0 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 BCP07421 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.13 C[C](N)C1=CC=C(F)C=C1 BCP12200 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 Cc1ccc(cn1)B(O)O BCP03648 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 Cc1ccc(nc1)[N+](=O)[O-] BCP10982 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 NC(C1=CC=C(N)C=C1)=N BCP12270 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.13 NC1=NC=C(C=C1)C(C)C BCP00188 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 N[C@@H](C)C1=CC=C(Br)C=C1 BCP07969 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.13 N[C](C)C1=CC=C(Br)C=C1 BCP09414 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.13 N[C](C)C1=CC=C(Cl)C=C1 BCP09416 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.13 N[C](C)C=1C=CC(=CC1)F BCP12199 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.13 O=C(C)C1=CC=C(Cl)N=C1 BCP13928 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 O=[N+](C1=CC=C(I)C=C1)[O-] BCP14439 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.13 O=[N+]([O-])C1=CC=C(N)C=C1 BCP10655 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.13 OB(O)C1=CC=C(S)C=C1 BCP06691 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.13 OC1=CC=C(B(O)O)C=C1 BCP03521 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.13 OC1=CC=C(C(=S)N)C=C1 BCP12826 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.1 CC1=CC=C(C=N1)C=O BCP04829 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.1 COC1=CN=C(Br)C=C1 BCP04838 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 ClC1=CC=C(CN)C=N1 BCP19252 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.1 FC1=CC=C([Mg]Br)C=C1 BCP08644 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 NC1=CC=C(C#N)C=C1 BCP04531 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.1 NCC1=NC=C(C)N=C1 BCP14024 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.1 O=CC1=CC=C(I)C=C1 BCP05912 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.1 OCC1=CC=C(C)N=C1 BCP15437 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.1 OCC1=CC=C(S)C=C1 BCP18396 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.6 N[C](C)C1=CC=CC=C1 BCP13697 [1,0,0,0,0,0|1,0,1]=3 26 B9R1.6 O[C](C)C1=NC=CC=C1 BCP18401 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O BCP08093 [0,1,0,0,0,0|1,0,1]=3 28 B11R1.3 CC(C1=CC=C(SC)C=C1)=O BCP20233 [0,1,0,0,0,0|1,0,1]=3 29 B11R1.3 CNC1=CC=C([N+]([O-])=O)C=C1 BCP04516 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.3 N#CC1=CC=C(C=C1)[C](C)N BCP09898 [0,1,0,0,0,0|1,0,2]=4 31 B11R1.3 NC(C1=CC=C(CN)C=C1)=N BCP04219 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.3 N[C](C)C1=CC=C(OC)C=C1 BCP12189 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 BCP15778 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.3 OB(C1=CC=C(OC)C=C1)O BCP03522 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O BCP08001 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.19 CC1=CC=C(S(=O)(O)=O)C=C1 BCP19430 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.19 C[Si](C1=NC=C(Br)C=C1)(C)C BCP04665 [0,1,0,0,0,0|2,1,0]=4 38 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O BCP10390 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O BCP14881 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O BCP01685 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.21 CC(C1=CC=C(F)C(N)=C1)=O BCP10115 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.21 NC(C1=CC(N)=C(C)C=C1)=O BCP14925 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.21 O=C(Cl)C1=CC(I)=C(C)C=C1 BCP07666 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.21 O=C(O)C1=CC=C(C)C(I)=C1 BCP15174 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.22 BrC1=CC=C(C(CN)=O)C=C1 BCP24959 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.22 FC1=CC=C([C](CCl)O)C=C1 BCP12170 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.166 Brc1ccc(c(c1)O)C(=O)C BCP18244 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.166 Cc1ccc(c(c1)F)B(O)O BCP18410 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.166 ClC1=C(B(O)O)C=CC(C)=C1 BCP13673 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.166 FC1=C(C(O)=O)C=CC(C)=C1 BCP09722 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.166 FC1=C([C@@H](C)N)C=CC(F)=C1 BCP07396 [0,1,0,0,0,0|2,0,0]=3 52 B11R2.34 