=C1)C(C)C BB31-3442 [0,1,0,0,0,0|1,0,2]=4 39 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 BB32-1369 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.36 CC(C)C(C)C1=CC=CC=C1 BB31-5345 [0,1,0,0,0,0|1,0,0]=2 41 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 BB31-5054 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 BB31-7042 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.222 CC1=C(N(C)C=O)C=CC=C1 BB31-1907 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 BB31-1755 [0,1,0,0,0,0|2,0,0]=3 45 B11R2.1 CC1=CNC2=C1C=CN=C2 BB32-1173 [0,0,0,1,0,0|1,0,2]=4 46 B11R2.1 CC1=NNC2=C1C=CN=C2 BB31-8410 [0,0,0,1,0,0|2,0,1]=4 47 B11R2.1 CC1=NNC2=C1C=NC=C2 BB31-9059 [0,0,0,1,0,0|2,0,1]=4 48 B11R2.1 CC1=NOC2=C1C=CC=C2 BB31-4705 [0,0,0,1,0,0|2,0,1]=4 49 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [0,0,0,1,0,0|1,0,2]=4 50 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [0,0,0,1,0,0|1,0,2]=4 51 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [0,0,0,1,0,0|2,0,1]=4 52 B11R2.1 OC1CCC2=C1C=CC=N2 BB31-8742 [0,0,0,1,0,0|3,0,0]=4 53 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 BB31-5413 [0,0,0,1,0,0|2,0,0]=3 54 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 BB31-4659 [0,0,0,1,0,0|2,0,0]=3 55 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 BB31-4761 [0,0,0,1,0,0|0,0,0]=1 56 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 BB31-5270 [0,0,0,1,0,0|0,0,0]=1 57 B11R2.239 C1=CC(C2CNC2)=CC=N1 BB31-0986 [0,0,0,1,0,0|1,0,0]=2 58 B11R2.239 C1=CC=C(C2CCN2)C=C1 BB31-8120 [0,0,0,1,0,0|2,0,0]=3 59 B11R2.239 C1=CN=CC(C2CNC2)=C1 BB31-0985 [0,0,0,1,0,0|1,0,0]=2 60 B11R2.988 OCC1CC2=C1C=CC=C2 BB31-2934 [0,0,0,1,0,0|1,0,0]=2 61 B9R1.11 CC(CO)N1C=CC=N1 BB52-8649 [0,0,0,0,1,0|3,0,0]=4 62 B11R1.40 CC(C#N)NC1=CC=CC=C1 BB32-1220 [0,0,0,0,0,1|0,0,2]=3 63 B11R1.40 NCC(=O)CC1=CC=CC=C1 BB31-4674 [0,0,0,0,0,1|1,0,1]=3 64 B11R1.40 NCC(O)CC1=CC=CC=C1 BB32-2349 [0,0,0,0,0,1|1,0,0]=2 65 B11R1.40 NNC(=O)OC1=CC=CC=C1 BB31-5306 [0,0,0,0,0,1|2,0,1]=4 66 B11R1.40 O=C(CO)NC1=CC=CC=C1 BB32-2558 [0,0,0,0,0,1|2,0,1]=4 67 B8R1.2 NCC1=CC=NC=C1 BB32-3106 [2,0,0,0,0,0|1,0,0]=3 68 B8R1.2 NCC1=CN=NC=C1 BB31-7658 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.2 NNC1=NC=CC=C1 BB52-0908 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.13 CC(C)C1=CC=C(N)N=N1 BB32-3140 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.13 CC(C)C1=NC=C(Br)C=C1 BB31-0706 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.13 CC(C)C1=NN=C(Br)C=C1 BB31-9165 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.13 CC(C)C1=NN=C(Br)C=C1 BB31-9854 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.13 CC(O)C1=CN=C(Cl)C=C1 BB32-1451 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 BB31-5404 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.13 CC1=NC=C(C(C)N)C=C1 BB31-7487 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.13 CN(C)C1=CC=C(I)C=C1 BB12-5133 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.13 