0 B10R1.1 ClC1=CC=C(CCBr)C=C1 BCP09513 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.1 FC1=CC=C(CCBr)C=C1 BCP15339 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.1 COC1=CN=C(Br)C=C1 BCP04838 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.1 ClC1=CC=C(CN)C=N1 BCP19252 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.1 FC1=CC=C([Mg]Br)C=C1 BCP08644 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.1 NC1=CC=C(C#N)C=C1 BCP04531 [1,0,0,0,0,0|1,0,2]=4 6 B9R1.1 NCC1=NC=C(C)N=C1 BCP14024 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.1 NNC1=NC=C(Cl)C=C1 BCP15596 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.1 O=CC1=CC=C(I)C=C1 BCP05912 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.1 OCC1=CC=C(C)N=C1 BCP15437 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.1 OCC1=CC=C(S)C=C1 BCP18396 [1,0,0,0,0,0|1,1,0]=3 11 B9R1.8 BrCCC1=CC=CN=C1 BCP07727 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.8 ONCC1=CC=CC=C1 BCP07876 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.1 ClC1=CC=C(OCCO)C=C1 BCP11228 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.1 OC1=CC=C(CCNC)C=C1 BCP10171 [0,1,0,0,0,0|0,0,0]=1 15 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.22 BrC1=CC=C(C(CN)=O)C=C1 BCP24959 [0,1,0,0,0,0|1,0,1]=3 17 B11R1.22 FC1=CC=C([C](CCl)O)C=C1 BCP12170 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP02652 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP10292 [0,1,0,0,0,0|1,0,0]=2 20 B11R1.83 NOCC1=CC=C(OC)C=C1 BCP19988 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.83 OCCc1ccc(cn1)CC BCP12396 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.192 NCCC1=CC(O)=C(C=C1)O BCP06611 [0,1,0,0,0,0|0,0,0]=1 23 B11R2.34 FC1=CC=C([C@@H]2OC2)C=C1 BCP13087 [0,0,0,1,0,0|2,0,0]=3 24 B11R2.34 FC1=CC=C([C]2OC2)C=C1 BCP12175 [0,0,0,1,0,0|2,0,1]=4 25 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 BCP00386 [0,0,0,1,0,0|2,0,1]=4 26 B11R2.36 Brc1ccc2c(c1)CCO2 BCP08601 [0,0,0,1,0,0|3,0,0]=4 27 B11R2.36 CC1=CC2=C(C=C1)C=CN2 BCP00914 [0,0,0,1,0,0|1,0,2]=4 28 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 BCP00061 [0,0,0,1,0,0|1,0,2]=4 29 B11R2.36 ClC1=CC=C2C(NN=C2)=C1 BCP00929 [0,0,0,1,0,0|2,0,1]=4 30 B11R2.36 IC1=CC2=C(C=C1)C=NN2 BCP00928 [0,0,0,1,0,0|2,0,1]=4 31 B11R2.36 NC1=CC=C2OCCC2=C1 BCP19517 [0,0,0,1,0,0|3,0,0]=4 32 B11R2.36 Nc1ccc2c(c1)[nH]nc2 BCP00039 [0,0,0,1,0,0|2,0,1]=4 33 B11R2.36 OC1=CC2=C(C=C1)OCO2 BCP14043 [0,0,0,1,0,0|2,0,0]=3 34 B11R2.36 OC1=CC=C2NN=CC2=C1 BCP11175 [0,0,0,1,0,0|3,0,0]=4 35 B8R1.2 NCC1=CC=CN=C1 BCP13872 [2,0,0,0,0,0|1,0,0]=3 36 B8R1.2 NCC1=NC=CC=N1 BCP00118 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.2 NCC1=NN=CC=C1 BCP04627 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.2 OCC1=CC=CN=C1 BCP20084 