FC1=CC=C([C@@H]2OC2)C=C1 BCP13087 [0,0,0,1,0,0|2,0,0]=3 53 B11R2.34 FC1=CC=C([C]2OC2)C=C1 BCP12175 [0,0,0,1,0,0|2,0,1]=4 54 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [0,0,0,0,0,1|2,0,1]=4 55 B8R1.2 NCC1=CC=CN=C1 BCP13872 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.2 OCC1=CC=CN=C1 BCP20084 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.2 [Na]SC1=CC=CC=C1 BCP14418 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.3 BrC1=CN=C(C)C=C1 BCP13752 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.3 CC1=CC=C(Cl)N=C1 BCP19250 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.3 CC1=CN=C(C)C=N1 BCP08618 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.3 FC1=CC=C(C)N=C1 BCP05119 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.3 NC1=CC=C(C)N=C1 BCP05413 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.3 NC=1C=CC(=CN1)C BCP16835 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.3 O=C1C=CC(C)=CN1 BCP20199 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.3 OC1=CC=C(Br)C=C1 BCP17755 [2,0,0,0,0,0|2,0,0]=4 66 B8R1.3 OC1=CC=C(I)C=C1 BCP14445 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.3 SC1=CC=C(N)C=C1 BCP18598 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.1 ClC1=CC=C(CCBr)C=C1 BCP09513 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.1 FC1=CC=C(CCBr)C=C1 BCP15339 [1,1,0,0,0,0|1,0,0]=3 70 B10R1.3 NCC1=CC=C(OC)C=C1 BCP11229 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.3 OCC1=CC=C(C=O)C=C1 BCP07175 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.3 OCc1ccc(cc1)C#C BCP06953 [1,1,0,0,0,0|0,0,2]=4 73 B10R1.25 NC1=CC(F)=CC=C1OC BCP05920 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.25 NC1=CC=C(OC)C(F)=C1 BCP05898 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.25 NCC1=CC=C(F)C=C1F BCP12876 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.25 OC1=CC(Br)=CC=C1OC BCP13373 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.25 OCC1=CC=C(Br)C=C1Br BCP17133 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.176 CC1=C(C)C=C(CN)C=C1 BCP18640 [1,1,0,0,0,0|1,0,0]=3 79 B10R1.176 COC1=CC(N)=C(C)C=C1 BCP05922 [1,1,0,0,0,0|1,0,0]=3 80 B10R1.176 COC1=CC=C(Cl)C(O)=C1 BCP11272 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.15 OC(CN)C1=CC=CN=C1 BCP11465 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.61 CN(C)C1=CC=CC=C1Br BCP05527 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.61 C[C](N)C1=CC=CC=C1Br BCP20468 [1,1,0,0,0,0|1,0,1]=4 84 B10R1.61 FC1=C(C(C)O)N=CC=C1 BCP06886 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.61 FC1=C([C@@H](O)C)C=CC=C1 BCP12488 [1,1,0,0,0,0|1,0,0]=3 86 B10R1.113 N[C@@H](C)C1=CC(Br)=CC=C1 BCP09419 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.113 N[C@@H](C)C1=CC(F)=CC=C1 BCP09418 [1,1,0,0,0,0|1,0,0]=3 88 B10R1.113 N[C](C)C1=CC(F)=CC=C1 BCP09417 [1,1,0,0,0,0|1,0,1]=4 89 B12R1.5 CCC(C1=CC=C(OC)C=C1)=O BCP14923 [0,2,0,0,0,0|1,0,1]=4 90 B12R1.5 COC1=CC=C([C@@H](O)CCl)C=C1 BCP12169 [0,2,0,0,0,0|1,0,0]=3 91 B12R1.5 NCc1ccc(cc1)C(=O)OC BCP15634 [0,2,0,0,0,0|1,0,1]=4 92 B12R1.5 O=C(OC)C1=CC=C(CCl)C=C1 BCP11096 [0,2,0,0,0,0|1,0,1]=4 93 B12R1.113 CC(C1=CC=C(CCBr)C=C1)=O BCP17023 [0,2,0,0,0,0|1,0,1]=4 94 B12R1.256 C[C@@H](N)C1=CC=C([N+]([O-])=O)C=C1 BCP09415 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.256 N[C@@H](C)C1=CC=C(C=C1)N(C)C BCP14799 [0,2,0,0,0,0|1,0,0]=3 96 B12R1.126 CC(C)(C)C1=C(C=C(C=C1)N)O BCP29444 [0,2,0,0,0,0|1,0,0]=3 97 B12R1.232 O=C1C(C)=CC(C(C(C)C)=C1)=O BCP16946 [0,2,0,0,0,0|0,0,0]=2 98 B12R1.367 OC(CN)C1=CC=C(O)C(O)=C1 BCP13658 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.367 OC1=C(O)C=CC(C(CN)O)=C1 BCP04226 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.367 OC1=C(O)C=CC(C(CN)O)=C1 BCP04227 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.367 OC1=CC=C([C@@H](O)CN)C=C1O BCP13659 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.16 OC(CNC)C1=CC=C(O)C=C1 BCP13680 [0,2,0,0,0,0|2,0,0]=4 103 B10R2.6 [C]1(C2=CC=CC=C2)OC1 BCP14534 [1,0,0,1,0,0|1,0,1]=4 104 B12R2.606 NC1Cc2c(C1)cc(cc2)Br BCP05915 [0,0,0,1,0,1|2,0,0]=4 105 B12R2.612 C[C]1NCC2=C1C=CC(Br)=C2 BCP17553 [0,1,0,1,0,0|1,0,1]=4 106 B12R2.612 Cc1ccc2c(c1)CCC2=O BCP09170 [0,1,0,1,0,0|1,0,1]=4 107 B8R1.1 C[N+]1=CN(CC)C=C1 BCP15816 [1,0,0,0,1,0|2,0,0]=4 108 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [1,0,0,0,0,1|1,0,1]=4