CN(C)C1=CN=C(N)C=C1 BB31-7808 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.13 CN(C)C1=NC=C(I)C=C1 BB32-1805 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.13 CN(C)C1=NC=C(N)C=C1 BB32-2424 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 BB31-0481 [1,1,0,0,0,0|0,0,0]=2 82 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-1090 [1,1,0,0,0,0|0,0,0]=2 83 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-2900 [1,1,0,0,0,0|0,0,0]=2 84 B10R1.13 N=C(N)C1=CC=C(I)C=C1 BB31-9721 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.13 N=C(N)C1=CC=C(N)C=C1 BB31-7117 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.28 CC(C)(N)C1=CC=CN=C1 BB31-5567 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.28 CC(C)(N)C1=CC=NC=C1 BB31-5575 [1,1,0,0,0,0|1,0,0]=3 88 B10R1.28 CC(C)(N)C1=NC=CC=C1 BB32-2362 [1,1,0,0,0,0|1,0,0]=3 89 B10R1.28 CC(C)(O)C1=NC=CC=C1 BB32-1616 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.28 C[S@](=N)(=O)C1=CC=CC=C1 BB31-5431 [1,1,0,0,0,0|1,0,1]=4 91 B10R1.61 CC(C)C1=C(O)C=CC=N1 BB31-4057 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.61 CC(C)C1=CN=CN=C1Cl BB31-0216 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.61 CC(N)C1=C(Br)C=CC=C1 BB31-0378 [1,1,0,0,0,0|0,0,0]=2 94 B10R1.61 CC(O)C1=C(F)C=CC=N1 BB31-5459 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.61 CC1=C(C(=N)N)C=CC=C1 BB31-5703 [1,1,0,0,0,0|1,0,1]=4 96 B10R1.61 CN(C)C1=C(Br)C=CC=N1 BB31-9343 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.61 CN(C)C1=C(Br)C=NC=C1 BB31-6826 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.61 CN(C)C1=C(F)C=CC=C1 BB32-1594 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 BB31-0478 [1,1,0,0,0,0|0,0,0]=2 100 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-0488 [1,1,0,0,0,0|0,0,0]=2 101 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-7807 [1,1,0,0,0,0|0,0,0]=2 102 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 BB31-1004 [1,1,0,0,0,0|0,0,0]=2 103 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 BB31-2127 [1,1,0,0,0,0|0,0,0]=2 104 B10R1.61 C[C@H](N)C1=C(O)C=CC=C1 BB31-8099 [1,1,0,0,0,0|0,0,0]=2 105 B10R1.61 NC1=C(C(F)F)C=CC=C1 BB31-2757 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.113 CC(C)C1=CN=CC(N)=C1 BB31-1267 [1,1,0,0,0,0|1,0,0]=3 107 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 BB31-7554 [1,1,0,0,0,0|1,0,0]=3 108 B10R1.113 CC(C)C1=NC=CC(Cl)=N1 BB31-7204 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.113 CC(C)C1=NC=CC(N)=C1 BB32-2144 [1,1,0,0,0,0|1,0,0]=3 110 B10R1.113 CC(O)C1=CC=CC(Br)=N1 BB31-9694 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 BB31-0480 [1,1,0,0,0,0|0,0,0]=2 112 B10R1.113 CC1=CC=CC([C@@H](C)O)=C1 BB32-1902 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 BB32-2691 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 BB32-3260 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.113 CN(C)C1=CC=CC(Br)=N1 BB31-8405 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.113 