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.2 [Na]SC1=CC=CC=C1 BCP14418 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.3 BrC1=CN=C(C)C=C1 BCP13752 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.3 CC1=CC=C(Cl)N=C1 BCP19250 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.3 FC1=CC=C(C)N=C1 BCP05119 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.3 NC1=CC=C(C)N=C1 BCP05413 [2,0,0,0,0,0|2,0,0]=4 44 B8R1.3 NC=1C=CC(=CN1)C BCP16835 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.3 O=C1C=CC(C)=CN1 BCP20199 [2,0,0,0,0,0|1,0,1]=4 46 B8R1.3 O=C1C=CC(N)=CN1 BCP05414 [2,0,0,0,0,0|1,0,1]=4 47 B8R1.3 OC1=CC=C(Br)C=C1 BCP17755 [2,0,0,0,0,0|1,0,0]=3 48 B8R1.3 OC1=CC=C(I)C=C1 BCP14445 [2,0,0,0,0,0|1,0,0]=3 49 B8R1.3 SC1=CC=C(N)C=C1 BCP18598 [2,0,0,0,0,0|0,1,0]=3 50 B10R1.3 NCC1=CC=C(OC)C=C1 BCP11229 [1,1,0,0,0,0|0,0,0]=2 51 B10R1.3 OCC1=CC=C(C=O)C=C1 BCP07175 [1,1,0,0,0,0|1,0,1]=4 52 B10R1.3 OCc1ccc(cc1)C#C BCP06953 [1,1,0,0,0,0|0,0,2]=4 53 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 BCP07421 [1,1,0,0,0,0|1,0,0]=3 54 B10R1.13 C[C](N)C1=CC=C(F)C=C1 BCP12200 [1,1,0,0,0,0|1,0,1]=4 55 B10R1.13 NC(C1=CC=C(N)C=C1)=N BCP12270 [1,1,0,0,0,0|1,0,1]=4 56 B10R1.13 NC1=NC=C(C=C1)C(C)C BCP00188 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.13 N[C@@H](C)C1=CC=C(Br)C=C1 BCP07969 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.13 N[C](C)C1=CC=C(Br)C=C1 BCP09414 [1,1,0,0,0,0|1,0,1]=4 59 B10R1.13 N[C](C)C1=CC=C(Cl)C=C1 BCP09416 [1,1,0,0,0,0|1,0,1]=4 60 B10R1.13 N[C](C)C=1C=CC(=CC1)F BCP12199 [1,1,0,0,0,0|1,0,1]=4 61 B10R1.13 OC1=CC=C(B(O)O)C=C1 BCP03521 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.13 OC1=CC=C(C(=S)N)C=C1 BCP12826 [1,1,0,0,0,0|0,0,1]=3 63 B10R1.25 CC1=CC(O)=CC=C1C=O BCP10259 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.25 NC1=CC(F)=CC=C1OC BCP05920 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.25 NC1=CC=C(OC)C(F)=C1 BCP05898 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.25 NCC1=CC=C(F)C=C1F BCP12876 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.25 O=CC1=CC=C(O)C=C1Cl BCP16836 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.25 OC1=CC(Br)=CC=C1OC BCP13373 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.25 OCC1=CC=C(Br)C=C1Br BCP17133 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.176 CC1=C(C)C=C(CN)C=C1 BCP18640 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.176 COC1=CC(N)=C(C)C=C1 BCP05922 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.176 COC1=CC=C(Cl)C(O)=C1 BCP11272 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.176 O=CC1=CC(O)=C(O)C=C1 BCP00880 [1,1,0,0,0,0|1,0,1]=4 74 B10R1.15 OC(CN)C1=CC=CN=C1 BCP11465 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.17 CNCCC1=CC=CC=N1 