0 B10R1.10 C=CCC1=CC=CC(C)=C1 022306 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.10 CCOC1=CC(F)=CC=C1 013375 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.10 CCOC1=CC=CC(Br)=N1 080333 [0,0,0,0,0,0|3,1,0]=4 3 B10R1.10 CCOC1=CC=CC(Cl)=N1 324419 [0,0,0,0,0,0|3,1,0]=4 4 B10R1.10 [N-]=[N+]=NC1=CC(F)=CC=C1 101264 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.10 [N-]=[N+]=NC1=CC(I)=CC=C1 101263 [0,0,0,0,0,0|2,1,1]=4 6 B9R1.2 CC1=CC=CC(CS)=C1 105403 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.2 CSC1=CC=CC(S)=C1 037948 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 COCC1=CC=NC=C1 097899 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 480957 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.13 CCSC1=C(Br)C(C)=CC=C1 105098 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.24 CCCCC1=CC=CC(S)=C1 070787 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.24 COCOC1=CC(F)=CC=C1 224841 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.34 C=CCC1=CC(C)=CC(C)=C1 022319 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.34 C=CCC1=CC(F)=CC(F)=C1 022317 [0,1,0,0,0,0|1,0,1]=3 15 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 231142 [0,1,0,0,0,0|2,1,0]=4 16 B11R1.34 CCOC1=CC(Cl)=CC(F)=C1 013279 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.157 CC(C)SC1=CC=CC(Cl)=C1 094944 [0,1,0,0,0,0|2,1,0]=4 18 B11R1.182 CCNC1=C(N)C=CC(Br)=C1 105267 [0,1,0,0,0,0|2,1,0]=4 19 B11R1.182 CCOC1=C(Br)C=CC(Br)=C1 038698 [0,1,0,0,0,0|2,1,0]=4 20 B11R1.182 COCC1=C(Br)C=CC(F)=C1 013237 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.182 N#CCC1=CC(Cl)=CC=C1Cl 092109 [0,1,0,0,0,0|0,1,2]=4 22 B11R1.189 C=CCC1=CC=CC(OC)=C1 022326 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.189 CNCC1=CC(C#N)=CC=C1 088720 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.192 C=CCC1=CC=C(C)C(F)=C1 022323 [0,1,0,0,0,0|1,0,1]=3 25 B11R1.192 C=CCC1=CC=C(Cl)C(C)=C1 022312 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.192 C=CCC1=CC=C(Cl)C(Cl)=C1 022314 [0,1,0,0,0,0|1,1,1]=4 27 B11R1.192 C=CCC1=CC=C(Cl)C(F)=C1 022311 [0,1,0,0,0,0|1,0,1]=3 28 B11R1.192 C=CCC1=CC=C(F)C(C)=C1 022324 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.192 C=CCC1=CC=C(F)C(Cl)=C1 022309 [0,1,0,0,0,0|1,1,1]=4 30 B11R1.192 C=CCC1=CC=C(F)C(F)=C1 022316 [0,1,0,0,0,0|1,0,1]=3 31 B11R1.192 CCOC1=CC(Cl)=C(F)C=C1 013278 [0,1,0,0,0,0|2,1,0]=4 32 B11R1.192 O=C=NC1=CC(F)=C(I)C=C1 097882 [0,1,0,0,0,0|2,0,1]=4 33 B11R2.36 IC1=CC2=C(C=C1)NN=C2 076978 [0,0,0,1,0,0|1,1,1]=4 34 B9R1.7 CC1=CC=C(CCS)S1 400344 [0,0,0,0,1,0|3,0,0]=4 35 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,0]=3 36 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|0,0,0]=2 37 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [2,0,0,0,0,0|0,0,0]=2 38 B10R1.2 CC1=C(Cl)C(CN)=CC=C1 075958 [1,1,0,0,0,0|1,0,0]=3 39 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 094705 [1,1,0,0,0,0|1,1,0]=4 40 B10R1.2 CSC1=CC=CC(Br)=C1Cl 105294 [1,1,0,0,0,0|1,1,0]=4 41 B10R1.8 CNC1=CC(Br)=CC(F)=C1 104894 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.8 COC1=CC(F)=CC(N)=C1 230690 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.30 C=CC1=C(F)C=CC(F)=C1 474850 [1,1,0,0,0,0|0,0,2]=4 44 B10R1.30 CC1=C(CBr)C=C(Br)C=C1 246530 [1,1,0,0,0,0|1,1,0]=4 45 B10R1.30 CC1=CC(CN)=C(Cl)C=C1 070846 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.30 CC1=CC(CO)=C(C)C=C1 104981 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.30 CCC1=C(F)C=CC(Br)=C1 037701 [1,1,0,0,0,0|0,1,0]=3 48 B10R1.30 COC1=C(Cl)C=CC(I)=C1 075709 [1,1,0,0,0,0|1,1,0]=4 49 B10R1.30 COC1=C(Cl)C=CC(S)=C1 075710 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.30 COC1=CC(C)=CC=C1Cl 038664 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.30 