CN(C)C1=CC=CC(F)=C1 BB31-4166 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 BB32-0142 [1,1,0,0,0,0|0,0,0]=2 118 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 BB31-7991 [1,1,0,0,0,0|0,0,0]=2 119 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 BB31-5432 [1,1,0,0,0,0|0,0,0]=2 120 B10R1.113 NC(=S)C1=CC(N)=CC=C1 BB31-6919 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.113 NC1=CC=CC(C(F)F)=C1 BB31-3122 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.113 OC1=CC=CC(C(F)F)=C1 BB32-2098 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.1 C=CCC1=CC=C(O)C=C1 BB31-5055 [1,1,0,0,0,0|1,0,1]=4 124 B10R1.1 CC1=CC=C(SCCl)C=C1 BB31-6111 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.1 CC1=NC=C(CCO)C=C1 BB31-0061 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.1 CSCC1=CC=C(F)C=C1 BB32-3225 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.1 OCCC1=CN=C(Cl)C=C1 BB31-8395 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.1 OCCC1=NC=C(Br)C=C1 BB31-8160 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.4 CC1=C(CON)C=CC=C1 BB31-8696 [1,1,0,0,0,0|1,0,0]=3 130 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.4 NOCC1=C(Cl)C=CC=C1 BB32-2623 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [1,1,0,0,0,0|1,0,0]=3 134 B10R1.10 CCCC1=CC=CC(Br)=C1 BB31-3877 [1,1,0,0,0,0|1,0,0]=3 135 B10R1.10 CCCC1=CC=CC(F)=C1 BB31-4486 [1,1,0,0,0,0|1,0,0]=3 136 B10R1.10 CCOC1=CC=CC(S)=C1 BB31-5788 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.10 NOCC1=CC=CC(Cl)=C1 BB31-4564 [1,1,0,0,0,0|1,0,0]=3 138 B10R1.10 NOCC1=CC=CC(F)=C1 BB32-2410 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.17 CCCCC1=CC=CN=C1 BB31-4701 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.17 ClCCSC1=NC=CC=C1 BB52-9581 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.17 NCCCC1=CC=CN=C1 BB31-5719 [1,1,0,0,0,0|1,0,0]=3 142 B10R1.17 NCCNC1=NC=CC=C1 BB52-8028 [1,1,0,0,0,0|1,0,0]=3 143 B10R1.17 NCCOC1=CC=NC=C1 BB32-2674 [1,1,0,0,0,0|1,0,0]=3 144 B10R1.17 NCCOC1=NC=CC=C1 BB31-4550 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.17 NCCSC1=NC=CC=C1 BB52-8924 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.17 OCCSC1=NC=CC=C1 BB52-9072 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.18 CC(C)CC1=NC=CC=C1 BB31-5691 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.18 N=C(N)CC1=CC=CN=C1 BB52-5807 [1,1,0,0,0,0|1,0,1]=4 149 B10R1.18 N=C(N)CC1=NC=CC=C1 BB52-5801 [1,1,0,0,0,0|1,0,1]=4 150 B10R1.14 CC1=CN(C(C)CN)N=C1 BB05-4113 [0,1,0,0,1,0|2,0,0]=4 151 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 BB32-3592 [0,1,0,0,0,1|2,0,0]=4 152 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O BB31-3006 [0,1,0,0,0,1|1,0,1]=4 153 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 BB31-6128 [0,1,0,0,0,1|2,0,0]=4 154 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 BB31-6129 [0,1,0,0,0,1|2,0,0]=4 155 B12R1.9 FC(F)(CBr)C1=CC=C(Br)C=C1 BB32-2621 