BCP13129 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.17 CNCCC1=CC=CC=N1 BCP13779 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.17 CNCCC1=NC=CC=C1 BCP16849 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [1,1,0,0,0,0|0,0,1]=3 79 B12R1.16 OC(CNC)C1=CC=C(O)C=C1 BCP13680 [0,2,0,0,0,0|0,0,0]=2 80 B12R1.49 O=C(CC)NC1=CC=C(O)C=C1 BCP10463 [0,2,0,0,0,0|1,0,1]=4 81 B12R1.69 OC1=CC(O)=CC=C1CCCC BCP08128 [0,2,0,0,0,0|1,0,0]=3 82 B12R1.19 OC1=CC(CC(C)=O)=CC=C1O BCP28119 [0,2,0,0,0,0|1,0,1]=4 83 B12R1.5 CCC(C1=CC=C(OC)C=C1)=O BCP14923 [0,2,0,0,0,0|1,0,1]=4 84 B12R1.5 COC1=CC=C([C@@H](O)CCl)C=C1 BCP12169 [0,2,0,0,0,0|1,0,0]=3 85 B12R1.367 OC(CN)C1=CC=C(O)C(O)=C1 BCP13658 [0,2,0,0,0,0|0,0,0]=2 86 B12R1.367 OC1=C(O)C=CC(C(CN)O)=C1 BCP04226 [0,2,0,0,0,0|0,0,0]=2 87 B12R1.367 OC1=C(O)C=CC(C(CN)O)=C1 BCP04227 [0,2,0,0,0,0|0,0,0]=2 88 B12R1.367 OC1=CC=C([C@@H](O)CN)C=C1O BCP13659 [0,2,0,0,0,0|0,0,0]=2 89 B12R1.1123 OC1=CC(CCN)=C(O)C=C1O BCP18603 [0,2,0,0,0,0|0,0,0]=2 90 B12R1.113 CC(C1=CC=C(CCBr)C=C1)=O BCP17023 [0,2,0,0,0,0|1,0,1]=4 91 B12R1.113 NCCC1=CC=C([N+]([O-])=O)C=C1 BCP10667 [0,2,0,0,0,0|0,0,1]=3 92 B12R1.113 NCCC1=CC=C([N+]([O-])=O)C=C1 BCP14535 [0,2,0,0,0,0|0,0,1]=3 93 B12R1.113 O=[N+](C1=CC=C(CCBr)C=C1)[O-] BCP16990 [0,2,0,0,0,0|1,0,1]=4 94 B12R1.113 O=[N+]([O-])C1=CC=C(CCO)C=C1 BCP04523 [0,2,0,0,0,0|1,0,1]=4 95 B10R2.6 [C]1(C2=CC=CC=C2)OC1 BCP14534 [1,0,0,1,0,0|1,0,1]=4 96 B10R2.7 C12=C(CNC1)C=CC=C2 BCP01139 [1,0,0,1,0,0|2,0,0]=4 97 B10R2.7 C12=C(CNC1)C=CC=C2 BCP15681 [1,0,0,1,0,0|2,0,0]=4 98 B10R2.7 C12=C(NC=C1)C=CC=C2 BCP29310 [1,0,0,1,0,0|0,0,2]=4 99 B10R2.7 C=12C=CC=CC1OCO2 BCP11873 [1,0,0,1,0,0|2,0,0]=4 100 B10R2.7 c1cnc2c(c1)CCC2 BCP01061 [1,0,0,1,0,0|2,0,0]=4 101 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 BCP10139 [0,1,0,1,0,0|1,0,0]=3 102 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 BCP07129 [0,1,0,1,0,0|2,0,0]=4 103 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 BCP10140 [0,1,0,1,0,0|2,0,0]=4 104 B12R2.24 BrC1=CC=C2OCCNC2=C1 BCP10058 [0,1,0,1,0,0|1,0,0]=3 105 B12R2.24 C1=C2COCCC2=CC(=C1)Br BCP08491 [0,1,0,1,0,0|2,0,0]=4 106 B12R2.24 OC1=CC2=C(C=C1)OCCO2 BCP02986 [0,1,0,1,0,0|1,0,0]=3 107 B12R2.24 OC1=CC=2NCCCC2C=C1 BCP13852 [0,1,0,1,0,0|0,0,0]=2 108 B12R2.24 OC1=CC=C2CCCCC2=C1 BCP20248 [0,1,0,1,0,0|1,0,0]=3 109 B12R2.132 O=C1C2=C(CC1)C=CC(F)=C2 BCP04453 [0,1,0,1,0,0|2,0,0]=4 110 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 BCP16277 [0,1,0,1,0,0|2,0,0]=4 111 B12R2.606 NC1Cc2c(C1)cc(cc2)Br BCP05915 [0,1,0,1,0,0|1,0,0]=3 112 B12R2.44 OCC1=CC=C2OCCC2=C1 BCP14015 [0,1,0,1,0,0|2,0,0]=4 113 B12R2.100 OC1=CC=2C=CNC2C=C1O BCP02562 [0,1,0,1,0,0|0,0,2]=4 114 B8R1.1 NCC1=CC(O)=NO1 BCP02327 [1,0,0,0,1,0|2,0,0]=4 115 B8R1.8 NCCC1=CN=CN1 BCP16313 [1,0,0,0,1,0|2,0,0]=4