COC1=CC(C)=CC=C1O 216346 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.30 CSC1=C(F)C=CC(Br)=C1 098206 [1,1,0,0,0,0|1,1,0]=4 53 B10R1.30 ClCC1=C(I)C=CC(Br)=C1 331982 [1,1,0,0,0,0|1,1,0]=4 54 B10R1.30 OCC1=C(I)C=CC(Br)=C1 331559 [1,1,0,0,0,0|1,1,0]=4 55 B10R1.113 CC1=CC=CC(C(C)N)=C1 094296 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.113 CC1=CC=CC(S(C)=O)=C1 064559 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.113 CS(=O)C1=CC(Cl)=CC=C1 064493 [1,1,0,0,0,0|1,1,0]=4 58 B10R1.113 CS(=O)C1=CC(F)=CC=C1 064508 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.113 CS(=O)C1=CC=CC(Br)=C1 064477 [1,1,0,0,0,0|1,1,0]=4 60 B10R1.172 CCC1=CC(C=O)=CC=C1 216622 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.176 C#CC1=CC=C(N)C(F)=C1 045992 [1,1,0,0,0,0|0,0,2]=4 62 B10R1.176 CC1=C(Cl)C=CC(CN)=C1 105224 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.176 CC1=C(N)C=C(CN)C=C1 075753 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.176 CCC1=CC=C(S)C(Br)=C1 061618 [1,1,0,0,0,0|0,1,0]=3 65 B10R1.176 COC1=CC=C(Br)C(S)=C1 062585 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.176 COC1=CC=C(I)C(N)=C1 062579 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.176 COC1=CC=C(S)C(C)=C1 023081 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.176 CSC1=CC=C(Br)C(S)=C1 070273 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.176 CSC1=CC=C(C)C(S)=C1 070026 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.176 CSC1=CC=C(Cl)C(S)=C1 070092 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.1 CC1=CC=C(CON)C=C1 025883 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.1 CCOC1=CC=C(S)C=C1 038427 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.1 CCSC1=CC=C(S)C=C1 023079 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.1 COCC1=CC=C(N)C=C1 098494 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.4 CCOC1=C(I)C=CC=C1 038700 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.4 ClC1=C(CCBr)C=CC=C1 020893 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.15 C=C(CC)C1=CC=CC=C1 319906 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.17 BrCCCC1=CC=NC=C1 098416 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.17 CCOCC1=CC=NC=C1 097898 [1,1,0,0,0,0|2,0,0]=4 80 B12R1.224 CC1=C(F)C=CC=C1NC(N)=S 062899 [0,2,0,0,0,0|1,0,1]=4 81 B12R1.497 N#CCC1=C(F)C(F)=CC=C1Br 105025 [0,2,0,0,0,0|0,0,2]=4 82 B12R1.17 C=CCC(O)C1=CC(Cl)=CC=C1 022243 [0,2,0,0,0,0|1,1,0]=4 83 B12R1.28 CCCCOC1=CC=CC(N)=C1 310050 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.28 COCCOC1=CC(N)=CC=C1 358800 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.100 CCCCC1=CC(Br)=CC(Br)=C1 037554 [0,2,0,0,0,0|1,1,0]=4 86 B12R1.100 N#CCOC1=CC(F)=CC(F)=C1 033316 [0,2,0,0,0,0|0,0,2]=4 87 B12R1.226 CC(C)COC1=CC=CC(N)=C1 038447 [0,2,0,0,0,0|2,0,0]=4 88 B12R1.226 O=C(O)CSC1=CC=CC(F)=C1 033386 [0,2,0,0,0,0|1,0,1]=4 89 B12R1.374 N#CCOC1=C(F)C=CC(F)=C1 033313 [0,2,0,0,0,0|0,0,2]=4 90 B12R1.382 CCCCC1=CC=CC(C#N)=C1 070789 [0,2,0,0,0,0|2,0,0]=4 91 B12R1.382 CCCOC1=CC(C=O)=CC=C1 014190 [0,2,0,0,0,0|2,0,0]=4 92 B12R1.385 CCCCC1=CC=C(Cl)C(Br)=C1 037559 [0,2,0,0,0,0|1,1,0]=4 93 B12R1.385 CCCCC1=CC=C(I)C(Br)=C1 037557 [0,2,0,0,0,0|1,1,0]=4 94 B12R1.385 N#CCOC1=CC(F)=C(F)C=C1 033317 [0,2,0,0,0,0|0,0,2]=4 95 B12R1.101 O=C(Cl)CC1=CC(F)=CC(F)=C1 038316 [0,2,0,0,0,0|1,0,1]=4 96 B12R1.19 NC(=S)NC1=CC(F)=C(Cl)C=C1 062797 [0,2,0,0,0,0|1,0,1]=4 97 B12R1.119 CS(=O)(=O)CC1=CC(F)=CC=C1 024344 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.288 C=CCC1=CC=C(OC)C(F)=C1 022322 [0,2,0,0,0,0|1,0,1]=4 99 B12R2.82 FC1=C(Br)C2=C(C=C1)NN=C2 230181 [0,1,0,1,0,0|1,0,1]=4 100 B12R2.291 NC1=C(F)C=C(C2CC2)C=C1 039986 [0,1,0,1,0,0|1,0,0]=3 101 B8R1.8 BrCCC1=CSC=C1 043805 [1,0,0,0,1,0|2,0,0]=4