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.195 CC(C)(CO)C1=C(Cl)C=CC=C1 BB31-9205 [0,2,0,0,0,0|1,0,0]=3 157 B12R1.478 CC(C)[C@H](CN)C1=CC=CC=C1 BB31-4663 [0,2,0,0,0,0|0,0,0]=2 158 B12R1.478 CCC(C(N)=O)C1=CC=CC=C1 BB31-4874 [0,2,0,0,0,0|0,0,1]=3 159 B12R1.478 CN[C@H](C(=O)O)C1=CC=CC=C1 BB31-4378 [0,2,0,0,0,0|1,0,1]=4 160 B12R1.478 N#CC(C(N)=O)C1=CC=CC=C1 BB31-7070 [0,2,0,0,0,0|0,0,2]=4 161 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 BB31-2435 [0,2,0,0,0,0|0,0,1]=3 162 B12R1.478 O=C(O)[C@@H](CO)C1=CC=CC=C1 BB32-0839 [0,2,0,0,0,0|1,0,1]=4 163 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 BB32-0834 [0,2,0,0,0,0|1,0,1]=4 164 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 BB31-1752 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.30 NC(CCCO)C1=CC=CC=C1 BB32-2038 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 BB31-1753 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 BB31-5440 [0,2,0,0,0,0|1,0,0]=3 168 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 BB31-5414 [0,2,0,0,0,0|1,0,0]=3 169 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 BB31-5109 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.5 COC1=CC=C(C(N)CO)C=C1 BB31-2402 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.5 COC1=CC=C(C(N)CO)C=C1 BB31-9770 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.20 CC(C(=O)O)C1=CC=C(Br)C=C1 BB32-2376 [0,2,0,0,0,0|1,0,1]=4 173 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 BB32-3174 [0,2,0,0,0,0|1,0,1]=4 174 B12R1.20 CC(C)[C@@H](N)C1=CC=C(F)C=C1 BB31-9782 [0,2,0,0,0,0|2,0,0]=4 175 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 BB32-0150 [0,2,0,0,0,0|2,0,0]=4 176 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 BB31-9783 [0,2,0,0,0,0|2,0,0]=4 177 B12R1.20 CC1=CC=C([C@@H](N)C(C)C)C=C1 BB32-0151 [0,2,0,0,0,0|2,0,0]=4 178 B12R1.367 NC(CO)C1=CC(Cl)=C(Cl)C=C1 BB32-0657 [0,2,0,0,0,0|2,0,0]=4 179 B12R1.367 N[C@H](CO)C1=CC(F)=C(F)C=C1 BB32-0133 [0,2,0,0,0,0|2,0,0]=4 180 B12R1.367 OC(CCl)C1=CC(F)=C(F)C=C1 BB32-2905 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 BB32-0387 [0,2,0,0,0,0|2,0,0]=4 182 B12R1.1703 N[C@H](CO)C1=C(Cl)C=C(Cl)C=C1 BB31-2433 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.225 CC(C)[C@@H](N)C1=CC=CC(Cl)=C1 BB31-9733 [0,2,0,0,0,0|2,0,0]=4 184 B12R1.435 COC1=CC=CC(C(=O)CN)=C1 BB31-7626 [0,2,0,0,0,0|1,0,1]=4 185 B12R1.124 CC(C(=O)O)C1=C(Cl)C=CC=C1 BB31-8139 [0,2,0,0,0,0|1,0,1]=4 186 B10R2.7 C1=CC2=C(C=C1)SCS2 BB32-1488 [1,0,0,1,0,0|2,0,0]=4 187 B10R2.7 C1=CC2=C(C=N1)CCN2 BB31-4247 [1,0,0,1,0,0|1,0,0]=3 188 B10R2.7 C1=CC2=C(C=N1)CCN2 BB32-3376 [1,0,0,1,0,0|1,0,0]=3 189 B10R2.7 C1=CC2=C(C=N1)NCC2 BB31-4675 [1,0,0,1,0,0|1,0,0]=3 190 B10R2.7 C1=CN=C2CCNC2=C1 BB31-9759 [1,0,0,1,0,0|1,0,0]=3 191 B10R2.7 C1=CN=C2CCNC2=C1 BB32-0564 [1,0,0,1,0,0|1,0,0]=3 192 B10R2.136 C1=CN(C2CNC2)N=C1 BB31-2330 [0,0,0,1,1,0|2,0,0]=4 193 B12R2.24 CC1=NC2=CC=CC=C2SC1 BB52-7622 [0,0,0,1,0,1|1,0,1]=4 194 B12R2.24 CC1CNC2=C(C=CC=C2)C1 BB31-4086 [0,0,0,1,0,1|0,0,0]=2 195 B12R2.24 CC1CNC2=C(C=CC=C2)N1 BB32-3882 [0,0,0,1,0,1|0,0,0]=2 196 B12R2.24 CC1CNC2=C(C=CC=C2)S1 BB32-3335 [0,0,0,1,0,1|0,0,0]=2 197 B12R2.24 CC1COC2=C(C=CC=C2)N1 BB32-1397 [0,0,0,1,0,1|1,0,0]=3 198 B12R2.24 CN1CCC2=C(C=CC=C2)C1 BB32-2641 [0,0,0,1,0,1|2,0,0]=4 199 B12R2.24 NC1CNC2=C(C=CC=C2)C1 BB32-1614 [0,0,0,1,0,1|1,0,0]=3 200 B12R2.24 NC1COC2=C(C=CC=C2)C1 BB31-4949 [0,0,0,1,0,1|2,0,0]=4 201 B12R2.24 OC1CNC2=C(C=CC=C2)C1 BB32-1531 [0,0,0,1,0,1|1,0,0]=3 202 B12R2.32 C#CC1CC2=C(C=CC=C2)C1 BB32-0346 [0,0,0,1,0,1|1,0,1]=4 203 B12R2.32 NCC1=NC2=C(C=CC=C2)S1 BB31-4534 [0,0,0,1,0,1|1,0,1]=4 204 B12R2.32 NCC1=NC2=CC=CC=C2O1 BB52-8719 [0,0,0,1,0,1|1,0,1]=4 205 B12R2.32 NCC1=NC2=CC=CC=C2S1 BB52-8729 [0,0,0,1,0,1|1,0,1]=4 206 B12R2.32 O=CC1CC2=C(C=CC=C2)C1 BB32-1577 [0,0,0,1,0,1|1,0,1]=4 207 B12R2.32 OCC1CC2=C(C=CC=C2)C1 BB32-2348 [0,0,0,1,0,1|1,0,0]=3 208 B12R2.32 OC[C@@H]1CC2=C(C=CC=C2)N1 BB31-4454 [0,0,0,1,0,1|1,0,0]=3 209 B12R2.48 NCC1(C2=CC=CN=C2)CC1 BB31-9456 [0,1,0,1,0,0|1,0,0]=3 210 B12R2.116 NC1(C2=CC=CC=C2)CCC1 BB31-5544 [0,1,0,1,0,0|1,0,0]=3 211 B12R2.116 NC1(C2=CC=CC=C2)COC1 BB31-5222 [0,1,0,1,0,0|1,0,0]=3 212 B12R2.116 OC1(C2=CC=CC=C2)CNC1 BB32-1141 [0,1,0,1,0,0|0,0,0]=2 213 B12R2.116 OC1(C2=CC=CC=C2)CNC1 BB32-2731 [0,1,0,1,0,0|0,0,0]=2 214 B12R2.116 OC1(C2=CC=CC=C2)COC1 BB31-6968 [0,1,0,1,0,0|1,0,0]=3 215 B12R2.1 CCC1=CNC2=C1C=CC=C2 BB31-2843 [0,1,0,1,0,0|0,0,2]=4 216 B12R2.1 NCC1=CSC2=C1C=CC=C2 BB31-5728 [0,1,0,1,0,0|0,0,2]=4 217 B12R2.2 C1=CC=C(C2=CCCC2)C=C1 BB31-8627 [0,1,0,1,0,0|1,0,1]=4 218 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 BB32-3315 [0,1,0,1,0,0|1,0,0]=3 219 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 BB32-3398 [0,1,0,1,0,0|1,0,0]=3 220 B12R2.2 C1=CN=CC(C2CCNC2)=C1 BB32-3380 [0,1,0,1,0,0|1,0,0]=3 221 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 BB31-3001 [0,1,0,1,0,0|0,0,0]=2 222 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 BB32-3180 [0,1,0,1,0,0|1,0,1]=4 223 B12R2.1081 CC1CCNC2=C1C=CC=C2 BB31-4716 [0,1,0,1,0,0|0,0,0]=2 224 B12R2.1081 CN1CCNC2=C1C=CC=C2 BB31-1425 [0,1,0,1,0,0|1,0,0]=3 225 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 BB32-1584 [0,1,0,1,0,0|2,0,0]=4 226 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 BB31-4049 [0,1,0,1,0,0|2,0,0]=4 227 B12R2.1081 OC1COCC2=C1C=CC=C2 BB31-4134 [0,1,0,1,0,0|2,0,0]=4 228 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 BB31-4223 [0,1,0,1,0,0|2,0,0]=4 229 B12R2.2028 NC1CC(=O)C2=C1C=CC=C2 BB32-0444 [0,1,0,1,0,0|1,0,1]=4 230 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 BB31-5520 [0,1,0,1,0,0|2,0,0]=4 231 B12R2.2075 N[C@@H](C1=CC=CC=C1)C2CC2 BB31-7748 [0,1,0,1,0,0|2,0,0]=4 232 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 BB31-9844 [0,1,0,1,0,0|0,0,0]=2 233 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 BB31-3897 [0,1,0,1,0,0|0,0,0]=2 234 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 BB32-2565 [0,1,0,1,0,0|2,0,0]=4 235 B12R2.290 OC1(C2=CC=C(Br)C=C2)CC1 BB31-5186 [0,1,0,1,0,0|2,0,0]=4 236 B12R2.612 CC1=NNC2=C1C=CC(F)=C2 BB31-3058 [0,1,0,1,0,0|1,0,1]=4 237 B12R2.612 CN1CCC2=C1C=CC(N)=C2 BB31-1016 [0,1,0,1,0,0|2,0,0]=4 238 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 BB31-9391 [0,1,0,1,0,0|2,0,0]=4 239 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 BB31-7488 [0,1,0,1,0,0|2,0,0]=4 240 B12R2.612 NC1CCC2=C1C=CC(F)=C2 BB31-2856 [0,1,0,1,0,0|2,0,0]=4 241 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-2188 [0,1,0,1,0,0|2,0,0]=4 242 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-7379 [0,1,0,1,0,0|2,0,0]=4 243 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 BB31-2788 [0,1,0,1,0,0|2,0,0]=4 244 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 BB31-7436 [0,1,0,1,0,0|2,0,0]=4 245 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 BB32-2056 [0,1,0,1,0,0|1,0,0]=3 246 B12R2.132 CC1=CNC2=C1C=C(O)C=C2 BB31-7869 [0,1,0,1,0,0|0,0,2]=4 247 B12R2.132 CC1=NNC2=C1C=C(Cl)C=C2 BB31-7370 [0,1,0,1,0,0|1,0,1]=4 248 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 BB32-3775 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.132 NC1CCC2=C1C=C(F)C=C2 BB31-0781 [0,1,0,1,0,0|2,0,0]=4 250 B12R2.132 NC1COC2=C1C=C(Cl)C=C2 BB31-6960 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 BB31-9837 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.196 CC1=CC=CC2=C1CCC2O BB32-3812 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.196 CC1=CNC2=C(Br)C=CC=C12 BB31-6518 [0,1,0,1,0,0|0,0,2]=4 254 B12R2.196 N[C@@H]1CCC2=C(Br)C=CC=C21 BB31-0904 [0,1,0,1,0,0|2,0,0]=4 255 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 BB31-0902 [0,1,0,1,0,0|2,0,0]=4 256 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 BB31-1669 [0,1,0,1,0,0|2,0,0]=4 257 B12R2.196 OC1COC2=C(Br)C=CC=C21 BB31-2504 [0,1,0,1,0,0|2,0,0]=4 258 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 BB31-9459 [0,1,0,1,0,0|1,0,0]=3 259 B12R2.3190 O=C(O)C1CC2=C1C=CC=C2 BB31-2766 [0,1,0,1,0,0|1,0,1]=4 260 B12R2.88 CC1=C(C2(N)CC2)C=CC=C1 BB31-7582 [0,1,0,1,0,0|2,0,0]=4 261 B12R2.88 NC1(C2=C(Cl)C=CC=C2)CC1 BB31-6531 [0,1,0,1,0,0|2,0,0]=4 262 B12R2.203 CC1=NNC2=CC=CC(Cl)=C21 BB31-3320 [0,1,0,1,0,0|1,0,1]=4 263 B12R2.203 CC1=NNC2=CC=CC(O)=C21 BB31-2859 [0,1,0,1,0,0|1,0,1]=4 264 B12R2.203 NC1CCC2=CC=CC(Br)=C21 BB31-9389 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.203 N[C@@H]1COC2=CC=CC(F)=C21 BB32-0139 [0,1,0,1,0,0|2,0,0]=4 266 B8R1.7 CC(N)C1=CC=CS1 BB32-0760 [1,0,0,0,1,0|1,0,0]=3 267 B8R1.7 CC(N)C1=NC=CS1 BB31-5454 [1,0,0,0,1,0|2,0,0]=4 268 B8R1.8 BrCCN1C=CC=C1 BB31-5450 [1,0,0,0,1,0|2,0,0]=4 269 B8R1.8 NCCC1=NC=CS1 BB52-6118 [1,0,0,0,1,0|2,0,0]=4 270 B8R1.8 NCCN1C=CC=N1 BB53-0567 [1,0,0,0,1,0|2,0,0]=4 271 B8R1.8 NCCN1C=CN=C1 BB32-0624 [1,0,0,0,1,0|2,0,0]=4 272 B8R1.8 NCCN1C=CN=C1 BB52-8954 [1,0,0,0,1,0|2,0,0]=4 273 B8R1.8 OCCC1=COC=C1 BB31-4913 [1,0,0,0,1,0|2,0,0]=4 274 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 BB32-1672 [0,0,0,0,0,2|1,0,0]=3